*HEADER    CELL ADHESION                           26-AUG-19   6U4N              
*TITLE     SOLUTION STRUCTURE OF PAXILLIN LIM4 IN COMPLEX WITH KINDLIN-2 F0      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FERMITIN FAMILY HOMOLOG 2;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: KINDLIN-2,MITOGEN-INDUCIBLE GENE 2 PROTEIN,MIG-2,PLECKSTRIN 
*COMPND   5 HOMOLOGY DOMAIN-CONTAINING FAMILY C MEMBER 1,PH DOMAIN-CONTAINING    
*COMPND   6 FAMILY C MEMBER 1;                                                   
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: PAXILLIN;                                                  
*COMPND  10 CHAIN: B;                                                            
*COMPND  11 FRAGMENT: LIM4 DOMAIN RESIDUES 527-591;                              
*COMPND  12 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: FERMT2, KIND2, MIG2, PLEKHC1;                                  
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PGST-1;                                   
*SOURCE  11 MOL_ID: 2;                                                           
*SOURCE  12 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE  13 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  14 ORGANISM_TAXID: 9606;                                                
*SOURCE  15 GENE: PXN;                                                           
*SOURCE  16 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE  17 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE  18 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE  19 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  20 EXPRESSION_SYSTEM_PLASMID: PGST-1                                    
*KEYWDS    LIM DOMAIN, ZINC FINGER, UBIQUITIN FOLD, COMPLEX, CELL ADHESION       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    L.ZHU,J.QIN                                                           
*REVDAT   1   23-OCT-19 6U4N    0                                                
# Restraints file 1: k2f0c-restrants-submit-4th.xtb
! Editing history: apply residue index offset (-7) on Thu Jul 18 15:24:35 EDT 2019
!@ BEGIN_XPLR_NOE_FILE

! M1
assign (resid   1 and name   HA) (resid   1 and name  HG2)  2.5  0.7  0.2 ! A.2    at -4.52e+07
assign (resid   1 and name  HB1) (resid   2 and name   HN)  2.5  0.7  0.4 ! A.10   at  4.66e+07
assign (resid   1 and name  HB2) (resid   2 and name   HN)  3.0  1.2  0.5 ! A.11   at  2.59e+07
assign (resid   1 and name  HG1) (resid   2 and name   HN)  3.0  1.2  0.5 ! A.12   at  7.99e+06
assign (resid   1 and name  HG2) (resid   2 and name   HN)  3.0  1.2  0.5 ! A.13   at  1.01e+07
assign (resid   1 and name  HB1) (resid   3 and name   HN)  3.0  1.2  0.5 ! A.35   at  1.32e+07

! A2
assign (resid   2 and name   HN) (resid   2 and name  HB#)  2.5  0.7  0.9 ! A.15   at  2.21e+08
assign (resid   2 and name   HN) (resid   3 and name  HB2)  3.0  1.2  0.5 ! A.16   at  6.05e+06
assign (resid   2 and name   HA) (resid   3 and name   HN)  2.5  0.7  1.0 ! A.36   at  3.22e+08
assign (resid   2 and name  HB#) (resid   3 and name   HN)  2.5  0.7  0.9 ! A.37   at  7.74e+07
assign (resid   2 and name  HB#) (resid   4 and name   HN)  3.0  1.2  1.8 ! A.52   at  2.16e+07

! L3
assign (resid   3 and name   HN) (resid   3 and name  HB1)  2.5  0.7  1.2 ! A.39   at  2.68e+08
assign (resid   3 and name   HN) (resid   3 and name  HB2)  2.5  0.7  0.4 ! A.40   at  2.94e+08
assign (resid   3 and name   HN) (resid   3 and name HD1#)  2.5  0.7  0.9 ! A.41   at  5.18e+07
assign (resid   3 and name   HN) (resid   3 and name HD2#)  2.5  0.7  0.9 ! A.42   at  5.18e+07
assign (resid   3 and name   HA) (resid   3 and name   HG)  2.5  0.7  0.2 ! A.20   at -2.59e+08
assign (resid   3 and name   HA) (resid   3 and name HD1#)  2.5  0.7  1.3 ! A.18   at -1.92e+08
assign (resid   3 and name   HA) (resid   3 and name HD2#)  2.5  0.7  0.7 ! A.19   at -1.92e+08
assign (resid   3 and name  HB1) (resid   3 and name HD1#)  2.5  0.7  0.7 ! A.23   at -8.10e+07
assign (resid   3 and name  HB1) (resid   3 and name HD2#)  2.5  0.7  0.7 ! A.25   at -8.10e+07
assign (resid   3 and name  HB2) (resid   3 and name HD1#)  2.5  0.7  0.7 ! A.24   at -1.38e+08
assign (resid   3 and name  HB2) (resid   3 and name HD2#)  2.5  0.7  0.7 ! A.26   at -1.49e+08
assign (resid   3 and name   HG) (resid   3 and name   HN)  2.5  0.7  0.4 ! A.34   at -3.78e+07
assign (resid   3 and name   HN) (resid   4 and name  HB1)  4.0  2.2  1.0 ! A.43   at  1.14e+07
assign (resid   3 and name   HA) (resid   4 and name   HN)  2.5  0.7  1.0 ! A.53   at  1.69e+08
assign (resid   3 and name  HB1) (resid   4 and name   HN)  2.5  0.7  0.4 ! A.54   at  7.67e+07
assign (resid   3 and name  HB2) (resid   4 and name   HN)  2.5  0.7  0.4 ! A.55   at  7.25e+07
assign (resid   3 and name HD1#) (resid   4 and name   HN)  3.0  1.2  1.0 ! A.56   at  2.48e+07
assign (resid   3 and name HD2#) (resid   4 and name   HN)  3.0  1.2  1.0 ! A.57   at  2.48e+07
assign (resid   3 and name  HB1) (resid   4 and name   HA)  3.0  1.2  1.1 ! A.44   at -9.09e+06
assign (resid   3 and name  HB2) (resid   4 and name   HA)  3.0  1.2  1.0 ! A.45   at -9.09e+06
assign (resid   3 and name   HA) (resid   5 and name   HN)  3.0  1.2  0.5 ! A.70   at  1.90e+07
assign (resid   3 and name HD1#) (resid   5 and name   HN)  3.0  1.2  1.5 ! A.71   at  1.34e+07

! D4
assign (resid   4 and name   HN) (resid   4 and name  HB1)  2.5  0.7  0.8 ! A.59   at  1.30e+08
assign (resid   4 and name   HN) (resid   5 and name  HA1)  4.0  2.2  1.1 ! A.60   at  9.90e+06
assign (resid   4 and name   HA) (resid   5 and name   HN)  2.5  0.7  0.8 ! A.72   at  1.34e+08
assign (resid   4 and name  HB1) (resid   5 and name   HN)  2.5  0.7  1.2 ! A.73   at  5.56e+07
assign (resid   4 and name   HA) (resid   5 and name  HA1)  4.0  2.2  1.0 ! A.61   at -8.48e+06
assign (resid   4 and name  HB1) (resid   5 and name  HA1)  4.0  2.2  1.5 ! A.62   at -3.32e+06
assign (resid   4 and name   HA) (resid   6 and name   HN)  3.0  1.2  1.3 ! A.49   at -9.86e+06
assign (resid   4 and name   HA) (resid   6 and name HD1#)  3.0  1.2  0.8 ! A.48   at -1.04e+07
assign (resid   4 and name  HB1) (resid   6 and name   HN)  3.0  1.2  1.9 ! A.118  at  1.26e+07

! G5
assign (resid   5 and name   HN) (resid   6 and name   HB)  4.0  2.2  1.5 ! A.75   at  1.12e+07
assign (resid   5 and name   HN) (resid   6 and name   HN)  2.5  0.7  0.4 ! A.79   at  6.81e+07
assign (resid   5 and name   HN) (resid   6 and name HD1#)  3.0  1.2  1.0 ! A.76   at  1.34e+07
assign (resid   5 and name   HN) (resid   6 and name HG11)  4.0  2.2  1.0 ! A.77   at  2.56e+07
assign (resid   5 and name   HN) (resid   6 and name HG12)  3.0  1.2  0.5 ! A.78   at  4.87e+06
assign (resid   5 and name  HA1) (resid   6 and name   HB)  4.0  2.2  2.0 ! A.64   at -6.20e+06
assign (resid   5 and name  HA1) (resid   6 and name   HN)  2.5  0.7  0.4 ! A.69   at -5.00e+07
assign (resid   5 and name  HA1) (resid   6 and name HD1#)  3.0  1.2  0.8 ! A.65   at -1.03e+07
assign (resid   5 and name  HA1) (resid   6 and name HG11)  4.0  2.2  1.5 ! A.66   at -1.10e+07
assign (resid   5 and name  HA1) (resid   6 and name HG12)  3.0  1.2  1.4 ! A.67   at -4.36e+06
assign (resid   5 and name  HA1) (resid   6 and name HG2#)  3.0  1.2  1.3 ! A.68   at -1.03e+07

! I6
assign (resid   6 and name   HN) (resid   6 and name   HB)  2.5  0.7  1.0 ! A.122  at  1.83e+08
assign (resid   6 and name   HN) (resid   6 and name HD1#)  2.5  0.7  0.9 ! A.123  at  8.60e+07
assign (resid   6 and name   HN) (resid   6 and name HG11)  2.5  0.7  0.9 ! A.124  at  1.09e+08
assign (resid   6 and name   HN) (resid   6 and name HG12)  2.5  0.7  0.4 ! A.125  at  8.80e+07
assign (resid   6 and name   HN) (resid   6 and name HG2#)  2.5  0.7  0.9 ! A.126  at  8.60e+07
assign (resid   6 and name   HA) (resid   6 and name HD1#)  2.5  0.7  0.7 ! A.81   at -7.05e+07
assign (resid   6 and name   HA) (resid   6 and name HG11)  3.0  1.2  1.2 ! A.82   at -2.57e+07
assign (resid   6 and name   HA) (resid   6 and name HG12)  3.0  1.2  0.7 ! A.83   at -2.46e+07
assign (resid   6 and name   HA) (resid   6 and name HG2#)  2.5  0.7  0.7 ! A.84   at -7.05e+07
assign (resid   6 and name   HB) (resid   6 and name HD1#)  2.5  0.7  0.7 ! A.89   at -9.32e+07
assign (resid   6 and name   HN) (resid   7 and name   HN)  2.5  0.7  0.9 ! A.128  at  4.02e+07
assign (resid   6 and name   HN) (resid   7 and name  HD1)  4.0  2.2  1.2 ! A.127  at  8.35e+06
assign (resid   6 and name   HA) (resid   7 and name   HN)  2.5  0.7  1.0 ! A.87   at -9.97e+07
assign (resid   6 and name   HA) (resid   7 and name  HB1)  3.0  1.2  1.7 ! A.86   at -9.39e+06
assign (resid   6 and name   HB) (resid   7 and name   HN)  3.0  1.2  0.5 ! A.94   at -1.39e+07
assign (resid   6 and name HG11) (resid   7 and name   HN)  3.0  1.2  0.5 ! A.110  at -8.33e+06
assign (resid   6 and name HG12) (resid   7 and name   HN)  3.0  1.2  0.5 ! A.111  at -3.79e+06
assign (resid   6 and name HG2#) (resid   7 and name   HN)  2.5  0.7  0.9 ! A.116  at -3.57e+07
assign (resid   6 and name HG2#) (resid   8 and name   HN)  4.0  2.2  1.6 ! A.174  at  5.37e+06
assign (resid   6 and name HG11) (resid  11 and name   HN)  3.0  1.2  1.3 ! A.242  at  7.13e+06
assign (resid   6 and name HG12) (resid  11 and name   HN)  4.0  2.2  1.0 ! A.243  at  2.20e+06
assign (resid   6 and name HG11) (resid  11 and name  HA1)  4.0  2.2  1.0 ! A.228  at -2.87e+06
assign (resid   6 and name HG11) (resid  11 and name  HA2)  4.0  2.2  1.0 ! A.229  at -3.18e+06
assign (resid   6 and name HG11) (resid  12 and name   HN)  4.0  2.2  1.0 ! A.261  at  6.60e+06

! R7
assign (resid   7 and name   HN) (resid   7 and name  HB1)  2.5  0.7  0.9 ! A.154  at  5.36e+07
assign (resid   7 and name   HN) (resid   7 and name  HB2)  2.5  0.7  1.4 ! A.155  at  5.36e+07
assign (resid   7 and name   HN) (resid   7 and name  HD1)  3.0  1.2  0.5 ! A.156  at  5.49e+06
assign (resid   7 and name   HN) (resid   7 and name  HG1)  3.0  1.2  1.1 ! A.157  at  1.95e+07
assign (resid   7 and name   HA) (resid   7 and name  HD1)  3.0  1.2  0.8 ! A.129  at -1.55e+07
assign (resid   7 and name  HB1) (resid   7 and name  HD1)  3.0  1.2  0.3 ! A.132  at -2.33e+07
assign (resid   7 and name  HB2) (resid   7 and name  HD1)  3.0  1.2  0.7 ! A.133  at -1.68e+07
assign (resid   7 and name  HG1) (resid   7 and name   HA)  3.0  1.2  1.3 ! A.145  at -3.01e+07
assign (resid   7 and name   HN) (resid   8 and name  HB1)  4.0  2.2  2.2 ! A.158  at  3.71e+06
assign (resid   7 and name   HN) (resid   8 and name  HG2)  4.0  2.2  1.0 ! A.159  at  2.25e+06
assign (resid   7 and name  HB1) (resid   8 and name  HG2)  3.0  1.2  1.4 ! A.138  at -3.57e+06
assign (resid   7 and name  HB2) (resid   8 and name  HG2)  3.0  1.2  0.3 ! A.139  at -5.30e+06
assign (resid   7 and name  HB1) (resid   8 and name   HN)  2.5  0.7  0.9 ! A.175  at  3.80e+07
assign (resid   7 and name  HB2) (resid   8 and name   HN)  2.5  0.7  0.4 ! A.176  at  3.80e+07
assign (resid   7 and name  HD1) (resid   8 and name   HN)  3.0  1.2  1.0 ! A.177  at  1.02e+07
assign (resid   7 and name  HG1) (resid   8 and name   HN)  2.5  0.7  0.4 ! A.178  at  3.38e+07
assign (resid   7 and name  HG1) (resid   8 and name  HG1)  3.0  1.2  0.3 ! A.164  at -8.00e+06
assign (resid   7 and name  HB1) (resid  11 and name   HN)  4.0  2.2  1.3 ! A.244  at  6.48e+06
assign (resid   7 and name  HD1) (resid  11 and name  HA1)  3.0  1.2  2.0 ! A.231  at -4.19e+06
assign (resid   7 and name  HB1) (resid  11 and name  HA2)  4.0  2.2  2.7 ! A.230  at -2.69e+06

! M8
assign (resid   8 and name   HN) (resid   8 and name  HB1)  2.5  0.7  1.4 ! A.180  at  9.50e+07
assign (resid   8 and name   HN) (resid   8 and name  HG1)  3.0  1.2  0.5 ! A.181  at  2.37e+07
assign (resid   8 and name   HN) (resid   8 and name  HG2)  2.5  0.7  0.4 ! A.182  at  4.03e+07
assign (resid   8 and name   HA) (resid   8 and name  HG2)  3.0  1.2  0.3 ! A.161  at -5.42e+06
assign (resid   8 and name  HG1) (resid   8 and name   HA)  3.0  1.2  0.7 ! A.165  at -1.33e+07
assign (resid   8 and name   HN) (resid   9 and name  HD1)  3.0  1.2  0.5 ! A.183  at  1.12e+07
assign (resid   8 and name   HN) (resid   9 and name  HD2)  3.0  1.2  0.5 ! A.184  at  8.84e+06
assign (resid   8 and name  HG1) (resid   9 and name  HD1)  3.0  1.2  0.3 ! A.171  at -5.89e+06
assign (resid   8 and name  HG1) (resid   9 and name  HD2)  3.0  1.2  0.3 ! A.173  at -4.83e+06
assign (resid   8 and name  HG2) (resid   9 and name  HD1)  3.0  1.2  0.6 ! A.172  at -7.70e+06
assign (resid   8 and name   HN) (resid   9 and name  HB2)  4.0  2.2  1.2 ! A.191  at -7.43e+06
assign (resid   8 and name   HN) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.185  at  4.71e+06
assign (resid   8 and name  HG1) (resid  11 and name  HA1)  4.0  2.2  2.1 ! A.232  at -3.06e+06
!assign (resid   8 and name   HN) (resid  12 and name   HN)  3.0  1.2  0.8 ! A.186  at  9.27e+06
!assign (resid   8 and name  HG1) (resid  12 and name   HN)  4.0  2.2  1.3 ! A.262  at  1.04e+07
assign (resid   8 and name   HA) (resid  12 and name  HB1)  3.0  1.2  0.3 ! A.255  at -5.39e+06

! P9
assign (resid   9 and name   HA) (resid   9 and name  HD1)  3.0  1.2  0.7 ! A.189  at -8.85e+06
assign (resid   9 and name  HB2) (resid   9 and name  HD1)  3.0  1.2  0.7 ! A.195  at -2.04e+07
assign (resid   9 and name  HD2) (resid   9 and name   HA)  3.0  1.2  0.9 ! A.201  at -4.88e+06
assign (resid   9 and name  HG1) (resid   9 and name   HA)  2.5  0.7  0.2 ! A.206  at -3.50e+07
assign (resid   9 and name   HA) (resid  10 and name   HN)  2.5  0.7  0.9 ! A.190  at -4.19e+07
assign (resid   9 and name  HB2) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.196  at -8.11e+06
assign (resid   9 and name  HD1) (resid  10 and name   HN)  3.0  1.2  0.8 ! A.204  at -5.71e+06
assign (resid   9 and name  HD2) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.205  at -3.46e+06
assign (resid   9 and name  HB1) (resid  10 and name   HN)  3.0  1.2  1.2 ! A.219  at  1.78e+07
assign (resid   9 and name  HG1) (resid  10 and name   HN)  3.0  1.2  1.4 ! A.223  at  4.36e+07
assign (resid   9 and name  HG1) (resid  11 and name   HN)  4.0  2.2  2.1 ! A.245  at  1.77e+07
!assign (resid   9 and name  HG1) (resid  11 and name  HA2)  4.0  2.2  2.4 ! A.233  at -2.19e+06
!assign (resid   9 and name  HG1) (resid  12 and name   HN)  4.0  2.2  2.1 ! A.263  at  3.61e+07
!assign (resid   9 and name  HG1) (resid  12 and name  HB1)  4.0  2.2  1.4 ! A.256  at -7.74e+06
assign (resid   9 and name  HG1) (resid  13 and name   HN)  4.0  2.2  1.7 ! A.275  at  2.71e+06

! D10
assign (resid  10 and name   HN) (resid  10 and name  HB1)  2.5  0.7  0.4 ! A.225  at  2.91e+07
assign (resid  10 and name   HN) (resid  10 and name  HB2)  2.5  0.7  0.4 ! A.226  at  4.25e+07
assign (resid  10 and name   HN) (resid  11 and name   HN)  2.5  0.7  0.4 ! A.227  at  2.82e+07
assign (resid  10 and name   HA) (resid  11 and name   HN)  2.5  0.7  0.9 ! A.214  at -4.26e+07
assign (resid  10 and name   HA) (resid  11 and name  HA2)  3.0  1.2  1.7 ! A.213  at -1.01e+07
assign (resid  10 and name  HB1) (resid  11 and name  HA1)  3.0  1.2  1.5 ! A.217  at -5.01e+06
assign (resid  10 and name  HB1) (resid  11 and name   HN)  3.0  1.2  0.5 ! A.247  at  2.14e+07
assign (resid  10 and name  HB2) (resid  11 and name   HN)  3.0  1.2  0.8 ! A.248  at  1.92e+07
assign (resid  10 and name   HA) (resid  11 and name  HA1)  4.0  2.2  1.2 ! A.234  at -4.66e+06
assign (resid  10 and name   HA) (resid  12 and name   HN)  3.0  1.2  1.1 ! A.264  at  1.81e+07

! G11
assign (resid  11 and name   HN) (resid  12 and name   HN)  2.5  0.7  0.4 ! A.252  at  3.27e+07
assign (resid  11 and name   HN) (resid  12 and name  HB1)  3.0  1.2  1.5 ! A.251  at  4.69e+06
assign (resid  11 and name  HA1) (resid  12 and name   HN)  2.5  0.7  0.8 ! A.265  at  3.07e+07
assign (resid  11 and name  HA2) (resid  12 and name   HN)  2.5  0.7  1.0 ! A.266  at  4.08e+07

! C12
assign (resid  12 and name   HN) (resid  12 and name  HB1)  2.5  0.7  0.4 ! A.269  at  9.99e+07
assign (resid  12 and name   HN) (resid  13 and name   HN)  3.0  1.2  0.5 ! A.270  at  2.02e+07
assign (resid  12 and name   HA) (resid  13 and name   HN)  3.0  1.2  0.5 ! A.254  at -2.78e+07
assign (resid  12 and name  HB1) (resid  13 and name   HN)  3.0  1.2  0.5 ! A.260  at -1.23e+07

! Y13
assign (resid  13 and name   HN) (resid  13 and name  HB1)  3.0  1.2  0.9 ! A.278  at  1.05e+07
assign (resid  13 and name   HN) (resid  13 and name  HB2)  2.5  0.7  0.9 ! A.279  at  4.19e+07
assign (resid  13 and name   HN) (resid  14 and name  HB#)  3.0  1.2  1.6 ! A.280  at  4.48e+06
assign (resid  13 and name   HA) (resid  14 and name   HN)  3.0  1.2  0.5 ! A.290  at  1.09e+07
assign (resid  13 and name  HB1) (resid  14 and name   HN)  3.0  1.2  0.5 ! A.291  at  9.07e+06
assign (resid  13 and name  HB2) (resid  14 and name   HN)  3.0  1.2  0.5 ! A.292  at  7.73e+06
assign (resid  13 and name  HB1) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.341  at  3.58e+06

! A14
assign (resid  14 and name   HN) (resid  14 and name  HB#)  3.0  1.2  1.0 ! A.294  at  2.74e+07
assign (resid  14 and name   HN) (resid  15 and name   HN)  3.0  1.2  0.5 ! A.296  at  4.49e+06
assign (resid  14 and name   HN) (resid  15 and name  HB2)  4.0  2.2  1.0 ! A.295  at  1.79e+06
assign (resid  14 and name   HA) (resid  15 and name   HN)  2.5  0.7  1.0 ! A.307  at  3.26e+07
assign (resid  14 and name  HB#) (resid  15 and name   HN)  2.5  0.7  0.9 ! A.288  at -3.06e+07
assign (resid  14 and name  HB#) (resid  15 and name  HB1)  3.0  1.2  1.3 ! A.286  at -2.02e+07
assign (resid  14 and name  HB#) (resid  15 and name  HB2)  3.0  1.2  0.8 ! A.287  at -1.33e+07
assign (resid  14 and name   HA) (resid  15 and name   HA)  3.0  1.2  1.4 ! A.297  at -8.31e+06
assign (resid  14 and name  HB#) (resid  16 and name   HN)  3.0  1.2  1.0 ! A.289  at -5.20e+06
assign (resid  14 and name   HN) (resid  16 and name   HN)  3.0  1.2  0.5 ! A.323  at  5.70e+06
assign (resid  14 and name  HB#) (resid  17 and name   HN)  4.0  2.2  1.5 ! A.342  at  2.58e+06

! D15
assign (resid  15 and name   HN) (resid  15 and name  HB1)  3.0  1.2  0.5 ! A.311  at  2.77e+07
assign (resid  15 and name   HN) (resid  15 and name  HB2)  3.0  1.2  0.5 ! A.312  at  2.21e+07
assign (resid  15 and name   HN) (resid  16 and name   HN)  2.5  0.7  0.4 ! A.327  at  3.49e+07
assign (resid  15 and name   HN) (resid  16 and name  HA2)  3.0  1.2  1.3 ! A.313  at  4.86e+06
assign (resid  15 and name   HA) (resid  16 and name   HN)  3.0  1.2  0.5 ! A.302  at -9.69e+06
assign (resid  15 and name   HA) (resid  16 and name  HA1)  3.0  1.2  1.9 ! A.301  at -8.31e+06
assign (resid  15 and name  HB1) (resid  16 and name   HN)  3.0  1.2  0.5 ! A.325  at  1.70e+07
assign (resid  15 and name  HB2) (resid  16 and name   HN)  3.0  1.2  1.3 ! A.326  at  9.57e+06
assign (resid  15 and name   HN) (resid  17 and name HG2#)  3.0  1.2  1.0 ! A.315  at  5.18e+06
assign (resid  15 and name   HA) (resid  17 and name   HN)  3.0  1.2  1.9 ! A.343  at  9.84e+06
assign (resid  15 and name  HB1) (resid  17 and name   HN)  3.0  1.2  1.3 ! A.344  at  8.91e+06

! G16
assign (resid  16 and name   HN) (resid  17 and name HG2#)  3.0  1.2  1.0 ! A.330  at  8.45e+06
assign (resid  16 and name  HA1) (resid  17 and name HG2#)  4.0  2.2  1.5 ! A.320  at -3.03e+06
assign (resid  16 and name   HN) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.347  at  1.87e+07
assign (resid  16 and name  HA1) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.345  at  1.40e+07
assign (resid  16 and name  HA2) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.346  at  1.43e+07
assign (resid  16 and name  HA1) (resid  18 and name   HN)  4.0  2.2  1.8 ! A.352  at  3.24e+06
assign (resid  16 and name  HA1) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.321  at -3.50e+06

! T17
assign (resid  17 and name   HN) (resid  17 and name   HB)  3.0  1.2  0.5 ! A.349  at  1.25e+07
assign (resid  17 and name   HN) (resid  17 and name HG2#)  3.0  1.2  1.0 ! A.350  at  2.50e+07
assign (resid  17 and name HG2#) (resid  17 and name   HA)  2.5  0.7  0.7 ! A.336  at -6.94e+07
assign (resid  17 and name   HN) (resid  18 and name   HN)  3.0  1.2  1.3 ! A.351  at  8.50e+06
assign (resid  17 and name   HB) (resid  18 and name   HN)  3.0  1.2  1.4 ! A.333  at -4.03e+06
assign (resid  17 and name HG2#) (resid  18 and name   HN)  3.0  1.2  1.0 ! A.339  at -3.85e+07
assign (resid  17 and name   HA) (resid  18 and name   HN)  3.0  1.2  0.5 ! A.353  at  2.45e+07
assign (resid  17 and name   HB) (resid  34 and name  HD1)  4.0  2.2  1.0 ! A.334  at -1.88e+06
assign (resid  17 and name   HB) (resid  34 and name  HG1)  4.0  2.2  1.0 ! A.335  at -2.66e+06
assign (resid  17 and name HG2#) (resid  34 and name  HG1)  3.0  1.2  0.8 ! A.340  at -2.22e+07
assign (resid  17 and name HG2#) (resid  34 and name  HD2)  3.0  1.2  0.8 ! A.718  at -3.97e+06
assign (resid  17 and name   HA) (resid  36 and name   HN)  4.0  2.2  1.1 ! A.806  at  6.56e+06
assign (resid  17 and name   HA) (resid  36 and name   HA)  4.0  2.2  1.0 ! A.789  at -2.76e+06
assign (resid  17 and name   HA) (resid  36 and name   HB)  3.0  1.2  1.3 ! A.794  at -4.60e+06
assign (resid  17 and name   HA) (resid  36 and name HG2#)  2.5  0.7  0.7 ! A.800  at -6.43e+07
assign (resid  17 and name   HN) (resid  36 and name HG2#)  4.0  2.2  1.5 ! A.801  at -2.98e+06

! W18
assign (resid  18 and name   HN) (resid  18 and name  HB1)  3.0  1.2  0.5 ! A.357  at  3.27e+06
assign (resid  18 and name   HN) (resid  18 and name  HB2)  3.0  1.2  0.5 ! A.358  at  3.71e+06
assign (resid  18 and name   HN) (resid  18 and name  HE1)  4.0  2.2  1.0 ! A.359  at  1.49e+06
assign (resid  18 and name   HN) (resid  19 and name   HN)  3.0  1.2  1.3 ! A.360  at  3.65e+06
assign (resid  18 and name   HA) (resid  19 and name   HN)  3.0  1.2  0.5 ! A.383  at  7.67e+06
assign (resid  18 and name  HB1) (resid  19 and name   HN)  3.0  1.2  1.0 ! A.384  at  4.57e+06
assign (resid  18 and name  HB2) (resid  19 and name   HN)  3.0  1.2  0.5 ! A.385  at  5.98e+06
assign (resid  18 and name  HE1) (resid  20 and name HD2#)  4.0  2.2  2.0 ! A.365  at  2.57e+06
assign (resid  18 and name   HN) (resid  34 and name  HG1)  3.0  1.2  1.6 ! A.361  at  4.33e+06
assign (resid  18 and name   HN) (resid  35 and name HG2#)  3.0  1.2  1.0 ! A.362  at  6.86e+06
assign (resid  18 and name  HE1) (resid  35 and name HG2#)  4.0  2.2  1.5 ! A.366  at  1.80e+06
assign (resid  18 and name   HN) (resid  36 and name HG2#)  3.0  1.2  1.0 ! A.363  at  1.19e+07
assign (resid  18 and name  HE1) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.367  at  4.06e+06
assign (resid  18 and name  HE1) (resid  36 and name   HN)  4.0  2.2  1.0 ! A.807  at  2.20e+06
assign (resid  18 and name  HE1) (resid  36 and name   HA)  4.0  2.2  1.0 ! A.790  at -2.49e+06
assign (resid  18 and name  HE1) (resid  37 and name   HN)  3.0  1.2  0.5 ! A.370  at  4.20e+06
assign (resid  18 and name  HE1) (resid  37 and name  HA1)  3.0  1.2  0.3 ! A.368  at  5.96e+06
assign (resid  18 and name  HE1) (resid  37 and name  HA2)  4.0  2.2  1.0 ! A.369  at  1.95e+06
assign (resid  18 and name  HE1) (resid  38 and name   HN)  4.0  2.2  1.0 ! A.845  at  1.96e+06
assign (resid  18 and name  HE1) (resid  85 and name  HG1)  4.0  2.2  1.0 ! A.371  at  2.27e+06
assign (resid  18 and name  HB1) (resid  86 and name   HN)  3.0  1.2  1.4 ! A.1757 at  3.27e+06
assign (resid  18 and name  HB2) (resid  86 and name   HN)  4.0  2.2  1.0 ! A.1758 at  3.10e+06
assign (resid  18 and name   HA) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1742 at -1.09e+07
assign (resid  18 and name  HB1) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1743 at -1.63e+07
assign (resid  18 and name  HB2) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1744 at -1.62e+07

! E19
assign (resid  19 and name   HN) (resid  19 and name  HB1)  3.0  1.2  0.5 ! A.387  at  5.95e+06
assign (resid  19 and name   HN) (resid  19 and name  HB2)  4.0  2.2  1.0 ! A.388  at  2.88e+06
assign (resid  19 and name   HN) (resid  19 and name  HG1)  4.0  2.2  1.0 ! A.389  at  2.23e+06
assign (resid  19 and name   HN) (resid  19 and name  HG2)  3.0  1.2  0.5 ! A.390  at  5.21e+06
assign (resid  19 and name  HG1) (resid  19 and name   HA)  3.0  1.2  0.3 ! A.373  at -5.67e+06
assign (resid  19 and name  HG1) (resid  32 and name HG2#)  3.0  1.2  1.2 ! A.379  at -6.93e+06
assign (resid  19 and name  HG2) (resid  32 and name HG2#)  2.5  0.7  0.7 ! A.671  at -4.80e+07
assign (resid  19 and name  HB2) (resid  32 and name   HB)  3.0  1.2  0.3 ! A.659  at -5.52e+06
assign (resid  19 and name  HG1) (resid  32 and name   HB)  3.0  1.2  1.6 ! A.660  at -3.27e+06
assign (resid  19 and name  HG2) (resid  32 and name   HB)  3.0  1.2  0.3 ! A.661  at -6.04e+06
assign (resid  19 and name  HB2) (resid  32 and name HG2#)  2.5  0.7  0.7 ! A.669  at -4.03e+07
assign (resid  19 and name  HB2) (resid  33 and name   HN)  4.0  2.2  1.0 ! A.709  at  2.83e+06
assign (resid  19 and name  HG1) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.381  at -4.05e+06
assign (resid  19 and name  HG1) (resid  34 and name  HG1)  4.0  2.2  1.0 ! A.382  at -1.77e+06
assign (resid  19 and name   HA) (resid  34 and name   HN)  3.0  1.2  1.0 ! A.733  at  8.10e+06
assign (resid  19 and name  HB1) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.734  at  2.55e+06
assign (resid  19 and name  HB2) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.735  at  2.24e+06
assign (resid  19 and name   HA) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.777  at  5.17e+06
assign (resid  19 and name  HB1) (resid  35 and name   HN)  4.0  2.2  1.0 ! A.778  at  2.79e+06
assign (resid  19 and name   HA) (resid  35 and name HG2#)  3.0  1.2  0.8 ! A.765  at -5.44e+06
assign (resid  19 and name   HN) (resid  86 and name  HB#)  3.0  1.2  1.0 ! A.391  at  5.23e+06

! L20
assign (resid  20 and name HD2#) (resid  20 and name   HA)  3.0  1.2  0.8 ! A.392  at -8.35e+06
assign (resid  20 and name HD2#) (resid  20 and name   HN)  3.0  1.2  1.0 ! A.396  at -3.29e+06
assign (resid  20 and name HD2#) (resid  20 and name  HB1)  3.0  1.2  0.8 ! A.393  at -1.58e+07
assign (resid  20 and name HD2#) (resid  21 and name   HN)  3.0  1.2  1.5 ! A.397  at -1.02e+07
assign (resid  20 and name   HA) (resid  21 and name   HN)  3.0  1.2  0.5 ! A.412  at  7.19e+06
assign (resid  20 and name   HG) (resid  21 and name   HN)  3.0  1.2  1.6 ! A.416  at  3.88e+06
assign (resid  20 and name  HB1) (resid  21 and name   HN)  4.0  2.2  1.0 ! A.413  at  2.00e+06
assign (resid  20 and name HD1#) (resid  21 and name   HN)  3.0  1.2  1.0 ! A.414  at  3.82e+06
assign (resid  20 and name HD1#) (resid  21 and name  HB1)  3.0  1.2  0.8 ! A.400  at -5.00e+06
assign (resid  20 and name HD2#) (resid  35 and name HG2#)  3.0  1.2  1.3 ! A.398  at -1.08e+07
assign (resid  20 and name  HB2) (resid  35 and name HG2#)  3.0  1.2  0.8 ! A.766  at -1.02e+07
assign (resid  20 and name HD1#) (resid  85 and name   HN)  3.0  1.2  1.0 ! A.1718 at  4.76e+06
assign (resid  20 and name HD2#) (resid  86 and name   HA)  3.0  1.2  0.8 ! A.399  at -6.81e+06
assign (resid  20 and name   HA) (resid  86 and name   HA)  4.0  2.2  1.0 ! A.1739 at -2.04e+06
assign (resid  20 and name   HA) (resid  86 and name  HB#)  4.0  2.2  2.5 ! A.1747 at  3.25e+05
assign (resid  20 and name HD2#) (resid  86 and name  HB#)  3.0  1.2  1.3 ! A.1748 at -8.58e+06
assign (resid  20 and name HD1#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1783 at  1.04e+07
assign (resid  20 and name HD2#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1784 at  9.54e+06
assign (resid  20 and name HD1#) (resid  88 and name  HB#)  2.5  0.7  1.2 ! A.1772 at -3.20e+07
assign (resid  20 and name   HG) (resid  90 and name   HN)  3.0  1.2  2.0 ! A.1844 at  8.07e+06
assign (resid  20 and name HD1#) (resid  90 and name   HN)  3.0  1.2  1.0 ! A.1843 at  3.85e+06
assign (resid  20 and name HD1#) (resid  90 and name HD1#)  3.0  1.2  1.3 ! A.1821 at -1.30e+07
assign (resid  20 and name HD1#) (resid  90 and name HD2#)  3.0  1.2  1.3 ! A.1829 at -5.00e+06

! S21
assign (resid  21 and name   HN) (resid  21 and name  HB1)  3.0  1.2  0.5 ! A.418  at  6.19e+06
assign (resid  21 and name  HB1) (resid  22 and name   HA)  3.0  1.2  1.1 ! A.403  at -3.95e+06
assign (resid  21 and name  HB1) (resid  22 and name   HN)  3.0  1.2  0.5 ! A.404  at -1.14e+07
assign (resid  21 and name   HA) (resid  22 and name HG2#)  3.0  1.2  0.8 ! A.436  at -1.14e+07
assign (resid  21 and name   HA) (resid  31 and name   HN)  4.0  2.2  1.0 ! A.635  at  2.04e+06
assign (resid  21 and name   HN) (resid  32 and name   HA)  4.0  2.2  1.0 ! A.419  at  1.81e+06
assign (resid  21 and name  HB1) (resid  32 and name   HA)  4.0  2.2  1.5 ! A.405  at -6.10e+06
assign (resid  21 and name  HB1) (resid  32 and name HG2#)  3.0  1.2  1.2 ! A.406  at -7.58e+06
assign (resid  21 and name   HA) (resid  32 and name   HA)  3.0  1.2  0.3 ! A.652  at -5.32e+06
assign (resid  21 and name   HA) (resid  32 and name HG2#)  2.5  0.7  0.7 ! A.672  at -3.27e+07
assign (resid  21 and name   HN) (resid  89 and name   HA)  3.0  1.2  0.5 ! A.420  at  6.07e+06
assign (resid  21 and name  HB1) (resid  89 and name  HB1)  3.0  1.2  0.3 ! A.407  at -5.22e+06
assign (resid  21 and name  HB1) (resid  89 and name  HD1)  2.5  0.7  0.2 ! A.1795 at -2.85e+07
assign (resid  21 and name  HB1) (resid  89 and name  HE1)  3.0  1.2  1.6 ! A.409  at -3.89e+06
assign (resid  21 and name  HB1) (resid  89 and name  HG2)  3.0  1.2  1.4 ! A.410  at -1.09e+07
assign (resid  21 and name  HB1) (resid  89 and name  HG1)  3.0  1.2  1.1 ! A.1801 at -6.55e+06
assign (resid  21 and name  HB1) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.411  at -4.77e+06

! V22
assign (resid  22 and name   HB) (resid  22 and name   HN)  4.0  2.2  1.0 ! A.423  at -2.71e+06
assign (resid  22 and name HG1#) (resid  22 and name   HA)  3.0  1.2  0.8 ! A.426  at -1.06e+07
assign (resid  22 and name HG1#) (resid  22 and name   HN)  3.0  1.2  1.0 ! A.428  at -1.36e+07
assign (resid  22 and name HG2#) (resid  22 and name   HA)  3.0  1.2  0.8 ! A.437  at -1.17e+07
assign (resid  22 and name HG2#) (resid  22 and name   HN)  3.0  1.2  1.0 ! A.440  at -1.07e+07
assign (resid  22 and name HG1#) (resid  23 and name   HN)  3.0  1.2  1.0 ! A.429  at -1.49e+07
assign (resid  22 and name   HA) (resid  23 and name   HN)  3.0  1.2  0.5 ! A.451  at  3.40e+06
assign (resid  22 and name   HB) (resid  23 and name   HN)  4.0  2.2  1.0 ! A.452  at  2.40e+06
assign (resid  22 and name HG2#) (resid  23 and name   HN)  3.0  1.2  1.0 ! A.453  at  7.93e+06
assign (resid  22 and name HG1#) (resid  24 and name HG2#)  3.0  1.2  1.3 ! A.465  at -1.54e+07
assign (resid  22 and name   HN) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.637  at  3.42e+06
assign (resid  22 and name HG2#) (resid  31 and name   HN)  3.0  1.2  1.6 ! A.636  at  3.30e+06
assign (resid  22 and name   HN) (resid  31 and name   HB)  4.0  2.2  1.0 ! A.613  at -2.89e+06
assign (resid  22 and name HG2#) (resid  32 and name   HA)  3.0  1.2  0.8 ! A.441  at -9.61e+06
assign (resid  22 and name   HN) (resid  32 and name   HA)  3.0  1.2  0.5 ! A.654  at -5.85e+06
assign (resid  22 and name   HN) (resid  32 and name   HB)  4.0  2.2  1.8 ! A.662  at -1.24e+07
assign (resid  22 and name   HN) (resid  32 and name HG2#)  2.5  0.7  0.9 ! A.673  at -2.99e+07
assign (resid  22 and name   HB) (resid  48 and name HD1#)  2.5  0.7  0.7 ! A.1025 at -2.87e+07
assign (resid  22 and name   HB) (resid  48 and name HD2#)  3.0  1.2  0.8 ! A.1033 at -5.26e+06
assign (resid  22 and name HG1#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.430  at -8.01e+06
assign (resid  22 and name HG1#) (resid  48 and name HD2#)  2.5  0.7  1.2 ! A.431  at -2.96e+07
assign (resid  22 and name HG2#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.442  at -1.26e+07
assign (resid  22 and name HG2#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.443  at -1.25e+07
assign (resid  22 and name HG2#) (resid  90 and name   HA)  3.0  1.2  1.5 ! A.444  at -9.61e+06
assign (resid  22 and name HG2#) (resid  90 and name   HN)  3.0  1.2  1.0 ! A.446  at -1.04e+07
assign (resid  22 and name HG2#) (resid  90 and name  HB2)  2.5  0.7  0.7 ! A.445  at -2.82e+07
assign (resid  22 and name   HA) (resid  90 and name   HN)  4.0  2.2  1.0 ! A.1846 at  2.67e+06
assign (resid  22 and name HG1#) (resid  91 and name   HA)  3.0  1.2  0.8 ! A.432  at -1.04e+07
assign (resid  22 and name HG2#) (resid  91 and name   HA)  3.0  1.2  0.8 ! A.447  at -3.77e+06
assign (resid  22 and name HG2#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.448  at -1.06e+07
assign (resid  22 and name HG1#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1878 at  1.39e+07
assign (resid  22 and name HG1#) (resid  92 and name   HN)  3.0  1.2  1.0 ! A.435  at -5.24e+06
assign (resid  22 and name HG1#) (resid  92 and name  HB1)  3.0  1.2  0.8 ! A.433  at -1.22e+07
assign (resid  22 and name HG1#) (resid  92 and name  HB2)  3.0  1.2  0.8 ! A.434  at -9.10e+06
assign (resid  22 and name HG2#) (resid  92 and name  HB1)  3.0  1.2  1.7 ! A.449  at -3.76e+06
assign (resid  22 and name HG2#) (resid  92 and name  HB2)  3.0  1.2  0.8 ! A.450  at -5.74e+06

! H23
assign (resid  23 and name   HN) (resid  23 and name  HB1)  3.0  1.2  0.5 ! A.454  at  3.61e+06
assign (resid  23 and name   HN) (resid  23 and name  HB2)  3.0  1.2  0.5 ! A.455  at  3.61e+06
assign (resid  23 and name   HN) (resid  24 and name   HN)  4.0  2.2  1.0 ! A.456  at  2.05e+06
assign (resid  23 and name  HB1) (resid  25 and name HG2#)  3.0  1.2  0.8 ! A.480  at -8.90e+06
assign (resid  23 and name   HA) (resid  29 and name   HN)  4.0  2.2  1.2 ! A.565  at  5.45e+06
assign (resid  23 and name   HA) (resid  30 and name   HN)  4.0  2.2  1.0 ! A.596  at  1.69e+06
assign (resid  23 and name   HA) (resid  31 and name   HN)  4.0  2.2  1.0 ! A.638  at  2.23e+06
assign (resid  23 and name  HB2) (resid  31 and name   HN)  4.0  2.2  2.1 ! A.639  at  1.72e+06
assign (resid  23 and name   HN) (resid  90 and name  HB2)  4.0  2.2  1.0 ! A.457  at  2.07e+06
assign (resid  23 and name   HN) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.458  at  1.75e+06
assign (resid  23 and name   HN) (resid  91 and name  HB2)  4.0  2.2  1.0 ! A.459  at  1.44e+06
assign (resid  23 and name   HN) (resid  91 and name  HG1)  4.0  2.2  1.0 ! A.460  at  1.67e+06
assign (resid  23 and name   HN) (resid  91 and name   HN)  4.0  2.2  1.0 ! A.1880 at  2.77e+06
assign (resid  23 and name  HB2) (resid  91 and name   HN)  4.0  2.2  1.0 ! A.1879 at  2.09e+06
assign (resid  23 and name  HB2) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.1856 at -1.81e+06
assign (resid  23 and name  HB2) (resid  91 and name  HG1)  3.0  1.2  0.3 ! A.1862 at -3.61e+06
assign (resid  23 and name  HB1) (resid  91 and name  HG2)  3.0  1.2  0.3 ! A.1861 at -3.71e+06
assign (resid  23 and name  HB2) (resid  91 and name  HG2)  3.0  1.2  0.3 ! A.1863 at -4.43e+06
assign (resid  23 and name  HB2) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1895 at  2.55e+06
assign (resid  23 and name   HN) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.461  at  1.60e+06
assign (resid  23 and name  HB1) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.1913 at  2.84e+06

! V24
assign (resid  24 and name   HN) (resid  24 and name   HB)  4.0  2.2  1.0 ! A.468  at  1.79e+06
assign (resid  24 and name   HN) (resid  24 and name HG1#)  4.0  2.2  1.5 ! A.469  at  2.15e+06
assign (resid  24 and name   HN) (resid  24 and name HG2#)  4.0  2.2  1.5 ! A.470  at  2.76e+06
assign (resid  24 and name HG2#) (resid  25 and name   HN)  3.0  1.2  1.4 ! A.490  at  5.73e+06
assign (resid  24 and name   HN) (resid  27 and name  HB1)  4.0  2.2  1.4 ! A.471  at  1.72e+06
assign (resid  24 and name HG1#) (resid  27 and name   HA)  3.0  1.2  1.3 ! A.498  at -1.28e+07
assign (resid  24 and name HG1#) (resid  27 and name HD1#)  2.5  0.7  1.2 ! A.504  at -3.05e+07
assign (resid  24 and name HG1#) (resid  28 and name   HN)  3.0  1.2  1.0 ! A.530  at  7.85e+06
assign (resid  24 and name   HN) (resid  29 and name   HA)  4.0  2.2  1.0 ! A.472  at  1.47e+06
assign (resid  24 and name   HB) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.566  at  1.25e+07
assign (resid  24 and name   HN) (resid  29 and name   HN)  3.0  1.2  0.8 ! A.569  at  1.14e+07
assign (resid  24 and name HG1#) (resid  29 and name   HN)  3.0  1.2  1.1 ! A.567  at  2.94e+07
assign (resid  24 and name HG2#) (resid  29 and name   HN)  3.0  1.2  1.0 ! A.568  at  1.98e+07
assign (resid  24 and name   HN) (resid  30 and name   HN)  3.0  1.2  1.2 ! A.597  at  6.41e+06
assign (resid  24 and name   HN) (resid  30 and name   HA)  4.0  2.2  1.0 ! A.589  at -2.78e+06
assign (resid  24 and name   HN) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.642  at  9.91e+06
assign (resid  24 and name HG1#) (resid  31 and name   HN)  4.0  2.2  1.5 ! A.640  at  2.05e+06
assign (resid  24 and name HG2#) (resid  31 and name   HN)  4.0  2.2  1.5 ! A.641  at  2.10e+06
assign (resid  24 and name HG2#) (resid  31 and name   HB)  4.0  2.2  1.5 ! A.614  at -2.56e+06
assign (resid  24 and name HG2#) (resid  92 and name  HB2)  3.0  1.2  0.8 ! A.467  at -4.92e+06
assign (resid  24 and name HG1#) (resid  92 and name   HN)  3.0  1.2  1.0 ! A.1915 at  3.48e+06
assign (resid  24 and name HG2#) (resid  92 and name   HN)  4.0  2.2  1.5 ! A.1916 at  2.99e+06

! T25
assign (resid  25 and name   HN) (resid  25 and name   HB)  3.0  1.2  0.5 ! A.492  at  4.52e+06
assign (resid  25 and name   HN) (resid  25 and name HG2#)  3.0  1.2  1.0 ! A.493  at  2.67e+07
assign (resid  25 and name   HA) (resid  25 and name HG2#)  3.0  1.2  0.8 ! A.474  at -1.12e+07
assign (resid  25 and name   HN) (resid  27 and name   HN)  4.0  2.2  1.0 ! A.494  at  3.13e+06
assign (resid  25 and name   HA) (resid  27 and name   HN)  3.0  1.2  0.5 ! A.476  at -6.56e+06
assign (resid  25 and name   HN) (resid  28 and name   HN)  3.0  1.2  1.1 ! A.531  at  4.55e+06
assign (resid  25 and name   HA) (resid  29 and name   HN)  3.0  1.2  1.8 ! A.570  at  4.35e+06
assign (resid  25 and name   HN) (resid  91 and name  HB2)  4.0  2.2  1.0 ! A.495  at  3.07e+06
assign (resid  25 and name HG2#) (resid  91 and name   HA)  3.0  1.2  0.8 ! A.484  at -6.91e+06
assign (resid  25 and name HG2#) (resid  91 and name  HB2)  3.0  1.2  0.8 ! A.485  at -1.46e+07
assign (resid  25 and name HG2#) (resid  91 and name  HG1)  3.0  1.2  1.2 ! A.487  at -1.45e+07
assign (resid  25 and name HG2#) (resid  91 and name  HG2)  3.0  1.2  0.8 ! A.488  at -9.76e+06
assign (resid  25 and name HG2#) (resid  91 and name HE22)  2.5  0.7  0.7 ! A.486  at -3.45e+07
assign (resid  25 and name HG2#) (resid  91 and name HE21)  3.0  1.2  0.8 ! A.1896 at  4.73e+06
assign (resid  25 and name   HN) (resid  92 and name   HA)  4.0  2.2  1.0 ! A.496  at  2.14e+06
assign (resid  25 and name   HN) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.497  at  2.07e+06
assign (resid  25 and name HG2#) (resid  92 and name   HN)  3.0  1.2  1.0 ! A.489  at -8.73e+06
assign (resid  25 and name   HB) (resid  93 and name   HB)  4.0  2.2  1.0 ! A.1924 at -1.44e+06
assign (resid  25 and name HG2#) (resid  93 and name   HB)  3.0  1.2  0.8 ! A.1925 at -5.55e+06

! D26

! L27
assign (resid  27 and name   HA) (resid  27 and name   HG)  3.0  1.2  0.3 ! A.501  at -1.22e+07
assign (resid  27 and name   HA) (resid  27 and name HD2#)  3.0  1.2  0.8 ! A.500  at -1.52e+07
assign (resid  27 and name  HB1) (resid  27 and name HD2#)  3.0  1.2  0.8 ! A.503  at -3.21e+06
assign (resid  27 and name HD1#) (resid  27 and name   HA)  3.0  1.2  0.8 ! A.505  at -1.40e+07
assign (resid  27 and name HD1#) (resid  27 and name  HB1)  2.5  0.7  0.7 ! A.506  at -2.95e+07
assign (resid  27 and name   HA) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.532  at  8.07e+06
assign (resid  27 and name   HN) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.536  at  1.45e+07
assign (resid  27 and name  HB1) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.533  at  8.81e+06
assign (resid  27 and name  HB2) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.534  at  7.85e+06
assign (resid  27 and name HD2#) (resid  28 and name   HN)  3.0  1.2  1.6 ! A.535  at  4.83e+06
assign (resid  27 and name  HB1) (resid  28 and name  HB1)  4.0  2.2  1.0 ! A.517  at -2.81e+06
assign (resid  27 and name HD1#) (resid  29 and name  HD1)  3.0  1.2  0.8 ! A.507  at -8.87e+06
assign (resid  27 and name   HA) (resid  29 and name   HN)  3.0  1.2  1.6 ! A.571  at  7.19e+06
assign (resid  27 and name  HB1) (resid  29 and name   HN)  2.5  0.7  0.4 ! A.572  at  3.27e+07
assign (resid  27 and name  HB2) (resid  29 and name   HN)  2.5  0.7  0.8 ! A.573  at  2.94e+07
assign (resid  27 and name HD1#) (resid  29 and name   HN)  3.0  1.2  1.3 ! A.574  at  1.69e+07
assign (resid  27 and name HD2#) (resid  29 and name   HN)  3.0  1.2  1.3 ! A.575  at  1.82e+07 !! relaxed
assign (resid  27 and name HD2#) (resid  29 and name  HD1)  3.0  1.2  0.8 ! A.556  at -9.15e+06
assign (resid  27 and name HD1#) (resid  52 and name HD1#)  3.0  1.2  1.3 ! A.508  at -1.81e+07
assign (resid  27 and name HD2#) (resid  52 and name HD1#)  3.0  1.2  1.3 ! A.1096 at -2.55e+07
assign (resid  27 and name HD1#) (resid  56 and name  HE2)  3.0  1.2  0.8 ! A.510  at -9.16e+06
assign (resid  27 and name HD2#) (resid  56 and name  HE1)  3.0  1.2  0.8 ! A.513  at -1.98e+07

! N28
assign (resid  28 and name   HN) (resid  28 and name  HB1)  3.0  1.2  0.9 ! A.538  at  6.42e+06
assign (resid  28 and name   HN) (resid  28 and name  HB2)  3.0  1.2  0.5 ! A.539  at  8.52e+06
assign (resid  28 and name  HB1) (resid  28 and name HD21)  3.0  1.2  0.3 ! A.522  at -9.66e+06
assign (resid  28 and name  HB1) (resid  28 and name HD22)  3.0  1.2  0.8 ! A.524  at -1.04e+07
assign (resid  28 and name  HB2) (resid  28 and name HD21)  3.0  1.2  0.3 ! A.523  at -7.94e+06
assign (resid  28 and name  HB2) (resid  28 and name HD22)  3.0  1.2  1.1 ! A.525  at -7.91e+06
assign (resid  28 and name HD21) (resid  28 and name   HA)  3.0  1.2  0.3 ! A.542  at  3.56e+06
assign (resid  28 and name HD22) (resid  28 and name   HA)  3.0  1.2  0.3 ! A.543  at  4.37e+06
assign (resid  28 and name   HN) (resid  29 and name   HA)  4.0  2.2  1.2 ! A.540  at  1.44e+07
assign (resid  28 and name   HN) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.541  at  1.75e+07
assign (resid  28 and name   HA) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.516  at -6.57e+06
assign (resid  28 and name  HB1) (resid  29 and name   HA)  4.0  2.2  1.0 ! A.528  at -2.21e+06
assign (resid  28 and name  HB2) (resid  29 and name   HA)  4.0  2.2  1.6 ! A.529  at -2.90e+06
assign (resid  28 and name HD21) (resid  29 and name   HA)  3.0  1.2  1.0 ! A.550  at  8.08e+06
assign (resid  28 and name HD22) (resid  29 and name   HA)  4.0  2.2  1.3 ! A.551  at  7.24e+06
assign (resid  28 and name  HB1) (resid  29 and name   HN)  3.0  1.2  0.9 ! A.577  at  1.10e+07
assign (resid  28 and name  HB2) (resid  29 and name   HN)  3.0  1.2  1.4 ! A.578  at  1.68e+07
assign (resid  28 and name HD21) (resid  29 and name   HN)  4.0  2.2  1.0 ! A.579  at  2.86e+06

! R29
assign (resid  29 and name   HN) (resid  29 and name  HB1)  2.5  0.7  1.2 ! A.582  at  3.93e+07
assign (resid  29 and name   HN) (resid  29 and name  HB2)  2.5  0.7  0.4 ! A.583  at  3.93e+07
assign (resid  29 and name   HN) (resid  29 and name  HD1)  3.0  1.2  0.9 ! A.584  at  7.89e+06
assign (resid  29 and name   HN) (resid  29 and name  HG2)  2.5  0.7  1.1 ! A.585  at  3.69e+07
assign (resid  29 and name  HB1) (resid  29 and name  HD1)  4.0  2.2  1.0 ! A.553  at -2.38e+06
assign (resid  29 and name  HD1) (resid  29 and name   HA)  3.0  1.2  1.4 ! A.557  at -2.71e+07
assign (resid  29 and name  HG1) (resid  29 and name   HA)  3.0  1.2  0.3 ! A.560  at -1.04e+07
assign (resid  29 and name  HG1) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.563  at -6.62e+06
assign (resid  29 and name  HG2) (resid  29 and name   HA)  3.0  1.2  0.3 ! A.561  at -1.38e+07
assign (resid  29 and name   HN) (resid  30 and name   HA)  4.0  2.2  1.0 ! A.586  at  3.05e+06
assign (resid  29 and name   HN) (resid  30 and name   HN)  3.0  1.2  1.3 ! A.587  at  1.18e+07
assign (resid  29 and name   HA) (resid  30 and name   HN)  2.5  0.7  0.4 ! A.598  at  3.01e+07
assign (resid  29 and name  HB1) (resid  30 and name   HN)  3.0  1.2  0.5 ! A.599  at  2.01e+07
assign (resid  29 and name  HD1) (resid  30 and name   HN)  3.0  1.2  1.8 ! A.600  at  6.03e+06
assign (resid  29 and name  HG1) (resid  30 and name   HN)  3.0  1.2  1.5 ! A.601  at  2.06e+07
assign (resid  29 and name  HG2) (resid  30 and name   HN)  3.0  1.2  1.0 ! A.602  at  1.54e+07
assign (resid  29 and name   HA) (resid  30 and name   HA)  4.0  2.2  1.0 ! A.590  at -1.50e+06
assign (resid  29 and name   HN) (resid  31 and name HG2#)  4.0  2.2  1.0 ! A.588  at  7.32e+06
assign (resid  29 and name  HB2) (resid  31 and name HG2#)  3.0  1.2  0.8 ! A.555  at -7.35e+06
assign (resid  29 and name  HD1) (resid  31 and name HG2#)  3.0  1.2  0.8 ! A.559  at -7.01e+06

! D30
assign (resid  30 and name   HN) (resid  30 and name  HB1)  3.0  1.2  0.8 ! A.605  at  2.77e+07
assign (resid  30 and name   HN) (resid  31 and name   HA)  4.0  2.2  1.0 ! A.606  at  2.87e+06
assign (resid  30 and name   HN) (resid  31 and name   HN)  3.0  1.2  1.0 ! A.608  at  6.93e+06
assign (resid  30 and name   HN) (resid  31 and name HG2#)  3.0  1.2  1.0 ! A.607  at  6.94e+06
assign (resid  30 and name   HA) (resid  31 and name   HA)  4.0  2.2  1.0 ! A.593  at -1.98e+06
assign (resid  30 and name   HA) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.643  at  7.41e+06
assign (resid  30 and name  HB1) (resid  31 and name   HA)  4.0  2.2  1.0 ! A.595  at -3.07e+06
assign (resid  30 and name  HB1) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.644  at  5.32e+06
assign (resid  30 and name   HA) (resid  31 and name   HB)  4.0  2.2  1.0 ! A.615  at -2.41e+06
assign (resid  30 and name  HB1) (resid  31 and name   HB)  4.0  2.2  1.9 ! A.616  at -1.98e+06
assign (resid  30 and name   HA) (resid  31 and name HG1#)  4.0  2.2  1.3 ! A.625  at -6.67e+06

! V31
assign (resid  31 and name   HN) (resid  31 and name   HB)  3.0  1.2  0.5 ! A.647  at  6.02e+06
assign (resid  31 and name   HN) (resid  31 and name HG1#)  3.0  1.2  1.0 ! A.648  at  8.64e+06
assign (resid  31 and name   HA) (resid  31 and name HG1#)  3.0  1.2  0.8 ! A.610  at -1.19e+07
assign (resid  31 and name   HA) (resid  31 and name HG2#)  3.0  1.2  0.8 ! A.611  at -1.08e+07
assign (resid  31 and name   HN) (resid  32 and name   HA)  4.0  2.2  1.0 ! A.649  at  1.99e+06
assign (resid  31 and name   HN) (resid  32 and name   HN)  4.0  2.2  1.0 ! A.650  at  1.89e+06
assign (resid  31 and name   HA) (resid  32 and name   HN)  3.0  1.2  0.5 ! A.612  at -1.00e+07
assign (resid  31 and name   HB) (resid  32 and name   HA)  4.0  2.2  1.0 ! A.620  at -2.54e+06
assign (resid  31 and name   HB) (resid  32 and name   HN)  3.0  1.2  0.5 ! A.680  at  8.83e+06
assign (resid  31 and name HG1#) (resid  32 and name   HN)  3.0  1.2  1.0 ! A.629  at -5.82e+06
assign (resid  31 and name HG2#) (resid  32 and name   HN)  3.0  1.2  1.0 ! A.633  at -1.47e+07
assign (resid  31 and name   HA) (resid  32 and name   HB)  4.0  2.2  1.3 ! A.663  at -8.56e+06
assign (resid  31 and name HG1#) (resid  32 and name   HB)  3.0  1.2  1.5 ! A.664  at -7.78e+06
assign (resid  31 and name   HN) (resid  48 and name HD1#)  4.0  2.2  1.5 ! A.651  at  1.90e+06
assign (resid  31 and name   HB) (resid  48 and name   HG)  4.0  2.2  1.0 ! A.624  at -2.56e+06
assign (resid  31 and name   HB) (resid  48 and name HD1#)  2.5  0.7  0.7 ! A.1026 at -2.87e+07
assign (resid  31 and name   HB) (resid  48 and name HD2#)  3.0  1.2  0.8 ! A.1035 at -5.26e+06
assign (resid  31 and name HG1#) (resid  48 and name   HG)  3.0  1.2  1.3 ! A.632  at -2.32e+07
assign (resid  31 and name HG1#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.630  at -1.86e+07
assign (resid  31 and name HG1#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.631  at -5.19e+06
assign (resid  31 and name HG2#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.634  at -1.14e+07

! T32
assign (resid  32 and name   HN) (resid  32 and name   HB)  3.0  1.2  0.5 ! A.683  at  6.46e+06
assign (resid  32 and name   HN) (resid  32 and name HG2#)  3.0  1.2  1.0 ! A.684  at  4.13e+06
assign (resid  32 and name   HA) (resid  32 and name HG2#)  3.0  1.2  0.8 ! A.656  at -4.89e+06
assign (resid  32 and name   HA) (resid  33 and name   HN)  3.0  1.2  0.5 ! A.658  at -6.09e+06
assign (resid  32 and name   HA) (resid  33 and name  HB1)  4.0  2.2  1.5 ! A.657  at -2.59e+06
assign (resid  32 and name   HB) (resid  33 and name   HN)  3.0  1.2  0.5 ! A.668  at -1.25e+07
assign (resid  32 and name HG2#) (resid  33 and name   HN)  2.5  0.7  0.9 ! A.678  at -5.08e+07
assign (resid  32 and name HG2#) (resid  33 and name HD2#)  3.0  1.2  1.3 ! A.677  at -2.14e+07
assign (resid  32 and name   HN) (resid  33 and name   HN)  4.0  2.2  1.0 ! A.712  at  2.21e+06

! L33
assign (resid  33 and name   HN) (resid  33 and name  HB1)  3.0  1.2  0.5 ! A.714  at  7.11e+06
assign (resid  33 and name   HN) (resid  33 and name  HB2)  3.0  1.2  0.5 ! A.715  at  5.85e+06
assign (resid  33 and name   HN) (resid  33 and name HD1#)  3.0  1.2  1.3 ! A.716  at  8.80e+06
assign (resid  33 and name   HN) (resid  33 and name HD2#)  3.0  1.2  1.0 ! A.717  at  8.80e+06
assign (resid  33 and name HD1#) (resid  33 and name   HA)  3.0  1.2  0.8 ! A.689  at -9.58e+06
assign (resid  33 and name HD2#) (resid  33 and name   HA)  2.5  0.7  0.7 ! A.701  at -4.49e+07
assign (resid  33 and name HD2#) (resid  33 and name  HB1)  2.5  0.7  0.7 ! A.702  at -9.79e+07
assign (resid  33 and name HD2#) (resid  33 and name  HB2)  2.5  0.7  0.7 ! A.703  at -3.89e+07
assign (resid  33 and name HD1#) (resid  34 and name   HN)  3.0  1.2  1.0 ! A.691  at -5.22e+06
assign (resid  33 and name HD2#) (resid  34 and name   HN)  3.0  1.2  1.0 ! A.705  at -1.33e+07
assign (resid  33 and name   HA) (resid  34 and name   HN)  2.5  0.7  0.4 ! A.736  at  2.94e+07
assign (resid  33 and name   HN) (resid  34 and name   HN)  3.0  1.2  1.1 ! A.739  at  4.30e+06
assign (resid  33 and name  HB2) (resid  34 and name   HN)  3.0  1.2  1.4 ! A.737  at  1.00e+07
assign (resid  33 and name HD1#) (resid  44 and name   HA)  3.0  1.2  0.8 ! A.692  at -5.31e+06
assign (resid  33 and name  HB1) (resid  44 and name   HA)  4.0  2.2  1.0 ! A.974  at -2.93e+06
assign (resid  33 and name HD1#) (resid  47 and name  HB1)  3.0  1.2  0.8 ! A.693  at -2.28e+07
assign (resid  33 and name HD1#) (resid  47 and name  HB2)  3.0  1.2  0.8 ! A.694  at -2.28e+07
assign (resid  33 and name HD1#) (resid  48 and name   HA)  3.0  1.2  0.8 ! A.695  at -7.66e+06
assign (resid  33 and name HD1#) (resid  48 and name   HN)  3.0  1.2  1.0 ! A.698  at -6.03e+06
assign (resid  33 and name HD1#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.696  at -6.19e+06
assign (resid  33 and name HD1#) (resid  48 and name HD2#)  3.0  1.2  1.8 ! A.697  at -5.76e+06
assign (resid  33 and name HD2#) (resid  48 and name   HA)  3.0  1.2  0.8 ! A.706  at -2.31e+07
assign (resid  33 and name HD2#) (resid  48 and name   HN)  3.0  1.2  1.0 ! A.707  at -8.26e+06
assign (resid  33 and name HD1#) (resid  48 and name  HB1)  4.0  2.2  1.5 ! A.1022 at -2.20e+06
assign (resid  33 and name HD2#) (resid  48 and name  HB1)  4.0  2.2  1.5 ! A.1023 at -3.05e+06
assign (resid  33 and name HD2#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.1036 at -1.53e+07
assign (resid  33 and name HD1#) (resid  51 and name  HD1)  3.0  1.2  0.8 ! A.699  at -2.61e+07
assign (resid  33 and name HD1#) (resid  51 and name  HE1)  3.0  1.2  0.8 ! A.700  at -5.84e+06
assign (resid  33 and name HD2#) (resid  51 and name  HE1)  3.0  1.2  0.8 ! A.708  at -2.05e+07
assign (resid  33 and name HD2#) (resid  51 and name  HD1)  3.0  1.2  0.8 ! A.1071 at -2.59e+07
assign (resid  33 and name HD1#) (resid  51 and name  HD2)  3.0  1.2  0.8 ! A.1070 at -4.77e+06
assign (resid  33 and name HD1#) (resid  51 and name  HG1)  3.0  1.2  0.8 ! A.1076 at -2.45e+07

! R34
assign (resid  34 and name   HN) (resid  34 and name  HB1)  2.5  0.7  0.4 ! A.741  at  2.82e+07
assign (resid  34 and name   HN) (resid  34 and name  HD1)  4.0  2.2  1.0 ! A.742  at  3.06e+06
assign (resid  34 and name   HN) (resid  34 and name  HD2)  3.0  1.2  1.7 ! A.743  at  4.07e+06
assign (resid  34 and name   HN) (resid  34 and name  HG1)  3.0  1.2  1.4 ! A.744  at  2.99e+07
assign (resid  34 and name  HD1) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.719  at -1.26e+07
assign (resid  34 and name  HD1) (resid  34 and name  HB1)  3.0  1.2  0.6 ! A.721  at -1.13e+07
assign (resid  34 and name  HD2) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.720  at -1.43e+07
assign (resid  34 and name  HD2) (resid  34 and name  HB1)  3.0  1.2  0.9 ! A.722  at -9.64e+06
assign (resid  34 and name  HG2) (resid  34 and name   HA)  3.0  1.2  0.7 ! A.727  at -8.62e+06
assign (resid  34 and name  HG2) (resid  34 and name   HN)  3.0  1.2  1.7 ! A.732  at -3.95e+06
assign (resid  34 and name   HN) (resid  35 and name   HN)  3.0  1.2  1.3 ! A.747  at  4.79e+06
assign (resid  34 and name   HN) (resid  35 and name HG1#)  3.0  1.2  1.0 ! A.745  at  4.74e+06
assign (resid  34 and name   HN) (resid  35 and name HG2#)  4.0  2.2  1.5 ! A.746  at  3.08e+06
assign (resid  34 and name   HA) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.779  at  1.52e+07
assign (resid  34 and name  HD1) (resid  35 and name   HN)  4.0  2.2  1.0 ! A.780  at  3.53e+06
assign (resid  34 and name  HG1) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.781  at  7.39e+06
assign (resid  34 and name   HA) (resid  35 and name HG1#)  3.0  1.2  0.8 ! A.756  at -1.06e+07

! V35
assign (resid  35 and name   HN) (resid  35 and name   HB)  3.0  1.2  0.9 ! A.784  at  9.48e+06
assign (resid  35 and name   HN) (resid  35 and name HG1#)  3.0  1.2  1.0 ! A.785  at  8.72e+06
assign (resid  35 and name   HN) (resid  35 and name HG2#)  3.0  1.2  1.0 ! A.786  at  1.45e+07
assign (resid  35 and name   HA) (resid  35 and name HG1#)  3.0  1.2  0.8 ! A.749  at -8.73e+06
assign (resid  35 and name   HA) (resid  35 and name HG2#)  3.0  1.2  0.8 ! A.750  at -5.42e+06
assign (resid  35 and name   HN) (resid  36 and name   HN)  4.0  2.2  1.0 ! A.787  at  2.75e+06
assign (resid  35 and name   HA) (resid  36 and name   HN)  3.0  1.2  0.5 ! A.752  at -5.32e+06
assign (resid  35 and name   HA) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.751  at -9.49e+06
assign (resid  35 and name   HB) (resid  36 and name   HN)  3.0  1.2  0.5 ! A.809  at  1.52e+07
assign (resid  35 and name HG1#) (resid  36 and name   HN)  3.0  1.2  1.0 ! A.762  at -1.21e+07
assign (resid  35 and name HG2#) (resid  36 and name   HA)  4.0  2.2  1.5 ! A.772  at -2.45e+06
assign (resid  35 and name HG2#) (resid  36 and name   HN)  3.0  1.2  1.0 ! A.773  at -7.19e+06
assign (resid  35 and name HG2#) (resid  37 and name   HN)  4.0  2.2  1.5 ! A.826  at  1.58e+06
assign (resid  35 and name   HB) (resid  38 and name   HN)  4.0  2.2  1.0 ! A.846  at  2.12e+06
assign (resid  35 and name   HN) (resid  39 and name HG1#)  3.0  1.2  1.9 ! A.788  at  7.06e+06
assign (resid  35 and name   HA) (resid  39 and name HG1#)  2.5  0.7  0.7 ! A.872  at -2.86e+07
assign (resid  35 and name HG1#) (resid  39 and name   HB)  3.0  1.2  0.8 ! A.763  at -1.22e+07
assign (resid  35 and name HG2#) (resid  39 and name HG1#)  3.0  1.2  1.3 ! A.774  at -1.23e+07
assign (resid  35 and name   HB) (resid  39 and name   HN)  3.0  1.2  1.1 ! A.895  at  6.39e+06
assign (resid  35 and name HG1#) (resid  39 and name   HN)  4.0  2.2  1.1 ! A.896  at  3.59e+06
assign (resid  35 and name HG2#) (resid  39 and name   HN)  4.0  2.2  1.5 ! A.897  at  3.00e+06
assign (resid  35 and name   HB) (resid  39 and name HG1#)  3.0  1.2  0.8 ! A.873  at -2.77e+07
assign (resid  35 and name HG1#) (resid  39 and name HG1#)  3.0  1.2  1.3 ! A.874  at -2.68e+07
assign (resid  35 and name HG1#) (resid  39 and name HG2#)  3.0  1.2  1.3 ! A.886  at -2.39e+07
assign (resid  35 and name HG2#) (resid  39 and name HG2#)  3.0  1.2  1.3 ! A.887  at -4.90e+06
assign (resid  35 and name HG1#) (resid  47 and name  HE1)  3.0  1.2  0.8 ! A.764  at -4.05e+06
assign (resid  35 and name HG2#) (resid  47 and name  HE1)  4.0  2.2  1.5 ! A.775  at -2.20e+06
assign (resid  35 and name HG2#) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.776  at -2.70e+07
assign (resid  35 and name HG2#) (resid  84 and name HG2#)  4.0  2.2  2.0 ! A.1691 at -2.33e+06

! T36
assign (resid  36 and name   HN) (resid  36 and name   HB)  3.0  1.2  0.8 ! A.814  at  1.49e+07
assign (resid  36 and name   HN) (resid  36 and name HG2#)  2.5  0.7  0.9 ! A.815  at  3.09e+07
assign (resid  36 and name   HA) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.792  at -7.18e+06
assign (resid  36 and name   HN) (resid  37 and name   HN)  4.0  2.2  1.0 ! A.816  at  2.97e+06
assign (resid  36 and name   HA) (resid  37 and name   HN)  3.0  1.2  0.5 ! A.793  at -4.85e+06
assign (resid  36 and name   HB) (resid  37 and name   HN)  3.0  1.2  1.2 ! A.798  at -4.47e+06
assign (resid  36 and name HG2#) (resid  37 and name   HN)  3.0  1.2  1.0 ! A.804  at -1.66e+07
assign (resid  36 and name   HN) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.847  at  3.23e+06
assign (resid  36 and name   HB) (resid  38 and name   HN)  4.0  2.2  1.0 ! A.799  at -2.11e+06
assign (resid  36 and name HG2#) (resid  38 and name   HN)  3.0  1.2  1.5 ! A.805  at -7.28e+06
assign (resid  36 and name   HN) (resid  39 and name   HA)  4.0  2.2  1.0 ! A.818  at  3.02e+06
assign (resid  36 and name   HN) (resid  39 and name   HB)  3.0  1.2  1.4 ! A.819  at  5.77e+06
assign (resid  36 and name   HN) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.820  at  4.34e+06
assign (resid  36 and name   HN) (resid  39 and name HG1#)  2.5  0.7  0.9 ! A.876  at -3.89e+07
assign (resid  36 and name   HN) (resid  39 and name HG2#)  3.0  1.2  1.5 ! A.888  at -1.03e+07
assign (resid  36 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.8 ! A.821  at  1.08e+07
assign (resid  36 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.822  at  9.78e+06

! G37
assign (resid  37 and name   HN) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.833  at  5.17e+06
assign (resid  37 and name   HN) (resid  38 and name  HB1)  4.0  2.2  1.0 ! A.832  at  2.01e+06
assign (resid  37 and name  HA1) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.848  at  1.89e+07
assign (resid  37 and name  HA2) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.849  at  5.39e+06
assign (resid  37 and name   HN) (resid  39 and name   HN)  3.0  1.2  1.8 ! A.900  at  3.64e+06
assign (resid  37 and name   HN) (resid  39 and name HG1#)  3.0  1.2  1.5 ! A.834  at  8.43e+06
assign (resid  37 and name  HA2) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.899  at  4.66e+06
assign (resid  37 and name  HA2) (resid  78 and name HG2#)  3.0  1.2  1.1 ! A.1503 at -5.35e+06
assign (resid  37 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.836  at  3.22e+06
assign (resid  37 and name  HA1) (resid  79 and name HD2#)  3.0  1.2  0.8 ! A.1546 at -4.36e+06
assign (resid  37 and name  HA2) (resid  79 and name HD2#)  3.0  1.2  0.8 ! A.1547 at -5.00e+06
assign (resid  37 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.5 ! A.1567 at  1.67e+06
assign (resid  37 and name  HA1) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1565 at  1.12e+07
assign (resid  37 and name  HA2) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1566 at  5.11e+06

! E38
assign (resid  38 and name   HN) (resid  38 and name  HB1)  3.0  1.2  0.5 ! A.852  at  1.62e+07
assign (resid  38 and name   HN) (resid  38 and name  HB2)  3.0  1.2  0.9 ! A.853  at  2.68e+07
assign (resid  38 and name   HN) (resid  38 and name  HG1)  2.5  0.7  0.4 ! A.854  at  2.84e+07
assign (resid  38 and name  HG1) (resid  38 and name   HA)  3.0  1.2  0.7 ! A.841  at -2.78e+07
assign (resid  38 and name   HN) (resid  39 and name   HA)  3.0  1.2  1.2 ! A.855  at  4.00e+06
assign (resid  38 and name   HN) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.857  at  1.53e+07
assign (resid  38 and name   HN) (resid  39 and name HG1#)  3.0  1.2  1.0 ! A.856  at  1.53e+07
assign (resid  38 and name  HG1) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.844  at -5.65e+06
assign (resid  38 and name   HA) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.901  at  1.07e+07
assign (resid  38 and name  HB1) (resid  39 and name   HN)  3.0  1.2  1.4 ! A.902  at  1.03e+07
assign (resid  38 and name  HB2) (resid  39 and name   HN)  3.0  1.2  1.3 ! A.903  at  1.12e+07
assign (resid  38 and name   HA) (resid  39 and name   HA)  4.0  2.2  1.0 ! A.863  at -3.06e+06
assign (resid  38 and name  HG1) (resid  39 and name HG1#)  3.0  1.2  0.8 ! A.878  at -8.51e+06
assign (resid  38 and name   HN) (resid  78 and name   HB)  3.0  1.2  1.8 ! A.858  at  4.04e+06
assign (resid  38 and name   HN) (resid  78 and name HG2#)  3.0  1.2  1.0 ! A.859  at  4.53e+06
assign (resid  38 and name   HA) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1504 at -1.35e+07
assign (resid  38 and name  HB1) (resid  78 and name HG2#)  3.0  1.2  1.2 ! A.1505 at -6.35e+06
assign (resid  38 and name  HG1) (resid  78 and name HG2#)  3.0  1.2  1.2 ! A.1506 at -6.08e+06
assign (resid  38 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.0 ! A.860  at  6.25e+06
assign (resid  38 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.861  at  7.59e+06
assign (resid  38 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.0 ! A.862  at  2.12e+06
assign (resid  38 and name   HA) (resid  80 and name   HN)  3.0  1.2  1.7 ! A.1568 at  1.12e+07

! V39
assign (resid  39 and name   HN) (resid  39 and name   HB)  3.0  1.2  0.5 ! A.907  at  2.34e+07
assign (resid  39 and name   HN) (resid  39 and name HG1#)  2.5  0.7  0.9 ! A.908  at  4.83e+07
assign (resid  39 and name   HN) (resid  39 and name HG2#)  2.5  0.7  0.9 ! A.909  at  4.83e+07
assign (resid  39 and name   HA) (resid  39 and name HG1#)  3.0  1.2  0.8 ! A.864  at -1.42e+07
assign (resid  39 and name   HA) (resid  39 and name HG2#)  3.0  1.2  0.8 ! A.865  at -1.42e+07
assign (resid  39 and name   HN) (resid  40 and name   HN)  3.0  1.2  1.5 ! A.910  at  5.83e+06
assign (resid  39 and name   HA) (resid  40 and name   HN)  3.0  1.2  0.5 ! A.867  at -6.10e+06
assign (resid  39 and name HG1#) (resid  40 and name   HN)  3.0  1.2  1.0 ! A.883  at -1.53e+07
assign (resid  39 and name HG2#) (resid  40 and name   HN)  3.0  1.2  1.0 ! A.892  at -1.41e+07
assign (resid  39 and name   HB) (resid  40 and name   HN)  3.0  1.2  0.5 ! A.917  at  3.22e+06
assign (resid  39 and name HG1#) (resid  44 and name HG2#)  3.0  1.2  1.3 ! A.884  at -2.68e+07
assign (resid  39 and name HG2#) (resid  44 and name   HB)  3.0  1.2  1.1 ! A.893  at -8.53e+06
assign (resid  39 and name HG2#) (resid  44 and name HG2#)  3.0  1.2  1.3 ! A.894  at -2.39e+07
assign (resid  39 and name HG2#) (resid  44 and name   HN)  3.0  1.2  1.0 ! A.990  at  1.00e+07
assign (resid  39 and name HG1#) (resid  47 and name  HE1)  3.0  1.2  0.8 ! A.885  at -7.51e+06
assign (resid  39 and name   HN) (resid  78 and name   HB)  4.0  2.2  1.0 ! A.911  at  2.72e+06
assign (resid  39 and name   HA) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1507 at -8.32e+06
assign (resid  39 and name   HN) (resid  78 and name HG2#)  3.0  1.2  1.0 ! A.1508 at -9.39e+06
assign (resid  39 and name   HN) (resid  79 and name   HN)  4.0  2.2  1.0 ! A.914  at  2.84e+06
assign (resid  39 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.0 ! A.912  at  1.26e+07
assign (resid  39 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.913  at  1.26e+07
assign (resid  39 and name   HA) (resid  79 and name HD1#)  4.0  2.2  1.5 ! A.868  at -2.91e+06
assign (resid  39 and name   HB) (resid  79 and name HD2#)  3.0  1.2  1.6 ! A.1548 at -9.40e+06
assign (resid  39 and name HG1#) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.1549 at -1.13e+07
assign (resid  39 and name HG2#) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.1550 at -1.15e+07
assign (resid  39 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.0 ! A.915  at  2.19e+06

! H40
assign (resid  40 and name   HN) (resid  40 and name  HB1)  4.0  2.2  1.0 ! A.921  at  1.59e+06
assign (resid  40 and name  HB1) (resid  41 and name   HN)  4.0  2.2  1.0 ! A.955  at  2.92e+06
assign (resid  40 and name  HB1) (resid  42 and name   HN)  4.0  2.2  1.0 ! A.961  at  2.30e+06
assign (resid  40 and name   HN) (resid  43 and name  HA1)  3.0  1.2  0.5 ! A.922  at  6.37e+06
assign (resid  40 and name   HA) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1509 at -7.04e+06
assign (resid  40 and name   HN) (resid  78 and name HG2#)  4.0  2.2  1.5 ! A.1511 at -2.95e+06
assign (resid  40 and name  HB1) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1510 at -5.07e+06

! I41
assign (resid  41 and name   HN) (resid  41 and name   HB)  4.0  2.2  1.0 ! A.956  at  2.32e+06
assign (resid  41 and name   HN) (resid  41 and name HD1#)  3.0  1.2  1.0 ! A.957  at  3.73e+06
assign (resid  41 and name   HN) (resid  41 and name HG11)  4.0  2.2  1.0 ! A.958  at  2.02e+06
assign (resid  41 and name   HN) (resid  41 and name HG2#)  3.0  1.2  1.0 ! A.959  at  3.71e+06
assign (resid  41 and name   HA) (resid  41 and name HD1#)  3.0  1.2  0.8 ! A.923  at -4.50e+06
assign (resid  41 and name   HA) (resid  41 and name HG11)  4.0  2.2  1.0 ! A.924  at -2.02e+06
assign (resid  41 and name   HA) (resid  41 and name HG12)  4.0  2.2  1.0 ! A.925  at -2.02e+06
assign (resid  41 and name   HA) (resid  41 and name HG2#)  3.0  1.2  0.8 ! A.926  at -7.77e+06
assign (resid  41 and name HD1#) (resid  41 and name   HB)  3.0  1.2  0.8 ! A.930  at -1.41e+07
assign (resid  41 and name HG2#) (resid  42 and name   HN)  3.0  1.2  1.0 ! A.945  at -4.07e+06
assign (resid  41 and name   HA) (resid  42 and name   HN)  4.0  2.2  1.0 ! A.962  at  2.69e+06
assign (resid  41 and name   HN) (resid  42 and name   HN)  4.0  2.2  1.0 ! A.965  at  1.59e+06
assign (resid  41 and name HD1#) (resid  42 and name   HN)  3.0  1.2  1.0 ! A.963  at  3.37e+06
assign (resid  41 and name HD1#) (resid  43 and name   HN)  4.0  2.2  1.6 ! A.933  at -1.11e+07
assign (resid  41 and name HG2#) (resid  43 and name   HN)  3.0  1.2  1.3 ! A.946  at -1.17e+07
assign (resid  41 and name   HA) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.991  at  7.74e+06
assign (resid  41 and name HG2#) (resid  44 and name   HN)  3.0  1.2  1.0 ! A.947  at -7.31e+06
assign (resid  41 and name   HA) (resid  44 and name HG2#)  3.0  1.2  0.8 ! A.983  at -6.58e+06
assign (resid  41 and name HG2#) (resid  45 and name  HG1)  3.0  1.2  0.8 ! A.948  at -9.92e+06
assign (resid  41 and name HG11) (resid  45 and name  HE#)  4.0  2.2  2.6 ! A.1001 at -5.61e+07
assign (resid  41 and name HD1#) (resid  72 and name   HG)  3.0  1.2  1.3 ! A.936  at -1.67e+07
assign (resid  41 and name HD1#) (resid  72 and name HD1#)  2.5  0.7  1.2 ! A.1403 at -3.65e+07
assign (resid  41 and name HD1#) (resid  72 and name HD2#)  3.0  1.2  1.3 ! A.935  at -5.72e+06
assign (resid  41 and name HG2#) (resid  72 and name   HG)  3.0  1.2  1.7 ! A.951  at -1.61e+07
assign (resid  41 and name HG2#) (resid  72 and name   HN)  4.0  2.2  1.5 ! A.952  at -3.11e+06
assign (resid  41 and name HG2#) (resid  72 and name HD1#)  2.5  0.7  1.2 ! A.949  at -2.84e+07
assign (resid  41 and name HG2#) (resid  72 and name HD2#)  3.0  1.2  1.3 ! A.950  at -2.72e+07
assign (resid  41 and name HD1#) (resid  73 and name   HN)  3.0  1.2  1.0 ! A.937  at -6.56e+06
assign (resid  41 and name HG2#) (resid  73 and name   HN)  3.0  1.2  1.3 ! A.953  at -1.24e+07
assign (resid  41 and name HG2#) (resid  74 and name   HN)  3.0  1.2  1.0 ! A.954  at -7.71e+06
assign (resid  41 and name   HN) (resid  75 and name   HA)  4.0  2.2  1.0 ! A.960  at  1.81e+06
assign (resid  41 and name HD1#) (resid  75 and name   HA)  3.0  1.2  0.8 ! A.938  at -2.01e+07
assign (resid  41 and name HG12) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1676 at -5.28e+06

! G42
assign (resid  42 and name   HN) (resid  43 and name  HA1)  3.0  1.2  1.8 ! A.968  at  5.43e+06
assign (resid  42 and name   HN) (resid  44 and name   HB)  4.0  2.2  1.3 ! A.969  at  2.55e+06 !! relaxed
assign (resid  42 and name   HN) (resid  44 and name   HN)  4.0  2.2  1.0 ! A.970  at  1.90e+06
assign (resid  42 and name   HN) (resid  45 and name  HE#)  3.0  1.2  1.0 ! A.1003 at -9.07e+06
assign (resid  42 and name  HA2) (resid  45 and name  HE#)  2.5  0.7  0.7 ! A.1002 at -3.85e+07
assign (resid  42 and name   HN) (resid  75 and name   HA)  3.0  1.2  0.5 ! A.971  at  5.43e+06
assign (resid  42 and name   HN) (resid  75 and name   HB)  4.0  2.2  1.0 ! A.972  at  1.81e+06
assign (resid  42 and name   HN) (resid  75 and name HG2#)  3.0  1.2  1.0 ! A.973  at  3.21e+06
assign (resid  42 and name  HA1) (resid  75 and name HG2#)  3.0  1.2  0.8 ! A.1487 at -5.81e+06
assign (resid  42 and name  HA2) (resid  75 and name HG2#)  3.0  1.2  0.8 ! A.1488 at -6.57e+06

! G43
assign (resid  43 and name   HN) (resid  44 and name   HN)  4.0  2.2  1.0 ! A.994  at  1.63e+06
assign (resid  43 and name  HA1) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.992  at  5.99e+06
assign (resid  43 and name  HA2) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.993  at  7.74e+06
assign (resid  43 and name   HN) (resid  44 and name HG2#)  3.0  1.2  1.5 ! A.984  at -4.12e+06

! V44
assign (resid  44 and name   HN) (resid  44 and name   HB)  3.0  1.2  0.5 ! A.996  at  9.28e+06
assign (resid  44 and name   HN) (resid  44 and name HG1#)  3.0  1.2  1.0 ! A.997  at  1.78e+07
assign (resid  44 and name   HN) (resid  44 and name HG2#)  3.0  1.2  1.0 ! A.998  at  1.06e+07
assign (resid  44 and name   HA) (resid  44 and name HG1#)  3.0  1.2  0.8 ! A.976  at -6.11e+06
assign (resid  44 and name   HA) (resid  44 and name HG2#)  3.0  1.2  0.8 ! A.977  at -7.27e+06
assign (resid  44 and name   HN) (resid  46 and name   HN)  3.0  1.2  0.8 ! A.1000 at  4.98e+06
assign (resid  44 and name   HN) (resid  46 and name  HB2)  4.0  2.2  1.3 ! A.999  at  4.32e+06 !! relaxed
assign (resid  44 and name HG1#) (resid  46 and name   HN)  4.0  2.2  1.5 ! A.1010 at  2.00e+06
assign (resid  44 and name   HA) (resid  47 and name  HB2)  3.0  1.2  0.3 ! A.979  at -4.54e+06
assign (resid  44 and name   HA) (resid  47 and name  HG1)  3.0  1.2  0.3 ! A.980  at -3.96e+06
assign (resid  44 and name HG2#) (resid  48 and name HD2#)  4.0  2.2  1.3 ! A.989  at -6.86e+06

! M45
assign (resid  45 and name  HE#) (resid  45 and name   HN)  3.0  1.2  1.0 ! A.1005 at -6.83e+06
assign (resid  45 and name  HE#) (resid  45 and name  HG1)  2.5  0.7  0.7 ! A.1004 at -2.94e+07
assign (resid  45 and name  HE#) (resid  46 and name   HN)  3.0  1.2  1.4 ! A.1006 at -3.48e+07
assign (resid  45 and name  HB1) (resid  46 and name   HN)  4.0  2.2  1.0 ! A.1011 at  1.88e+06
assign (resid  45 and name  HE#) (resid  62 and name  HB#)  3.0  1.2  1.3 ! A.1120 at -6.31e+06
assign (resid  45 and name  HE#) (resid  63 and name   HN)  4.0  2.2  1.1 ! A.1008 at -1.53e+07
assign (resid  45 and name  HE#) (resid  63 and name HD2#)  3.0  1.2  1.1 ! A.1007 at -8.76e+07
assign (resid  45 and name  HE#) (resid  75 and name HG2#)  2.5  0.7  1.2 ! A.1009 at -7.68e+07

! L46
assign (resid  46 and name   HN) (resid  46 and name HD1#)  4.0  2.2  1.5 ! A.1012 at  1.80e+06
assign (resid  46 and name   HN) (resid  46 and name HD2#)  4.0  2.2  1.5 ! A.1013 at  2.00e+06
assign (resid  46 and name HD2#) (resid  50 and name  HG1)  3.0  1.2  0.8 ! A.1057 at -3.74e+06
assign (resid  46 and name   HA) (resid  50 and name  HG2)  3.0  1.2  0.8 ! A.1056 at -5.22e+06
assign (resid  46 and name HD2#) (resid  50 and name  HG2)  3.0  1.2  0.8 ! A.1058 at -7.63e+06

! K47
assign (resid  47 and name   HN) (resid  48 and name   HN)  3.0  1.2  0.5 ! A.1045 at  4.59e+06
assign (resid  47 and name  HG1) (resid  48 and name   HN)  3.0  1.2  0.9 ! A.1044 at  4.19e+06
assign (resid  47 and name   HA) (resid  50 and name  HG2)  3.0  1.2  0.3 ! A.1059 at -5.22e+06

! L48
assign (resid  48 and name   HN) (resid  48 and name  HB1)  3.0  1.2  0.5 ! A.1047 at  5.28e+06
assign (resid  48 and name   HN) (resid  48 and name HD2#)  4.0  2.2  1.5 ! A.1048 at  1.83e+06
assign (resid  48 and name   HA) (resid  48 and name HD1#)  3.0  1.2  0.8 ! A.1017 at -3.66e+06
assign (resid  48 and name HD1#) (resid  48 and name   HN)  3.0  1.2  1.0 ! A.1030 at -5.06e+06
assign (resid  48 and name   HN) (resid  49 and name   HN)  3.0  1.2  0.5 ! A.1049 at  3.42e+06
assign (resid  48 and name HD1#) (resid  49 and name   HN)  3.0  1.2  1.4 ! A.1031 at -5.13e+06
assign (resid  48 and name HD2#) (resid  49 and name   HN)  4.0  2.2  1.5 ! A.1040 at -2.16e+06
assign (resid  48 and name HD2#) (resid  49 and name HG2#)  3.0  1.2  1.3 ! A.1039 at -1.39e+07
assign (resid  48 and name   HA) (resid  50 and name   HN)  4.0  2.2  1.0 ! A.1019 at -2.58e+06
assign (resid  48 and name   HA) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.1020 at -2.63e+06
assign (resid  48 and name   HA) (resid  51 and name  HG1)  3.0  1.2  0.6 ! A.1077 at -4.71e+06
assign (resid  48 and name   HA) (resid  52 and name   HN)  4.0  2.2  1.0 ! A.1021 at -2.63e+06
assign (resid  48 and name HD1#) (resid  92 and name  HB1)  3.0  1.2  1.2 ! A.1032 at -3.57e+06
assign (resid  48 and name HD2#) (resid  92 and name   HA)  4.0  2.2  1.5 ! A.1041 at -1.79e+06
assign (resid  48 and name HD2#) (resid  92 and name  HB1)  4.0  2.2  1.5 ! A.1042 at -1.55e+06
assign (resid  48 and name HD2#) (resid  92 and name  HB2)  4.0  2.2  1.5 ! A.1043 at -1.54e+06

! V49
assign (resid  49 and name HG2#) (resid  49 and name   HA)  3.0  1.2  0.8 ! A.1050 at -1.65e+07
assign (resid  49 and name HG2#) (resid  50 and name   HN)  3.0  1.2  1.0 ! A.1051 at -1.05e+07
assign (resid  49 and name   HB) (resid  51 and name   HN)  3.0  1.2  1.9 ! A.1087 at  5.32e+06
assign (resid  49 and name HG2#) (resid  51 and name   HN)  4.0  2.2  1.5 ! A.1088 at  2.76e+06

! E50
assign (resid  50 and name   HA) (resid  50 and name  HG1)  4.0  2.2  1.0 ! A.1053 at -2.71e+06
assign (resid  50 and name  HG2) (resid  50 and name   HA)  3.0  1.2  0.3 ! A.1061 at -1.48e+07
assign (resid  50 and name  HB1) (resid  51 and name   HN)  3.0  1.2  0.5 ! A.1055 at -7.81e+06
assign (resid  50 and name  HG1) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.1065 at -2.22e+06
assign (resid  50 and name  HG2) (resid  51 and name   HN)  3.0  1.2  1.5 ! A.1066 at -6.81e+06
assign (resid  50 and name   HA) (resid  51 and name   HN)  3.0  1.2  0.5 ! A.1089 at  3.61e+06
assign (resid  50 and name  HB2) (resid  51 and name   HN)  3.0  1.2  0.5 ! A.1090 at  5.32e+06
assign (resid  50 and name  HB1) (resid  51 and name  HG1)  3.0  1.2  1.2 ! A.1078 at -8.59e+06

! K51
assign (resid  51 and name   HN) (resid  51 and name  HB1)  3.0  1.2  0.5 ! A.1092 at  8.89e+06
assign (resid  51 and name   HN) (resid  51 and name  HD1)  3.0  1.2  1.4 ! A.1093 at  4.52e+06
assign (resid  51 and name   HN) (resid  51 and name  HE1)  4.0  2.2  1.0 ! A.1094 at  2.55e+06
assign (resid  51 and name   HN) (resid  51 and name  HG1)  3.0  1.2  0.5 ! A.1095 at  4.70e+06
assign (resid  51 and name  HD1) (resid  51 and name   HA)  3.0  1.2  1.5 ! A.1072 at -2.26e+07
assign (resid  51 and name  HD2) (resid  51 and name   HA)  3.0  1.2  1.7 ! A.1073 at -3.47e+06
assign (resid  51 and name  HD2) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.1075 at -2.44e+06
assign (resid  51 and name  HG1) (resid  51 and name   HA)  2.5  0.7  0.6 ! A.1079 at -3.18e+07
assign (resid  51 and name  HG1) (resid  51 and name  HE1)  2.5  0.7  0.2 ! A.1083 at -4.00e+07
assign (resid  51 and name  HG2) (resid  51 and name   HA)  3.0  1.2  0.3 ! A.1080 at -5.26e+06
assign (resid  51 and name  HG2) (resid  51 and name  HE1)  3.0  1.2  0.7 ! A.1084 at -6.59e+06

! L52

! D53
assign (resid  53 and name  HB1) (resid  53 and name   HN)  3.0  1.2  0.8 ! A.1099 at -4.10e+06
assign (resid  53 and name   HA) (resid  54 and name   HN)  2.5  0.7  0.4 ! A.1104 at  3.16e+07
assign (resid  53 and name  HB2) (resid  54 and name   HN)  3.0  1.2  1.4 ! A.1105 at  1.04e+07
assign (resid  53 and name   HA) (resid  54 and name HG1#)  3.0  1.2  0.8 ! A.1100 at -1.67e+07

! V54
assign (resid  54 and name   HN) (resid  54 and name   HB)  3.0  1.2  0.5 ! A.1106 at  8.52e+06
assign (resid  54 and name HG1#) (resid  54 and name   HA)  3.0  1.2  0.8 ! A.1101 at -2.39e+07
assign (resid  54 and name HG1#) (resid  54 and name   HN)  3.0  1.2  1.0 ! A.1102 at -1.54e+07
assign (resid  54 and name HG1#) (resid  56 and name   HN)  3.0  1.2  1.0 ! A.1103 at -8.48e+06

! K55
assign (resid  55 and name  HD1) (resid  55 and name   HA)  3.0  1.2  0.8 ! A.1107 at -1.62e+07
assign (resid  55 and name  HG1) (resid  55 and name   HA)  3.0  1.2  0.3 ! A.1108 at -1.88e+07
assign (resid  55 and name  HG1) (resid  55 and name  HE1)  2.5  0.7  0.2 ! A.1110 at -4.43e+07
assign (resid  55 and name  HG2) (resid  55 and name   HA)  3.0  1.2  0.3 ! A.1109 at -1.63e+07

! K56
assign (resid  56 and name   HA) (resid  57 and name   HN)  3.0  1.2  0.5 ! A.1107 at  1.38e+07
assign (resid  56 and name   HN) (resid  57 and name   HN)  3.0  1.2  1.6 ! A.1110 at  5.52e+06
assign (resid  56 and name  HB1) (resid  57 and name   HN)  4.0  2.2  1.0 ! A.1108 at  1.40e+06
assign (resid  56 and name  HB2) (resid  57 and name   HN)  3.0  1.2  0.9 ! A.1109 at  5.96e+06

! D57
assign (resid  57 and name   HN) (resid  57 and name  HB1)  3.0  1.2  0.5 ! A.1111 at  9.16e+06
assign (resid  57 and name   HN) (resid  57 and name  HB2)  3.0  1.2  0.5 ! A.1112 at  8.38e+06

! W65  (added)

! S59
assign (resid  59 and name   HN) (resid  59 and name  HB1)  3.0  1.2  0.5 ! A.1113 at  3.51e+06
assign (resid  59 and name   HN) (resid  59 and name  HB2)  3.0  1.2  0.5 ! A.1114 at  3.51e+06

! D60
assign (resid  60 and name   HN) (resid  60 and name  HB1)  4.0  2.2  1.0 ! A.1115 at  2.24e+06

! H61
assign (resid  61 and name   HN) (resid  61 and name  HB1)  3.0  1.2  0.5 ! A.1117 at  3.50e+06
assign (resid  61 and name   HN) (resid  61 and name  HB2)  3.0  1.2  0.5 ! A.1118 at  7.17e+06
assign (resid  61 and name   HA) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1125 at  2.98e+06
assign (resid  61 and name   HN) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1128 at  2.31e+06
assign (resid  61 and name  HB1) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1126 at  1.30e+06
assign (resid  61 and name  HB2) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1127 at  2.42e+06
assign (resid  61 and name   HA) (resid  62 and name  HB#)  3.0  1.2  0.8 ! A.1121 at -4.93e+06
assign (resid  61 and name   HN) (resid  94 and name   HA)  3.0  1.2  0.9 ! A.1119 at  4.52e+06

! A62
assign (resid  62 and name   HN) (resid  62 and name  HB#)  3.0  1.2  1.0 ! A.1130 at  7.15e+06
assign (resid  62 and name   HN) (resid  63 and name HD1#)  4.0  2.2  1.5 ! A.1131 at  2.51e+06
assign (resid  62 and name  HB#) (resid  63 and name   HN)  3.0  1.2  1.0 ! A.1124 at -1.20e+07
assign (resid  62 and name   HN) (resid  92 and name   HA)  4.0  2.2  1.0 ! A.1132 at  1.39e+06
assign (resid  62 and name   HN) (resid  94 and name   HA)  3.0  1.2  1.0 ! A.1133 at  4.30e+06

! L63
assign (resid  63 and name   HN) (resid  63 and name   HG)  3.0  1.2  0.8 ! A.1140 at  6.59e+06
assign (resid  63 and name   HN) (resid  63 and name HD1#)  3.0  1.2  1.0 ! A.1139 at  8.37e+06
assign (resid  63 and name HD1#) (resid  63 and name   HA)  3.0  1.2  0.8 ! A.1134 at -2.00e+07
assign (resid  63 and name HD1#) (resid  63 and name  HB2)  3.0  1.2  0.8 ! A.1135 at -1.91e+07
assign (resid  63 and name   HN) (resid  64 and name   HN)  4.0  2.2  1.0 ! A.1141 at  2.79e+06
assign (resid  63 and name HD1#) (resid  64 and name   HN)  3.0  1.2  1.0 ! A.1136 at -8.10e+06
assign (resid  63 and name   HA) (resid  64 and name   HN)  3.0  1.2  0.5 ! A.1144 at  4.45e+06
assign (resid  63 and name   HG) (resid  64 and name   HN)  4.0  2.2  1.0 ! A.1147 at  2.68e+06
assign (resid  63 and name  HB1) (resid  64 and name   HN)  4.0  2.2  1.0 ! A.1145 at  2.78e+06
assign (resid  63 and name  HB2) (resid  72 and name   HN)  4.0  2.2  1.3 ! A.1432 at  3.92e+06
assign (resid  63 and name   HA) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1404 at -4.25e+06
assign (resid  63 and name   HG) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1407 at -1.34e+07
assign (resid  63 and name  HB1) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1405 at -1.20e+07
assign (resid  63 and name  HB2) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1406 at -2.40e+07
assign (resid  63 and name  HB2) (resid  72 and name HD2#)  3.0  1.2  1.5 ! A.1419 at -4.75e+07
assign (resid  63 and name HD1#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1881 at  1.03e+07
assign (resid  63 and name   HA) (resid  93 and name   HN)  3.0  1.2  0.5 ! A.1933 at  6.15e+06

! W64
assign (resid  64 and name   HN) (resid  64 and name  HB1)  3.0  1.2  0.5 ! A.1148 at  3.45e+06
assign (resid  64 and name   HN) (resid  64 and name  HB2)  3.0  1.2  1.0 ! A.1149 at  3.79e+06
assign (resid  64 and name  HE1) (resid  64 and name  HB2)  4.0  2.2  1.3 ! A.1158 at  5.83e+06
assign (resid  64 and name   HN) (resid  65 and name   HN)  3.0  1.2  1.5 ! A.1164 at  3.76e+06
!assign (resid  64 and name   HN) (resid  65 and name  HE1)  4.0  2.2  1.0 ! A.1150 at  1.39e+06
assign (resid  64 and name   HA) (resid  65 and name  HB2)  4.0  2.2  1.0 ! A.1142 at -2.65e+06
assign (resid  64 and name   HA) (resid  65 and name   HN)  3.0  1.2  0.5 ! A.1161 at  6.12e+06
assign (resid  64 and name  HB1) (resid  65 and name   HN)  4.0  2.2  1.0 ! A.1162 at  2.76e+06
assign (resid  64 and name  HB2) (resid  65 and name   HN)  3.0  1.2  0.5 ! A.1163 at  1.09e+07
assign (resid  64 and name  HE1) (resid  66 and name   HA)  3.0  1.2  0.3 ! A.1159 at  3.62e+06
assign (resid  64 and name  HE1) (resid  66 and name   HN)  4.0  2.2  1.0 ! A.1160 at  1.62e+06
assign (resid  64 and name  HE1) (resid  66 and name  HG1)  3.0  1.2  1.3 ! A.1200 at -5.14e+06
assign (resid  64 and name  HE1) (resid  66 and name  HG2)  3.0  1.2  0.3 ! A.1201 at -5.56e+06
assign (resid  64 and name   HA) (resid  70 and name   HN)  3.0  1.2  1.3 ! A.1356 at  4.44e+06
assign (resid  64 and name  HB1) (resid  70 and name   HN)  4.0  2.2  1.8 ! A.1357 at  2.14e+06
assign (resid  64 and name  HB2) (resid  70 and name   HN)  3.0  1.2  1.5 ! A.1358 at  8.83e+06
assign (resid  64 and name   HA) (resid  70 and name   HB)  4.0  2.2  1.8 ! A.1327 at -2.95e+06
assign (resid  64 and name  HB2) (resid  70 and name   HB)  4.0  2.2  2.3 ! A.1328 at -5.58e+06
assign (resid  64 and name   HA) (resid  70 and name HG2#)  3.0  1.2  0.8 ! A.1340 at -6.98e+06
assign (resid  64 and name  HB2) (resid  70 and name HG2#)  3.0  1.2  1.2 ! A.1341 at -1.74e+07
assign (resid  64 and name   HN) (resid  71 and name   HA)  4.0  2.2  1.0 ! A.1152 at  2.60e+06
assign (resid  64 and name  HB1) (resid  71 and name   HA)  3.0  1.2  0.8 ! A.1143 at -1.30e+07
assign (resid  64 and name   HA) (resid  71 and name   HN)  3.0  1.2  1.5 ! A.1379 at  4.68e+06
assign (resid  64 and name   HN) (resid  72 and name HD1#)  4.0  2.2  1.5 ! A.1153 at  2.36e+06
assign (resid  64 and name   HA) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1433 at  3.01e+06
assign (resid  64 and name   HN) (resid  90 and name   HA)  4.0  2.2  1.0 ! A.1154 at  1.67e+06
assign (resid  64 and name   HN) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1155 at  3.69e+06
assign (resid  64 and name  HE1) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1898 at  2.03e+06
assign (resid  64 and name   HN) (resid  91 and name HE22)  4.0  2.2  1.6 ! A.1899 at  2.17e+06
assign (resid  64 and name   HN) (resid  92 and name   HA)  3.0  1.2  1.2 ! A.1156 at  4.23e+06
assign (resid  64 and name   HN) (resid  93 and name HG2#)  3.0  1.2  1.0 ! A.1157 at  3.22e+06
assign (resid  64 and name  HB1) (resid  93 and name HG2#)  3.0  1.2  0.8 ! A.1930 at -1.07e+07

! W65
assign (resid  65 and name   HN) (resid  65 and name  HB1)  3.0  1.2  0.5 ! A.1166 at  9.70e+06
assign (resid  65 and name   HN) (resid  65 and name  HB2)  3.0  1.2  0.5 ! A.1167 at  9.70e+06
assign (resid  65 and name  HE1) (resid  65 and name   HA)  3.0  1.2  1.7 ! A.1180 at  1.04e+07
assign (resid  65 and name  HE1) (resid  65 and name  HB1)  4.0  2.2  1.2 ! A.1181 at  3.60e+06
assign (resid  65 and name   HN) (resid  66 and name   HN)  4.0  2.2  1.0 ! A.1168 at  2.42e+06
assign (resid  65 and name  HE1) (resid  66 and name   HN)  4.0  2.2  1.5 ! A.1182 at  3.46e+06
assign (resid  65 and name   HA) (resid  66 and name   HN)  4.0  2.2  1.0 ! A.1213 at  2.30e+06
assign (resid  65 and name   HA) (resid  66 and name  HG1)  4.0  2.2  1.0 ! A.1202 at -2.43e+06
assign (resid  65 and name   HA) (resid  66 and name  HG2)  4.0  2.2  1.0 ! A.1203 at -2.20e+06
assign (resid  65 and name   HN) (resid  67 and name   HN)  4.0  2.2  1.3 ! A.1169 at  2.72e+06
assign (resid  65 and name  HE1) (resid  67 and name   HA)  3.0  1.2  1.7 ! A.1183 at  4.07e+06
assign (resid  65 and name  HE1) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1190 at  1.12e+07
assign (resid  65 and name  HE1) (resid  67 and name  HB1)  3.0  1.2  0.6 ! A.1184 at  1.58e+07
assign (resid  65 and name  HE1) (resid  67 and name  HB2)  3.0  1.2  0.3 ! A.1185 at  1.12e+07
assign (resid  65 and name  HE1) (resid  67 and name  HD1)  3.0  1.2  1.1 ! A.1186 at  9.47e+06
assign (resid  65 and name  HE1) (resid  67 and name  HE1)  3.0  1.2  0.3 ! A.1187 at  3.73e+06
assign (resid  65 and name  HE1) (resid  67 and name  HG1)  3.0  1.2  0.3 ! A.1188 at  7.09e+06
assign (resid  65 and name  HE1) (resid  67 and name  HG2)  3.0  1.2  0.3 ! A.1189 at  2.09e+07
assign (resid  65 and name   HA) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1240 at  6.40e+06
assign (resid  65 and name  HE1) (resid  68 and name  HE1)  3.0  1.2  1.0 ! A.1191 at  3.80e+06
assign (resid  65 and name  HE1) (resid  68 and name  HG1)  4.0  2.2  1.2 ! A.1192 at  6.61e+06
assign (resid  65 and name   HA) (resid  68 and name   HN)  3.0  1.2  1.4 ! A.1295 at  2.04e+07
assign (resid  65 and name  HE1) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.1296 at  3.08e+06
assign (resid  65 and name   HA) (resid  68 and name   HA)  4.0  2.2  3.0 ! A.1257 at -3.35e+06
assign (resid  65 and name   HA) (resid  68 and name  HG1)  4.0  2.2  1.3 ! A.1283 at -3.04e+06
assign (resid  65 and name   HA) (resid  68 and name  HG2)  3.0  1.2  1.6 ! A.1284 at -4.85e+06
assign (resid  65 and name   HN) (resid  69 and name   HN)  4.0  2.2  1.0 ! A.1170 at  3.07e+06
assign (resid  65 and name   HA) (resid  69 and name   HN)  3.0  1.2  1.8 ! A.1315 at  9.24e+06
assign (resid  65 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1172 at  5.78e+06
assign (resid  65 and name   HN) (resid  70 and name HG2#)  3.0  1.2  1.0 ! A.1171 at  7.93e+06
assign (resid  65 and name   HA) (resid  70 and name   HN)  3.0  1.2  1.7 ! A.1359 at  9.00e+06
assign (resid  65 and name  HB1) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1360 at  1.57e+07
assign (resid  65 and name  HB2) (resid  70 and name   HN)  3.0  1.2  1.4 ! A.1361 at  1.57e+07
assign (resid  65 and name   HN) (resid  70 and name   HB)  3.0  1.2  1.2 ! A.1330 at -3.45e+06
assign (resid  65 and name  HB1) (resid  70 and name   HB)  3.0  1.2  0.8 ! A.1329 at -7.37e+06
assign (resid  65 and name  HB1) (resid  70 and name HG2#)  2.5  0.7  0.7 ! A.1342 at -2.82e+07
assign (resid  65 and name  HB2) (resid  70 and name HG2#)  2.5  0.7  0.7 ! A.1343 at -2.88e+07
assign (resid  65 and name   HN) (resid  71 and name   HA)  3.0  1.2  1.0 ! A.1173 at  1.21e+07
assign (resid  65 and name   HN) (resid  71 and name   HN)  4.0  2.2  1.0 ! A.1174 at  2.42e+06
assign (resid  65 and name   HN) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1178 at  2.64e+06
assign (resid  65 and name   HN) (resid  72 and name  HB2)  4.0  2.2  1.3 ! A.1175 at  4.41e+06
assign (resid  65 and name   HN) (resid  72 and name HD1#)  3.0  1.2  1.0 ! A.1176 at  7.50e+06
assign (resid  65 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.0 ! A.1177 at  5.26e+06
assign (resid  65 and name  HB2) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1434 at  2.36e+06
assign (resid  65 and name  HB2) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1408 at -8.08e+06
assign (resid  65 and name  HB2) (resid  72 and name HD2#)  3.0  1.2  0.8 ! A.1420 at -1.24e+07
assign (resid  65 and name  HE1) (resid  84 and name HG2#)  3.0  1.2  1.8 ! A.1193 at  6.48e+06
assign (resid  65 and name  HE1) (resid  88 and name   HA)  3.0  1.2  0.3 ! A.1194 at  7.24e+06
assign (resid  65 and name  HE1) (resid  88 and name  HB#)  3.0  1.2  0.8 ! A.1195 at  1.59e+07
assign (resid  65 and name  HE1) (resid  89 and name   HN)  3.0  1.2  1.2 ! A.1196 at  5.22e+06
assign (resid  65 and name   HN) (resid  90 and name HD2#)  3.0  1.2  1.5 ! A.1179 at  7.50e+06
assign (resid  65 and name  HE1) (resid  90 and name HD2#)  3.0  1.2  0.8 ! A.1197 at  7.25e+06
assign (resid  65 and name   HA) (resid  90 and name HD2#)  3.0  1.2  0.8 ! A.1830 at -6.70e+06
assign (resid  65 and name  HB2) (resid  90 and name HD2#)  3.0  1.2  0.8 ! A.1831 at -3.65e+06

! E66
assign (resid  66 and name   HN) (resid  66 and name  HB1)  3.0  1.2  0.5 ! A.1214 at  3.76e+06
assign (resid  66 and name   HN) (resid  66 and name  HG1)  3.0  1.2  0.5 ! A.1215 at  3.76e+06
assign (resid  66 and name   HN) (resid  66 and name  HG2)  3.0  1.2  0.5 ! A.1216 at  3.76e+06
assign (resid  66 and name   HA) (resid  66 and name  HG2)  4.0  2.2  1.0 ! A.1199 at -1.88e+06
assign (resid  66 and name  HG1) (resid  66 and name   HA)  3.0  1.2  0.7 ! A.1204 at -6.52e+06
assign (resid  66 and name  HG1) (resid  67 and name   HA)  3.0  1.2  0.6 ! A.1208 at -3.39e+06
assign (resid  66 and name  HG1) (resid  67 and name   HN)  4.0  2.2  1.0 ! A.1210 at -2.93e+06
assign (resid  66 and name  HG2) (resid  67 and name   HA)  4.0  2.2  1.0 ! A.1209 at -1.96e+06
assign (resid  66 and name  HG2) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1211 at -5.10e+06
assign (resid  66 and name   HA) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1242 at  4.49e+06
assign (resid  66 and name   HN) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1246 at  3.48e+06
assign (resid  66 and name  HB1) (resid  67 and name   HN)  3.0  1.2  1.2 ! A.1243 at  1.11e+07
assign (resid  66 and name  HB2) (resid  67 and name   HN)  3.0  1.2  1.0 ! A.1244 at  1.02e+07
assign (resid  66 and name   HN) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.1297 at  2.35e+06
assign (resid  66 and name  HB1) (resid  69 and name   HN)  3.0  1.2  1.5 ! A.1316 at  4.53e+06
assign (resid  66 and name  HG2) (resid  69 and name   HN)  4.0  2.2  1.1 ! A.1317 at  4.90e+06
assign (resid  66 and name  HB1) (resid  69 and name  HD1)  4.0  2.2  1.3 ! A.1308 at -5.73e+06
assign (resid  66 and name  HG1) (resid  69 and name  HD1)  4.0  2.2  1.7 ! A.1309 at -3.16e+06

! K67
assign (resid  67 and name   HN) (resid  67 and name  HB1)  3.0  1.2  0.7 ! A.1248 at  1.65e+07
assign (resid  67 and name   HN) (resid  67 and name  HB2)  3.0  1.2  0.5 ! A.1249 at  7.54e+06
assign (resid  67 and name   HN) (resid  67 and name  HG1)  3.0  1.2  0.8 ! A.1250 at  8.65e+06
assign (resid  67 and name   HN) (resid  67 and name  HG2)  3.0  1.2  0.5 ! A.1251 at  7.62e+06
assign (resid  67 and name   HA) (resid  67 and name  HD1)  3.0  1.2  0.3 ! A.1219 at -1.26e+07
assign (resid  67 and name   HA) (resid  67 and name  HE1)  4.0  2.2  1.0 ! A.1220 at -2.95e+06
assign (resid  67 and name   HA) (resid  67 and name  HG1)  3.0  1.2  0.8 ! A.1221 at -1.25e+07
assign (resid  67 and name  HD1) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1229 at -7.15e+06
assign (resid  67 and name  HG1) (resid  67 and name  HE1)  3.0  1.2  0.3 ! A.1236 at -1.31e+07
assign (resid  67 and name  HG2) (resid  67 and name   HA)  3.0  1.2  0.3 ! A.1233 at -1.81e+07
assign (resid  67 and name  HG2) (resid  67 and name  HE1)  2.5  0.7  0.2 ! A.1237 at -4.29e+07
assign (resid  67 and name   HN) (resid  68 and name   HN)  3.0  1.2  0.5 ! A.1254 at  4.10e+06
assign (resid  67 and name   HN) (resid  68 and name  HG1)  4.0  2.2  1.0 ! A.1252 at  3.02e+06
assign (resid  67 and name   HN) (resid  68 and name  HG2)  4.0  2.2  1.0 ! A.1253 at  3.02e+06
assign (resid  67 and name   HA) (resid  68 and name  HG2)  4.0  2.2  1.0 ! A.1223 at -2.39e+06
assign (resid  67 and name   HA) (resid  68 and name   HN)  3.0  1.2  0.5 ! A.1298 at  5.02e+06
assign (resid  67 and name  HB2) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.1299 at  2.30e+06
assign (resid  67 and name   HN) (resid  69 and name   HN)  3.0  1.2  0.5 ! A.1255 at  4.10e+06
assign (resid  67 and name   HN) (resid  70 and name   HN)  4.0  2.2  1.3 ! A.1256 at  1.76e+06

! K68
assign (resid  68 and name   HN) (resid  68 and name  HB2)  3.0  1.2  0.5 ! A.1302 at  5.64e+06
assign (resid  68 and name   HN) (resid  68 and name  HD1)  3.0  1.2  0.8 ! A.1303 at  7.07e+06
assign (resid  68 and name   HN) (resid  68 and name  HG1)  3.0  1.2  0.8 ! A.1304 at  5.45e+06
assign (resid  68 and name   HN) (resid  68 and name  HG2)  3.0  1.2  0.5 ! A.1305 at  5.45e+06
assign (resid  68 and name   HA) (resid  68 and name  HD1)  3.0  1.2  0.3 ! A.1260 at -1.06e+07
assign (resid  68 and name   HA) (resid  68 and name  HG1)  3.0  1.2  1.0 ! A.1261 at -9.95e+06
assign (resid  68 and name   HA) (resid  68 and name  HG2)  3.0  1.2  0.3 ! A.1262 at -7.76e+06
assign (resid  68 and name  HB1) (resid  68 and name  HD1)  3.0  1.2  0.3 ! A.1266 at -4.78e+06
assign (resid  68 and name  HD1) (resid  68 and name  HB2)  3.0  1.2  0.7 ! A.1271 at -1.45e+07
assign (resid  68 and name  HE1) (resid  68 and name  HG1)  2.5  0.7  0.2 ! A.1279 at -3.48e+07
assign (resid  68 and name  HE1) (resid  68 and name  HG2)  2.5  0.7  0.2 ! A.1281 at -3.93e+07
assign (resid  68 and name  HE2) (resid  68 and name  HG1)  2.5  0.7  1.0 ! A.1280 at -3.30e+07
assign (resid  68 and name  HE2) (resid  68 and name  HG2)  2.5  0.7  0.2 ! A.1282 at -3.30e+07
assign (resid  68 and name   HA) (resid  69 and name   HN)  3.0  1.2  0.5 ! A.1319 at  5.29e+06
assign (resid  68 and name  HB2) (resid  69 and name   HN)  3.0  1.2  0.5 ! A.1320 at  5.64e+06
assign (resid  68 and name   HA) (resid  69 and name  HD1)  3.0  1.2  0.6 ! A.1310 at -3.55e+06
assign (resid  68 and name   HA) (resid  70 and name   HN)  3.0  1.2  1.7 ! A.1364 at  4.98e+06
assign (resid  68 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.8 ! A.1367 at  1.96e+07
assign (resid  68 and name  HB2) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1365 at  5.53e+06
assign (resid  68 and name  HG1) (resid  70 and name   HN)  3.0  1.2  1.9 ! A.1366 at  7.79e+06
assign (resid  68 and name   HN) (resid  70 and name   HB)  4.0  2.2  1.0 ! A.1333 at -4.42e+06
assign (resid  68 and name  HB1) (resid  70 and name   HB)  3.0  1.2  0.3 ! A.1331 at -5.35e+06
assign (resid  68 and name  HB2) (resid  70 and name   HB)  3.0  1.2  0.3 ! A.1332 at -6.70e+06
assign (resid  68 and name   HA) (resid  70 and name HG2#)  3.0  1.2  1.9 ! A.1345 at -1.17e+07

! R69
assign (resid  69 and name   HN) (resid  69 and name  HB1)  3.0  1.2  1.1 ! A.1322 at  1.58e+07
assign (resid  69 and name   HN) (resid  69 and name  HB2)  3.0  1.2  0.5 ! A.1323 at  2.50e+07
assign (resid  69 and name   HN) (resid  69 and name  HD1)  3.0  1.2  0.5 ! A.1324 at  1.31e+07
assign (resid  69 and name  HD1) (resid  69 and name  HB1)  2.5  0.7  1.1 ! A.1311 at -6.28e+07
assign (resid  69 and name  HD1) (resid  69 and name  HB2)  2.5  0.7  0.2 ! A.1312 at -1.19e+08
assign (resid  69 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1325 at  1.46e+07
assign (resid  69 and name  HD1) (resid  70 and name   HN)  3.0  1.2  1.7 ! A.1314 at -1.02e+07
assign (resid  69 and name   HA) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1368 at  2.00e+07
assign (resid  69 and name  HB1) (resid  70 and name   HN)  3.0  1.2  1.4 ! A.1369 at  1.22e+07
assign (resid  69 and name  HB2) (resid  70 and name   HN)  3.0  1.2  1.3 ! A.1370 at  1.35e+07
assign (resid  69 and name   HN) (resid  70 and name   HB)  3.0  1.2  1.5 ! A.1334 at -4.42e+06
assign (resid  69 and name   HA) (resid  70 and name HG2#)  3.0  1.2  1.6 ! A.1346 at -1.12e+07

! T70
assign (resid  70 and name   HN) (resid  70 and name   HB)  3.0  1.2  0.5 ! A.1373 at  1.42e+07
assign (resid  70 and name   HN) (resid  70 and name HG2#)  3.0  1.2  1.0 ! A.1374 at  2.30e+07
assign (resid  70 and name HG2#) (resid  70 and name   HA)  2.5  0.7  0.7 ! A.1347 at -4.76e+07
assign (resid  70 and name   HN) (resid  71 and name   HA)  4.0  2.2  1.1 ! A.1375 at  9.92e+06
assign (resid  70 and name   HN) (resid  71 and name   HN)  3.0  1.2  1.4 ! A.1376 at  7.37e+06
assign (resid  70 and name   HA) (resid  71 and name   HN)  3.0  1.2  0.5 ! A.1380 at  1.41e+07
assign (resid  70 and name   HB) (resid  71 and name   HN)  3.0  1.2  0.5 ! A.1338 at -7.67e+06
assign (resid  70 and name HG2#) (resid  71 and name   HN)  2.5  0.7  0.9 ! A.1350 at -3.05e+07
assign (resid  70 and name   HB) (resid  71 and name  HE1)  4.0  2.2  2.1 ! A.1394 at  6.06e+06
assign (resid  70 and name   HN) (resid  72 and name HD1#)  4.0  2.2  1.5 ! A.1377 at  4.22e+06
assign (resid  70 and name   HN) (resid  72 and name HD2#)  3.0  1.2  2.0 ! A.1378 at  7.79e+06
assign (resid  70 and name   HB) (resid  72 and name HD2#)  3.0  1.2  1.4 ! A.1339 at -1.20e+07
assign (resid  70 and name HG2#) (resid  72 and name   HA)  3.0  1.2  0.8 ! A.1351 at -1.11e+07
assign (resid  70 and name HG2#) (resid  72 and name   HN)  3.0  1.2  1.0 ! A.1354 at -6.71e+06
assign (resid  70 and name HG2#) (resid  72 and name HD1#)  3.0  1.2  1.3 ! A.1352 at -1.74e+07
assign (resid  70 and name HG2#) (resid  72 and name HD2#)  2.5  0.7  1.2 ! A.1353 at -8.58e+07
assign (resid  70 and name HG2#) (resid  74 and name  HE1)  4.0  2.2  1.4 ! A.1355 at -9.77e+06

! W71
assign (resid  71 and name   HN) (resid  71 and name  HB1)  3.0  1.2  0.5 ! A.1385 at  8.69e+06
assign (resid  71 and name   HN) (resid  71 and name  HB2)  3.0  1.2  0.8 ! A.1386 at  8.71e+06
assign (resid  71 and name   HN) (resid  71 and name  HE1)  4.0  2.2  1.0 ! A.1387 at  2.39e+06
assign (resid  71 and name  HE1) (resid  71 and name   HA)  4.0  2.2  1.9 ! A.1395 at  6.98e+06
assign (resid  71 and name  HE1) (resid  71 and name  HB1)  4.0  2.2  1.3 ! A.1396 at  7.19e+06
assign (resid  71 and name  HE1) (resid  71 and name  HB2)  3.0  1.2  1.8 ! A.1397 at  7.03e+06
assign (resid  71 and name   HN) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1390 at  1.63e+06
assign (resid  71 and name   HN) (resid  72 and name HD1#)  4.0  2.2  1.9 ! A.1388 at  1.38e+06
assign (resid  71 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.5 ! A.1425 at -4.02e+06
assign (resid  71 and name   HA) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1435 at  2.45e+06
assign (resid  71 and name  HB2) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1436 at  2.36e+06
assign (resid  71 and name   HA) (resid  72 and name HD1#)  3.0  1.2  1.8 ! A.1410 at -7.89e+06
assign (resid  71 and name   HA) (resid  72 and name HD2#)  3.0  1.2  1.9 ! A.1424 at -1.03e+07
assign (resid  71 and name   HN) (resid  73 and name   HG)  3.0  1.2  1.5 ! A.1393 at  3.33e+06
assign (resid  71 and name   HN) (resid  73 and name  HB1)  4.0  2.2  2.0 ! A.1391 at  3.33e+06
assign (resid  71 and name   HN) (resid  73 and name HD2#)  3.0  1.2  1.0 ! A.1392 at  5.72e+06
assign (resid  71 and name  HE1) (resid  73 and name   HG)  3.0  1.2  1.3 ! A.1401 at  5.01e+06
assign (resid  71 and name  HE1) (resid  73 and name HD1#)  3.0  1.2  0.8 ! A.1399 at  6.86e+06
assign (resid  71 and name  HE1) (resid  73 and name HD2#)  3.0  1.2  0.8 ! A.1400 at  6.17e+06
assign (resid  71 and name   HA) (resid  73 and name   HN)  3.0  1.2  1.8 ! A.1449 at  8.17e+06
assign (resid  71 and name  HB2) (resid  73 and name HD2#)  3.0  1.2  0.8 ! A.1445 at -1.87e+07

! L72
assign (resid  72 and name   HN) (resid  72 and name   HG)  3.0  1.2  0.5 ! A.1441 at  4.37e+06
assign (resid  72 and name   HN) (resid  72 and name  HB2)  3.0  1.2  0.5 ! A.1438 at  5.06e+06
assign (resid  72 and name   HN) (resid  72 and name HD1#)  3.0  1.2  1.0 ! A.1439 at  4.65e+06
assign (resid  72 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.0 ! A.1440 at  3.81e+06
assign (resid  72 and name   HA) (resid  72 and name HD2#)  3.0  1.2  0.8 ! A.1402 at -4.25e+06
assign (resid  72 and name HD1#) (resid  72 and name   HA)  3.0  1.2  0.8 ! A.1411 at -7.26e+06
assign (resid  72 and name HD1#) (resid  72 and name  HB2)  2.5  0.7  0.7 ! A.1412 at -4.35e+07
assign (resid  72 and name HD2#) (resid  72 and name  HB2)  3.0  1.2  0.8 ! A.1427 at -2.08e+07
assign (resid  72 and name HD1#) (resid  73 and name   HN)  4.0  2.2  1.5 ! A.1416 at -7.05e+06
assign (resid  72 and name HD2#) (resid  73 and name   HN)  3.0  1.2  1.5 ! A.1430 at -1.55e+07
assign (resid  72 and name   HA) (resid  73 and name   HN)  3.0  1.2  0.5 ! A.1450 at  9.39e+06
assign (resid  72 and name   HG) (resid  73 and name   HN)  3.0  1.2  1.7 ! A.1454 at  5.17e+06
assign (resid  72 and name   HN) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.1455 at  2.33e+06
assign (resid  72 and name  HB1) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.1451 at  3.20e+06
assign (resid  72 and name HD1#) (resid  84 and name HG12)  4.0  2.2  1.5 ! A.1417 at -2.49e+06
assign (resid  72 and name HD2#) (resid  84 and name HG12)  3.0  1.2  0.8 ! A.1431 at -3.68e+06
assign (resid  72 and name HD2#) (resid  90 and name HD2#)  3.0  1.2  1.3 ! A.1834 at -8.57e+06

! L73
assign (resid  73 and name   HN) (resid  73 and name   HG)  3.0  1.2  0.5 ! A.1460 at  1.89e+07
assign (resid  73 and name   HN) (resid  73 and name  HB1)  3.0  1.2  0.5 ! A.1457 at  2.19e+07
assign (resid  73 and name   HN) (resid  73 and name HD1#)  3.0  1.2  1.0 ! A.1458 at  2.24e+07
assign (resid  73 and name   HN) (resid  73 and name HD2#)  3.0  1.2  1.0 ! A.1459 at  2.21e+07
assign (resid  73 and name  HB1) (resid  73 and name HD1#)  3.0  1.2  0.8 ! A.1442 at -5.45e+06
assign (resid  73 and name HD1#) (resid  73 and name   HA)  2.5  0.7  1.2 ! A.1443 at -4.63e+07
assign (resid  73 and name HD2#) (resid  73 and name   HA)  3.0  1.2  1.1 ! A.1446 at -3.96e+07
assign (resid  73 and name HD2#) (resid  73 and name  HB1)  2.5  0.7  0.7 ! A.1447 at -6.19e+07
assign (resid  73 and name   HN) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.1461 at  5.52e+06
assign (resid  73 and name HD1#) (resid  74 and name  HD2)  3.0  1.2  0.8 ! A.1462 at -5.62e+06
assign (resid  73 and name HD1#) (resid  74 and name  HE1)  3.0  1.2  0.8 ! A.1472 at -7.77e+06
assign (resid  73 and name HD1#) (resid  74 and name  HE2)  3.0  1.2  0.8 ! A.1473 at -1.10e+07

! K74
assign (resid  74 and name   HN) (resid  74 and name  HB1)  3.0  1.2  0.5 ! A.1486 at  6.03e+06
assign (resid  74 and name  HD1) (resid  74 and name   HA)  3.0  1.2  0.3 ! A.1463 at -3.89e+06
assign (resid  74 and name  HD1) (resid  74 and name  HB1)  3.0  1.2  0.8 ! A.1465 at -4.94e+06
assign (resid  74 and name  HD2) (resid  74 and name   HA)  4.0  2.2  1.0 ! A.1464 at -2.06e+06
assign (resid  74 and name  HD2) (resid  74 and name  HB1)  4.0  2.2  1.0 ! A.1466 at -3.11e+06
assign (resid  74 and name  HE1) (resid  74 and name   HA)  3.0  1.2  0.7 ! A.1474 at -4.74e+06
assign (resid  74 and name  HE1) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.1479 at -6.20e+06
assign (resid  74 and name  HE2) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.1480 at -3.67e+06
assign (resid  74 and name  HG2) (resid  74 and name   HN)  4.0  2.2  1.0 ! A.1484 at -2.03e+06
assign (resid  74 and name  HG2) (resid  74 and name  HE1)  3.0  1.2  0.3 ! A.1482 at -3.93e+06

! T75
assign (resid  75 and name HG2#) (resid  75 and name   HA)  3.0  1.2  0.8 ! A.1491 at -5.81e+06
assign (resid  75 and name   HA) (resid  76 and name   HN)  4.0  2.2  1.0 ! A.1493 at  1.52e+06
assign (resid  75 and name   HB) (resid  76 and name   HN)  4.0  2.2  1.0 ! A.1494 at  1.23e+06
assign (resid  75 and name HG2#) (resid  77 and name   HN)  4.0  2.2  1.5 ! A.1496 at  2.04e+06

! H76
assign (resid  76 and name   HN) (resid  77 and name   HN)  4.0  2.2  1.0 ! A.1495 at  2.40e+06
assign (resid  76 and name   HA) (resid  77 and name   HN)  3.0  1.2  0.5 ! A.1497 at  4.15e+06

! W77
assign (resid  77 and name   HN) (resid  77 and name  HB1)  4.0  2.2  1.0 ! A.1499 at  2.06e+06
assign (resid  77 and name   HN) (resid  77 and name  HB2)  4.0  2.2  1.0 ! A.1500 at  1.51e+06
assign (resid  77 and name   HN) (resid  78 and name   HN)  3.0  1.2  1.2 ! A.1522 at  4.40e+06
assign (resid  77 and name  HE1) (resid  78 and name   HN)  4.0  2.2  2.3 ! A.1502 at  1.71e+06
assign (resid  77 and name   HA) (resid  78 and name   HN)  3.0  1.2  0.5 ! A.1518 at  1.65e+07
assign (resid  77 and name  HB1) (resid  78 and name   HN)  3.0  1.2  0.5 ! A.1519 at  4.15e+06
assign (resid  77 and name  HB2) (resid  78 and name   HN)  3.0  1.2  0.5 ! A.1520 at  3.97e+06

! T78
assign (resid  78 and name   HN) (resid  78 and name   HB)  4.0  2.2  1.0 ! A.1524 at  2.16e+06
assign (resid  78 and name   HN) (resid  78 and name HG2#)  3.0  1.2  1.0 ! A.1525 at  1.16e+07
assign (resid  78 and name HG2#) (resid  78 and name   HA)  3.0  1.2  0.8 ! A.1512 at -1.46e+07
assign (resid  78 and name   HN) (resid  79 and name   HN)  3.0  1.2  1.2 ! A.1526 at  3.49e+06
assign (resid  78 and name HG2#) (resid  79 and name   HN)  3.0  1.2  1.0 ! A.1515 at -9.59e+06
assign (resid  78 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.2 ! A.1572 at  4.05e+06
assign (resid  78 and name   HN) (resid  80 and name  HB1)  4.0  2.2  1.0 ! A.1527 at  2.10e+06
assign (resid  78 and name HG2#) (resid  80 and name   HN)  3.0  1.2  1.0 ! A.1517 at -7.54e+06
assign (resid  78 and name HG2#) (resid  80 and name  HB1)  3.0  1.2  1.5 ! A.1516 at -5.43e+06
assign (resid  78 and name   HB) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1570 at  6.91e+06
assign (resid  78 and name   HN) (resid  81 and name   HA)  4.0  2.2  1.0 ! A.1529 at  3.02e+06
assign (resid  78 and name   HN) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1536 at  3.52e+06
assign (resid  78 and name   HN) (resid  81 and name  HB1)  3.0  1.2  0.5 ! A.1530 at  9.49e+06
assign (resid  78 and name   HN) (resid  81 and name  HD1)  3.0  1.2  1.0 ! A.1531 at  3.71e+06
assign (resid  78 and name   HN) (resid  81 and name  HD2)  3.0  1.2  1.0 ! A.1532 at  4.17e+06
assign (resid  78 and name   HN) (resid  81 and name  HE1)  3.0  1.2  0.5 ! A.1533 at  3.97e+06
assign (resid  78 and name   HN) (resid  81 and name  HG1)  3.0  1.2  0.5 ! A.1610 at -5.65e+06
assign (resid  78 and name   HN) (resid  81 and name  HG2)  3.0  1.2  1.1 ! A.1535 at  6.49e+06
assign (resid  78 and name   HN) (resid  82 and name   HN)  3.0  1.2  1.2 ! A.1633 at  3.34e+06

! L79
assign (resid  79 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.0 ! A.1555 at  6.87e+06
assign (resid  79 and name   HA) (resid  79 and name   HG)  3.0  1.2  0.3 ! A.1539 at -4.03e+06
assign (resid  79 and name   HA) (resid  79 and name HD1#)  3.0  1.2  0.8 ! A.1538 at -9.57e+06
assign (resid  79 and name HD1#) (resid  79 and name  HB1)  3.0  1.2  0.8 ! A.1542 at -8.33e+06
assign (resid  79 and name HD2#) (resid  79 and name   HA)  3.0  1.2  0.8 ! A.1551 at -5.43e+06
assign (resid  79 and name HD2#) (resid  79 and name   HN)  4.0  2.2  1.5 ! A.1553 at -3.01e+06
assign (resid  79 and name HD2#) (resid  79 and name  HB2)  3.0  1.2  0.8 ! A.1552 at -1.03e+07
assign (resid  79 and name   HA) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1573 at  5.11e+06
assign (resid  79 and name   HN) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1578 at  1.04e+07
assign (resid  79 and name  HB1) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1574 at  5.57e+06
assign (resid  79 and name  HB2) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1575 at  6.35e+06
assign (resid  79 and name HD1#) (resid  80 and name   HN)  3.0  1.2  1.0 ! A.1576 at  1.21e+07
assign (resid  79 and name HD2#) (resid  80 and name   HN)  3.0  1.2  1.0 ! A.1577 at  1.05e+07
assign (resid  79 and name  HB2) (resid  81 and name   HN)  3.0  1.2  1.8 ! A.1622 at  6.01e+06
assign (resid  79 and name   HN) (resid  82 and name   HN)  3.0  1.2  1.8 ! A.1634 at  9.74e+06
assign (resid  79 and name   HA) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1650 at  1.76e+06
assign (resid  79 and name  HB1) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1651 at  1.40e+06
assign (resid  79 and name   HA) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1540 at -3.84e+06
assign (resid  79 and name HD1#) (resid  84 and name HD1#)  2.5  0.7  1.2 ! A.1544 at -3.16e+07
assign (resid  79 and name   HG) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1678 at -5.01e+06
assign (resid  79 and name   HA) (resid  84 and name HG2#)  3.0  1.2  1.2 ! A.1693 at -4.42e+06
assign (resid  79 and name   HG) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1695 at -9.25e+06
assign (resid  79 and name  HB1) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1694 at -6.11e+06

! D80
assign (resid  80 and name   HN) (resid  80 and name  HB1)  3.0  1.2  0.5 ! A.1580 at  2.12e+07
assign (resid  80 and name   HN) (resid  80 and name  HB2)  3.0  1.2  0.5 ! A.1581 at  2.12e+07
assign (resid  80 and name   HN) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1582 at  7.08e+06
assign (resid  80 and name   HA) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1559 at -6.94e+06
assign (resid  80 and name  HB2) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1564 at -4.42e+06
assign (resid  80 and name  HB1) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1624 at  1.26e+07
assign (resid  80 and name   HN) (resid  81 and name   HA)  4.0  2.2  1.4 ! A.1587 at -1.88e+06
assign (resid  80 and name  HB1) (resid  81 and name   HA)  3.0  1.2  1.0 ! A.1586 at -3.47e+06
assign (resid  80 and name   HN) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.1583 at  2.96e+06
assign (resid  80 and name  HB1) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.1635 at  2.44e+06
assign (resid  80 and name   HA) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1560 at -6.94e+06
assign (resid  80 and name   HN) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1654 at  2.89e+06
assign (resid  80 and name  HB1) (resid  83 and name   HN)  4.0  2.2  1.3 ! A.1652 at  2.41e+06
assign (resid  80 and name  HB2) (resid  83 and name   HN)  4.0  2.2  1.4 ! A.1653 at  3.12e+06
assign (resid  80 and name   HN) (resid  84 and name HD1#)  4.0  2.2  1.5 ! A.1584 at  1.45e+06

! K81
assign (resid  81 and name   HN) (resid  81 and name  HG1)  4.0  2.2  1.0 ! A.1628 at  2.80e+06
assign (resid  81 and name   HN) (resid  81 and name  HG2)  3.0  1.2  1.2 ! A.1629 at  9.94e+06
assign (resid  81 and name   HA) (resid  81 and name  HG1)  3.0  1.2  0.9 ! A.1589 at -6.80e+06
assign (resid  81 and name   HA) (resid  81 and name  HG2)  3.0  1.2  0.3 ! A.1590 at -9.20e+06
assign (resid  81 and name  HB1) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1595 at -3.79e+06
assign (resid  81 and name  HD1) (resid  81 and name   HA)  3.0  1.2  0.9 ! A.1599 at -1.29e+07
assign (resid  81 and name  HD1) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1608 at -3.45e+06
assign (resid  81 and name  HD1) (resid  81 and name  HB1)  3.0  1.2  0.3 ! A.1601 at -1.12e+07
assign (resid  81 and name  HD2) (resid  81 and name   HA)  3.0  1.2  1.2 ! A.1600 at -6.25e+06
assign (resid  81 and name  HD2) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1609 at -3.61e+06
assign (resid  81 and name  HD2) (resid  81 and name  HB1)  3.0  1.2  0.3 ! A.1602 at -1.10e+07
assign (resid  81 and name  HG1) (resid  81 and name  HE1)  3.0  1.2  0.3 ! A.1615 at -4.99e+06
assign (resid  81 and name  HG2) (resid  81 and name  HE1)  3.0  1.2  0.3 ! A.1616 at -4.25e+06
assign (resid  81 and name   HN) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1630 at  6.30e+06
assign (resid  81 and name  HB1) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1638 at  6.52e+06
assign (resid  81 and name   HA) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1637 at  5.49e+06
assign (resid  81 and name  HD1) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.1639 at  2.67e+06
assign (resid  81 and name  HG2) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1640 at  8.27e+06
assign (resid  81 and name   HA) (resid  83 and name   HN)  3.0  1.2  1.7 ! A.1655 at  7.67e+06 !! relaxed

! Y82
assign (resid  82 and name   HN) (resid  82 and name  HB1)  3.0  1.2  0.5 ! A.1643 at  7.04e+06
assign (resid  82 and name   HN) (resid  82 and name  HB2)  3.0  1.2  0.5 ! A.1644 at  5.84e+06
assign (resid  82 and name   HN) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1645 at  1.10e+07
assign (resid  82 and name  HB2) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1632 at -3.88e+06
assign (resid  82 and name   HA) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1656 at  4.02e+06
assign (resid  82 and name  HB1) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1657 at  4.22e+06
assign (resid  82 and name   HN) (resid  84 and name HD1#)  3.0  1.2  1.0 ! A.1646 at  4.34e+06
assign (resid  82 and name   HN) (resid  84 and name HG11)  4.0  2.2  1.0 ! A.1647 at  2.97e+06
assign (resid  82 and name  HB1) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1679 at -1.06e+07
assign (resid  82 and name  HB2) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1680 at -5.55e+06

! G83
assign (resid  83 and name   HN) (resid  84 and name   HB)  3.0  1.2  0.9 ! A.1662 at  6.92e+06
assign (resid  83 and name   HN) (resid  84 and name   HN)  3.0  1.2  0.5 ! A.1666 at  1.43e+07
assign (resid  83 and name   HN) (resid  84 and name HD1#)  3.0  1.2  1.0 ! A.1663 at  4.35e+06
assign (resid  83 and name   HN) (resid  84 and name HG11)  3.0  1.2  0.5 ! A.1664 at  4.42e+06
assign (resid  83 and name   HN) (resid  84 and name HG2#)  4.0  2.2  1.1 ! A.1665 at  6.97e+06
assign (resid  83 and name  HA1) (resid  84 and name   HN)  4.0  2.2  1.0 ! A.1706 at  2.39e+06
assign (resid  83 and name  HA2) (resid  84 and name   HN)  4.0  2.2  1.0 ! A.1707 at  2.44e+06
assign (resid  83 and name  HA2) (resid  84 and name   HA)  4.0  2.2  1.0 ! A.1667 at -1.85e+06

! I84
assign (resid  84 and name   HN) (resid  84 and name   HB)  3.0  1.2  0.5 ! A.1709 at  3.43e+06
assign (resid  84 and name   HN) (resid  84 and name HD1#)  3.0  1.2  1.0 ! A.1710 at  3.58e+06
assign (resid  84 and name   HN) (resid  84 and name HG12)  4.0  2.2  1.0 ! A.1711 at  1.42e+06
assign (resid  84 and name   HN) (resid  84 and name HG2#)  3.0  1.2  1.0 ! A.1712 at  6.04e+06
assign (resid  84 and name   HA) (resid  84 and name HD1#)  4.0  2.2  1.5 ! A.1668 at -2.93e+06
assign (resid  84 and name   HA) (resid  84 and name HG11)  4.0  2.2  1.0 ! A.1669 at -1.90e+06
assign (resid  84 and name   HA) (resid  84 and name HG12)  4.0  2.2  1.0 ! A.1670 at -1.62e+06
assign (resid  84 and name   HA) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1671 at -6.15e+06
assign (resid  84 and name   HB) (resid  84 and name HD1#)  4.0  2.2  1.5 ! A.1674 at -2.01e+06
assign (resid  84 and name   HA) (resid  85 and name   HA)  4.0  2.2  1.0 ! A.1673 at -1.85e+06
assign (resid  84 and name HG2#) (resid  85 and name   HA)  3.0  1.2  0.8 ! A.1703 at -8.69e+06
assign (resid  84 and name   HA) (resid  85 and name   HN)  3.0  1.2  0.5 ! A.1719 at  1.41e+07
assign (resid  84 and name   HB) (resid  85 and name   HN)  4.0  2.2  1.0 ! A.1720 at  3.02e+06
assign (resid  84 and name HD1#) (resid  85 and name   HN)  3.0  1.2  1.6 ! A.1721 at  4.95e+06
assign (resid  84 and name HG11) (resid  85 and name   HN)  3.0  1.2  1.7 ! A.1722 at  5.45e+06
assign (resid  84 and name HG12) (resid  85 and name   HN)  3.0  1.2  1.1 ! A.1723 at  3.62e+06
assign (resid  84 and name HG2#) (resid  85 and name   HN)  3.0  1.2  1.0 ! A.1724 at  1.64e+07
assign (resid  84 and name HD1#) (resid  88 and name  HB#)  3.0  1.2  1.3 ! A.1688 at -1.23e+07
assign (resid  84 and name HG2#) (resid  88 and name   HA)  3.0  1.2  1.4 ! A.1704 at -8.15e+06
assign (resid  84 and name HG2#) (resid  88 and name  HB#)  2.5  0.7  1.2 ! A.1705 at -3.69e+07
assign (resid  84 and name HG2#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1785 at  1.41e+07
assign (resid  84 and name HG11) (resid  88 and name  HB#)  3.0  1.2  1.2 ! A.1775 at -2.84e+07
assign (resid  84 and name HD1#) (resid  90 and name HD1#)  3.0  1.2  1.3 ! A.1822 at -6.47e+06
assign (resid  84 and name HD1#) (resid  90 and name HD2#)  3.0  1.2  1.3 ! A.1835 at -8.57e+06

! Q85
assign (resid  85 and name   HN) (resid  85 and name  HB1)  3.0  1.2  0.5 ! A.1726 at  1.30e+07
assign (resid  85 and name   HN) (resid  85 and name  HG1)  3.0  1.2  1.8 ! A.1728 at  1.15e+07
assign (resid  85 and name   HN) (resid  85 and name HE21)  4.0  2.2  1.0 ! A.1727 at  2.64e+06
assign (resid  85 and name   HA) (resid  85 and name  HG1)  3.0  1.2  0.3 ! A.1715 at -7.46e+06
assign (resid  85 and name HE21) (resid  85 and name   HA)  3.0  1.2  0.3 ! A.1732 at  6.65e+06
assign (resid  85 and name HE21) (resid  85 and name  HB1)  3.0  1.2  0.6 ! A.1734 at  1.25e+07
assign (resid  85 and name HE21) (resid  85 and name  HG1)  2.5  0.7  0.2 ! A.1737 at  4.44e+07
assign (resid  85 and name HE22) (resid  85 and name   HA)  3.0  1.2  0.3 ! A.1733 at  6.86e+06
assign (resid  85 and name HE22) (resid  85 and name  HB1)  3.0  1.2  1.8 ! A.1735 at  1.12e+07
assign (resid  85 and name HE22) (resid  85 and name  HG1)  2.5  0.7  1.2 ! A.1738 at  4.15e+07
assign (resid  85 and name   HN) (resid  86 and name   HN)  3.0  1.2  1.3 ! A.1729 at  4.38e+06
assign (resid  85 and name   HA) (resid  86 and name   HN)  3.0  1.2  0.5 ! A.1759 at  1.95e+07
assign (resid  85 and name  HB1) (resid  86 and name   HN)  3.0  1.2  0.5 ! A.1760 at  1.86e+07
assign (resid  85 and name  HG1) (resid  86 and name   HN)  3.0  1.2  0.5 ! A.1761 at  1.06e+07
assign (resid  85 and name   HN) (resid  86 and name  HB#)  4.0  2.2  1.3 ! A.1750 at -4.67e+06
assign (resid  85 and name  HB1) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1749 at -1.56e+07
assign (resid  85 and name   HN) (resid  88 and name   HN)  4.0  2.2  1.0 ! A.1731 at  3.04e+06
assign (resid  85 and name   HN) (resid  88 and name  HB#)  3.0  1.2  1.0 ! A.1730 at  9.88e+06
assign (resid  85 and name  HB1) (resid  88 and name  HB#)  3.0  1.2  0.8 ! A.1777 at -2.14e+07

! A86
assign (resid  86 and name   HN) (resid  86 and name  HB#)  3.0  1.2  1.0 ! A.1764 at  2.11e+07
assign (resid  86 and name   HN) (resid  87 and name   HN)  4.0  2.2  1.0 ! A.1765 at  2.81e+06
assign (resid  86 and name  HB#) (resid  87 and name   HA)  3.0  1.2  0.8 ! A.1753 at -9.25e+06
assign (resid  86 and name  HB#) (resid  87 and name   HN)  3.0  1.2  1.0 ! A.1755 at -1.60e+07
assign (resid  86 and name  HB#) (resid  87 and name  HB1)  3.0  1.2  1.2 ! A.1754 at -9.50e+06
assign (resid  86 and name  HB#) (resid  88 and name   HN)  3.0  1.2  1.4 ! A.1756 at -8.13e+06
assign (resid  86 and name   HA) (resid  88 and name   HN)  3.0  1.2  0.5 ! A.1786 at  1.11e+07

! D87
assign (resid  87 and name   HA) (resid  88 and name   HN)  2.5  0.7  0.9 ! A.1787 at  8.18e+07
assign (resid  87 and name  HB1) (resid  88 and name   HN)  4.0  2.2  1.0 ! A.1788 at  2.63e+06
assign (resid  87 and name  HB2) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1789 at  5.97e+07
assign (resid  87 and name   HN) (resid  88 and name  HB#)  2.5  0.7  1.3 ! A.1779 at -2.91e+07

! A88
assign (resid  88 and name   HN) (resid  88 and name  HB#)  2.5  0.7  0.9 ! A.1791 at  3.60e+07
assign (resid  88 and name   HA) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1771 at -1.30e+07
assign (resid  88 and name  HB#) (resid  89 and name   HN)  2.5  0.7  0.9 ! A.1782 at -2.91e+07
assign (resid  88 and name   HN) (resid  89 and name   HN)  4.0  2.2  1.0 ! A.1817 at  2.82e+06
assign (resid  88 and name   HA) (resid  89 and name  HG1)  4.0  2.2  1.8 ! A.1803 at -1.02e+07
assign (resid  88 and name   HN) (resid  90 and name HD2#)  3.0  1.2  2.0 ! A.1792 at  7.89e+06

! K89
assign (resid  89 and name   HN) (resid  89 and name  HB2)  3.0  1.2  0.5 ! A.1819 at  7.89e+06
assign (resid  89 and name   HN) (resid  89 and name  HG2)  3.0  1.2  0.5 ! A.1820 at  7.18e+06
assign (resid  89 and name  HB1) (resid  89 and name   HN)  3.0  1.2  0.8 ! A.1794 at -6.10e+06
assign (resid  89 and name  HD1) (resid  89 and name   HA)  3.0  1.2  1.5 ! A.1796 at -2.83e+07
assign (resid  89 and name  HD1) (resid  89 and name   HN)  3.0  1.2  1.2 ! A.1798 at -1.18e+07
assign (resid  89 and name  HE1) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1800 at -1.48e+07
assign (resid  89 and name  HG1) (resid  89 and name   HA)  3.0  1.2  0.8 ! A.1804 at -1.11e+07
assign (resid  89 and name  HG1) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1812 at -5.89e+06
assign (resid  89 and name  HG1) (resid  89 and name  HE1)  3.0  1.2  0.3 ! A.1810 at -9.51e+06
assign (resid  89 and name  HG2) (resid  89 and name   HA)  3.0  1.2  0.3 ! A.1805 at -9.79e+06
assign (resid  89 and name  HG2) (resid  89 and name  HE1)  3.0  1.2  0.3 ! A.1811 at -1.37e+07
assign (resid  89 and name  HD1) (resid  90 and name   HN)  3.0  1.2  1.1 ! A.1799 at -1.01e+07
assign (resid  89 and name  HG1) (resid  90 and name   HN)  4.0  2.2  1.6 ! A.1814 at -5.77e+06
assign (resid  89 and name   HA) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.1847 at  1.27e+07
assign (resid  89 and name  HB1) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.1848 at  8.35e+06

! L90
assign (resid  90 and name   HN) (resid  90 and name   HG)  3.0  1.2  0.5 ! A.1855 at  1.07e+07
assign (resid  90 and name   HN) (resid  90 and name  HB1)  3.0  1.2  1.0 ! A.1851 at  5.81e+06
assign (resid  90 and name   HN) (resid  90 and name  HB2)  3.0  1.2  0.5 ! A.1852 at  5.15e+06
assign (resid  90 and name   HN) (resid  90 and name HD1#)  3.0  1.2  1.0 ! A.1853 at  1.31e+07
assign (resid  90 and name   HN) (resid  90 and name HD2#)  3.0  1.2  1.0 ! A.1854 at  5.79e+06
assign (resid  90 and name HD1#) (resid  90 and name  HB1)  3.0  1.2  0.8 ! A.1823 at -9.36e+06
assign (resid  90 and name HD1#) (resid  90 and name  HB2)  3.0  1.2  0.8 ! A.1824 at -1.75e+07
assign (resid  90 and name HD2#) (resid  90 and name   HA)  3.0  1.2  0.8 ! A.1836 at -7.37e+06
assign (resid  90 and name HD2#) (resid  90 and name  HB1)  3.0  1.2  0.8 ! A.1837 at -5.38e+06
assign (resid  90 and name HD2#) (resid  90 and name  HB2)  3.0  1.2  0.8 ! A.1838 at -1.30e+07
assign (resid  90 and name HD1#) (resid  91 and name   HN)  3.0  1.2  1.3 ! A.1828 at -4.28e+06
assign (resid  90 and name HD2#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1842 at -4.29e+06
assign (resid  90 and name   HA) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1883 at  1.07e+07
assign (resid  90 and name   HG) (resid  91 and name   HN)  3.0  1.2  1.7 ! A.1888 at  9.00e+06
assign (resid  90 and name   HN) (resid  91 and name   HN)  3.0  1.2  1.5 ! A.1889 at  6.13e+06
assign (resid  90 and name  HB1) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1884 at  7.91e+06
assign (resid  90 and name  HB2) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1885 at  1.10e+07

! Q91
assign (resid  91 and name   HN) (resid  91 and name  HB1)  3.0  1.2  1.0 ! A.1891 at  1.07e+07
assign (resid  91 and name   HN) (resid  91 and name  HB2)  3.0  1.2  0.5 ! A.1892 at  1.00e+07
assign (resid  91 and name   HN) (resid  91 and name  HG1)  3.0  1.2  0.5 ! A.1893 at  4.88e+06
assign (resid  91 and name   HN) (resid  91 and name  HG2)  3.0  1.2  1.1 ! A.1894 at  5.65e+06
assign (resid  91 and name  HG1) (resid  91 and name   HA)  3.0  1.2  0.3 ! A.1867 at -3.84e+06
assign (resid  91 and name  HG1) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1870 at -2.64e+06
assign (resid  91 and name  HG1) (resid  91 and name HE22)  3.0  1.2  0.8 ! A.1872 at -4.22e+06
assign (resid  91 and name  HG2) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.1868 at -3.16e+06
assign (resid  91 and name  HG2) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1871 at -2.25e+06
assign (resid  91 and name  HG2) (resid  91 and name HE22)  3.0  1.2  1.0 ! A.1873 at -4.54e+06
assign (resid  91 and name HE21) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.1900 at  1.96e+06
assign (resid  91 and name HE21) (resid  91 and name  HB2)  3.0  1.2  0.3 ! A.1901 at  7.58e+06
assign (resid  91 and name HE22) (resid  91 and name   HN)  4.0  2.2  1.4 ! A.1909 at  2.27e+06
assign (resid  91 and name HE22) (resid  91 and name  HB2)  3.0  1.2  0.3 ! A.1902 at  9.41e+06
assign (resid  91 and name   HA) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.1860 at -1.97e+06
assign (resid  91 and name  HB2) (resid  92 and name   HN)  3.0  1.2  0.5 ! A.1919 at  3.85e+06
assign (resid  91 and name  HG2) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.1920 at  3.05e+06
assign (resid  91 and name  HB2) (resid  93 and name   HB)  4.0  2.2  1.0 ! A.1926 at -3.20e+06

! F92
assign (resid  92 and name   HN) (resid  92 and name  HB1)  4.0  2.2  1.0 ! A.1922 at  2.52e+06
assign (resid  92 and name   HN) (resid  92 and name  HB2)  3.0  1.2  0.5 ! A.1923 at  3.89e+06
assign (resid  92 and name   HA) (resid  93 and name   HN)  3.0  1.2  0.5 ! A.1934 at  7.04e+06
assign (resid  92 and name  HB1) (resid  93 and name   HN)  3.0  1.2  1.5 ! A.1935 at  3.22e+06
assign (resid  92 and name  HB2) (resid  93 and name   HN)  3.0  1.2  1.4 ! A.1936 at  3.89e+06

! T93
assign (resid  93 and name   HN) (resid  93 and name HG2#)  3.0  1.2  1.0 ! A.1937 at  8.86e+06
assign (resid  93 and name   HB) (resid  93 and name   HN)  4.0  2.2  1.0 ! A.1929 at -2.22e+06
assign (resid  93 and name HG2#) (resid  94 and name  HD1)  4.0  2.2  1.5 ! A.1939 at -2.76e+06
assign (resid  93 and name   HA) (resid  94 and name  HG1)  4.0  2.2  1.0 ! A.1940 at -3.02e+06

! P94

! added from free form
assign (resid  49 and name HG2#) (resid  58 and name   HN)  4.0  2.2  1.2 ! A.1973 at -8.12e+05
assign (resid  49 and name HG2#) (resid  58 and name  HB1)  4.0  2.2  1.5 ! A.1961 at  6.14e+05
assign (resid  49 and name HG2#) (resid  58 and name  HB2)  4.0  2.2  2.5 ! A.1962 at  4.54e+05
assign (resid  49 and name   HA) (resid  58 and name  HE1)  4.0  2.2  1.0 ! A.1985 at -5.57e+05
assign (resid  49 and name   HB) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1986 at -6.02e+05
assign (resid  49 and name HG1#) (resid  58 and name  HE1)  2.5  0.7  0.7 ! A.1987 at -3.94e+06
assign (resid  49 and name HG2#) (resid  58 and name  HE1)  3.0  1.2  1.0 ! A.1988 at -3.15e+06

assign (resid  52 and name   HN) (resid  52 and name   HG)  3.0  1.2  1.2 ! A.1839 at -1.89e+06
assign (resid  52 and name   HN) (resid  52 and name  HB1)  2.5  0.7  0.4 ! A.1837 at -1.14e+06
assign (resid  52 and name   HN) (resid  52 and name HD1#)  2.5  0.7  1.4 ! A.1838 at -1.10e+06
assign (resid  52 and name   HA) (resid  52 and name HD1#)  2.5  0.7  0.7 ! A.1810 at  1.83e+06
assign (resid  52 and name  HB1) (resid  52 and name HD1#)  4.0  2.2  2.5 ! A.1814 at  2.29e+05
assign (resid  52 and name   HN) (resid  53 and name   HA)  4.0  2.2  2.0 ! A.1840 at -1.72e+05
assign (resid  52 and name   HN) (resid  53 and name   HN)  2.5  0.7  0.4 ! A.1857 at -1.51e+06
assign (resid  52 and name   HA) (resid  53 and name   HN)  2.5  0.7  0.9 ! A.1853 at -1.96e+06
assign (resid  52 and name   HG) (resid  53 and name   HN)  3.0  1.2  1.4 ! A.1856 at -8.09e+05
assign (resid  52 and name  HB1) (resid  53 and name   HN)  2.5  0.7  0.4 ! A.1854 at -1.87e+06
assign (resid  52 and name HD1#) (resid  53 and name   HN)  3.0  1.2  1.3 ! A.1855 at -1.71e+06
assign (resid  52 and name   HN) (resid  54 and name HG1#)  4.0  2.2  1.5 ! A.1833 at -5.78e+05
assign (resid  52 and name HD1#) (resid  54 and name   HB)  4.0  2.2  2.1 ! A.1810 at  7.37e+05
assign (resid  52 and name HD1#) (resid  54 and name HG1#)  3.0  1.2  1.5 ! A.1811 at  3.28e+06
assign (resid  52 and name   HA) (resid  54 and name HG1#)  4.0  2.2  1.5 ! A.1868 at  5.67e+05
assign (resid  52 and name   HG) (resid  54 and name HG1#)  2.5  0.7  0.7 ! A.1869 at  1.40e+06
assign (resid  52 and name   HG) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1991 at -3.96e+05
assign (resid  52 and name  HB1) (resid  58 and name  HE1)  2.5  0.7  1.4 ! A.1989 at -1.29e+06
assign (resid  52 and name HD1#) (resid  58 and name  HE1)  4.0  2.2  2.5 ! A.1990 at -4.00e+05

assign (resid  53 and name   HN) (resid  53 and name  HB1)  2.5  0.7  1.1 ! A.1859 at -2.85e+06
assign (resid  53 and name   HN) (resid  53 and name  HB2)  2.5  0.7  0.4 ! A.1860 at -2.51e+06
assign (resid  53 and name   HN) (resid  54 and name   HB)  4.0  2.2  2.0 ! A.1861 at -3.14e+05
assign (resid  53 and name   HN) (resid  54 and name   HN)  2.5  0.7  0.4 ! A.1862 at -1.40e+06
assign (resid  53 and name   HN) (resid  54 and name HG1#)  3.0  1.2  1.4 ! A.1852 at -1.47e+06
assign (resid  53 and name   HA) (resid  54 and name   HN)  3.0  1.2  0.5 ! A.1876 at -9.86e+05
assign (resid  53 and name  HB2) (resid  54 and name   HN)  4.0  2.2  2.0 ! A.1877 at -2.63e+05
assign (resid  53 and name  HB2) (resid  54 and name   HB)  4.0  2.2  1.6 ! A.1860 at  6.73e+05
assign (resid  53 and name   HA) (resid  54 and name HG1#)  2.5  0.7  1.2 ! A.1865 at  1.27e+06
assign (resid  53 and name  HB1) (resid  54 and name HG1#)  3.0  1.2  1.2 ! A.1866 at  1.15e+06
assign (resid  53 and name  HB2) (resid  54 and name HG1#)  4.0  2.2  2.5 ! A.1867 at  2.97e+05
assign (resid  53 and name   HN) (resid  56 and name   HN)  4.0  2.2  2.2 ! A.1854 at -7.05e+05

assign (resid  54 and name   HN) (resid  54 and name   HB)  4.0  2.2  2.0 ! A.1878 at -1.70e+05
assign (resid  54 and name   HA) (resid  54 and name HG1#)  2.5  0.7  0.7 ! A.1864 at  5.31e+06
assign (resid  54 and name HG1#) (resid  54 and name   HN)  2.5  0.7  0.9 ! A.1874 at  1.66e+06
assign (resid  54 and name   HA) (resid  55 and name   HN)  4.0  2.2  1.0 ! A.1858 at  6.62e+05
assign (resid  54 and name HG1#) (resid  55 and name   HN)  3.0  1.2  1.0 ! A.1872 at  8.84e+05
assign (resid  54 and name   HA) (resid  56 and name   HN)  2.5  0.7  1.3 ! A.1928 at -1.75e+06
assign (resid  54 and name HG1#) (resid  56 and name   HN)  3.0  1.2  1.1 ! A.1875 at  1.16e+06
assign (resid  54 and name   HA) (resid  56 and name  HB1)  4.0  2.2  2.0 ! A.1890 at  1.38e+05
assign (resid  54 and name   HA) (resid  56 and name  HB2)  4.0  2.2  2.0 ! A.1891 at  2.72e+05
assign (resid  54 and name   HA) (resid  58 and name  HE1)  4.0  2.2  1.0 ! A.1992 at -9.15e+05
assign (resid  54 and name   HB) (resid  58 and name  HE1)  4.0  2.2  1.0 ! A.1993 at -5.15e+05

assign (resid  55 and name   HN) (resid  56 and name   HN)  4.0  2.2  2.0 ! A.1927 at -2.65e+05
assign (resid  55 and name   HN) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1993 at -1.78e+05

assign (resid  56 and name   HN) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1939 at -3.01e+05
assign (resid  56 and name   HA) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1889 at  1.97e+05
assign (resid  56 and name  HB2) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1910 at  2.95e+05
assign (resid  56 and name  HB1) (resid  58 and name  HE1)  2.5  0.7  0.2 ! A.1996 at -2.43e+06

assign (resid  57 and name   HN) (resid  58 and name   HN)  4.0  2.2  2.0 ! A.1956 at -1.70e+05
assign (resid  57 and name   HN) (resid  58 and name  HB2)  4.0  2.2  2.4 ! A.1955 at -2.48e+05
assign (resid  57 and name   HA) (resid  58 and name   HN)  2.5  0.7  0.4 ! A.1974 at -5.69e+06
assign (resid  57 and name  HB1) (resid  58 and name   HN)  3.0  1.2  1.2 ! A.1975 at -8.91e+05
assign (resid  57 and name  HB2) (resid  58 and name   HN)  3.0  1.2  1.4 ! A.1976 at -8.95e+05
assign (resid  57 and name  HB2) (resid  58 and name   HA)  4.0  2.2  1.6 ! A.1957 at  6.02e+05
assign (resid  57 and name   HN) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1997 at -4.56e+05
assign (resid  57 and name   HA) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2025 at -2.58e+05 

assign (resid  58 and name   HN) (resid  58 and name  HB1)  2.5  0.7  1.0 ! A.1979 at -1.13e+06
assign (resid  58 and name   HN) (resid  58 and name  HB2)  2.5  0.7  0.4 ! A.1980 at -1.51e+06
assign (resid  58 and name  HE1) (resid  58 and name   HA)  4.0  2.2  1.5 ! A.1998 at -5.47e+05
assign (resid  58 and name  HE1) (resid  58 and name   HN)  4.0  2.2  2.0 ! A.2001 at -3.96e+05
assign (resid  58 and name  HE1) (resid  58 and name  HB1)  4.0  2.2  2.0 ! A.1999 at -3.36e+05
assign (resid  58 and name  HE1) (resid  58 and name  HB2)  4.0  2.2  1.2 ! A.2000 at -1.21e+06
assign (resid  58 and name   HN) (resid  59 and name   HA)  4.0  2.2  2.0 ! A.1981 at -2.75e+05
assign (resid  58 and name   HN) (resid  59 and name   HN)  2.5  0.7  0.4 ! A.1983 at -1.33e+06
assign (resid  58 and name   HN) (resid  59 and name  HB2)  4.0  2.2  2.0 ! A.1982 at -3.11e+05
assign (resid  58 and name  HB1) (resid  59 and name   HN)  3.0  1.2  0.5 ! A.2012 at -8.26e+05
assign (resid  58 and name  HB2) (resid  59 and name   HN)  2.5  0.7  0.4 ! A.2013 at -1.53e+06
assign (resid  58 and name   HA) (resid  59 and name   HN)  2.5  0.7  1.0 ! A.2011 at -3.97e+06
assign (resid  58 and name  HB1) (resid  61 and name  HB1)  4.0  2.2  2.0 ! A.1971 at  2.11e+05
assign (resid  58 and name  HB2) (resid  61 and name  HB1)  4.0  2.2  2.6 ! A.1972 at  1.60e+05
assign (resid  58 and name  HB1) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2044 at -2.90e+05
assign (resid  58 and name  HB2) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2045 at -3.14e+05
assign (resid  58 and name   HA) (resid  61 and name   HA)  4.0  2.2  2.0 ! A.2033 at  3.49e+05

assign (resid  59 and name   HN) (resid  60 and name   HN)  3.0  1.2  0.5 ! A.2019 at -9.75e+05
assign (resid  59 and name   HN) (resid  60 and name  HB1)  4.0  2.2  1.0 ! A.2018 at -7.19e+05
assign (resid  59 and name   HA) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2026 at -1.93e+05
assign (resid  59 and name  HB1) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2027 at -1.44e+05
assign (resid  59 and name  HB2) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2028 at -1.45e+05
assign (resid  59 and name   HN) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2020 at -4.01e+05
assign (resid  59 and name   HA) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2046 at -3.53e+05
assign (resid  59 and name  HB2) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2047 at -3.35e+05

assign (resid  60 and name   HN) (resid  61 and name   HN)  2.5  0.7  0.4 ! A.2050 at -1.02e+06
assign (resid  60 and name   HA) (resid  61 and name   HN)  2.5  0.7  1.0 ! A.2048 at -1.04e+06
assign (resid  60 and name  HB1) (resid  61 and name   HN)  2.5  0.7  0.9 ! A.2049 at -1.20e+06

!@ END_XPLR_NOE_FILE
# Restraints file 2: K2F0LIM4c-restraints-submit-4th.xtb

!@ BEGIN_XPLR_NOE_FILE
! M1

! A2

! L3

! D4

! G5

! I6

! R7

! M8

! P9

! D10

! G11

! C12

! Y13

! A14

! D15

! G16

! T17

! W18

! E19

! L20

! S21

! V22

! H23

! V24

! T25

! D26

! L27

! N28

! R29

! D30

! V31

! T32

! L33

! R34

! V35

! T36

! G37

! E38

! V39

! H40

! I41
assign (resid  41 and name HD1#) (resid 602 and name  HE2)  4.0  2.2  1.5 ! A.1    at -2.03e+06
assign (resid  41 and name HG2#) (resid 602 and name  HE2)  4.0  2.2  1.5 ! A.2    at -2.53e+06

! G42

! G43

! V44

! M45
assign (resid  45 and name  HE#) (resid 577 and name  HD1)  3.0  1.2  1.3 ! A.3    at -2.61e+07
assign (resid  45 and name  HE#) (resid 602 and name   HA)  3.0  1.2  1.3 ! A.4    at -4.26e+06
assign (resid  45 and name  HE#) (resid 602 and name  HB2)  3.0  1.2  0.8 ! A.5    at -8.86e+06
assign (resid  45 and name  HE#) (resid 602 and name  HE1)  3.0  1.2  0.8 ! A.6    at -1.26e+07
assign (resid  45 and name  HE#) (resid 602 and name  HG2)  3.0  1.2  0.8 ! A.7    at -8.21e+06
assign (resid  45 and name  HE#) (resid 603 and name   HA)  3.0  1.2  0.8 ! A.8    at -4.96e+06
assign (resid  45 and name  HE#) (resid 603 and name   HG)  4.0  2.2  1.5 ! A.10   at -2.29e+06
assign (resid  45 and name  HE#) (resid 603 and name HD1#)  3.0  1.2  1.3 ! A.9    at -2.11e+07

!assign (resid  45 and name  HE#) (resid 602 and name  HE1)  3.0  1.2  0.8 ! A.8    at -1.58e+06
!assign (resid  45 and name  HE#) (resid 603 and name HD1#)  3.0  1.2  1.3 ! A.11   at -4.88e+06

! L46
assign (resid  46 and name HD1#) (resid 577 and name  HB2)  4.0  2.2  1.5 ! A.12   at -1.50e+06
assign (resid  46 and name HD1#) (resid 577 and name  HD1)  4.0  2.2  1.5 ! A.13   at -1.64e+06
assign (resid  46 and name HD1#) (resid 593 and name  HE1)  4.0  2.2  2.5 ! A.14   at -1.05e+06
assign (resid  46 and name  HB2) (resid 603 and name HD1#)  4.0  2.2  2.5 ! A.11   at -9.51e+05
assign (resid  46 and name HD1#) (resid 603 and name   HA)  4.0  2.2  1.5 ! A.15   at -1.25e+06
!assign (resid  46 and name HD1#) (resid 603 and name HD1#)  4.0  2.2  2.0 ! A.16   at -2.79e+06
assign (resid  46 and name HD1#) (resid 604 and name  HD1)  3.0  1.2  0.8 ! A.17   at -4.88e+06
assign (resid  46 and name HD1#) (resid 604 and name  HE1)  3.0  1.2  0.8 ! A.18   at -5.02e+06

assign (resid  46 and name   HA) (resid 603 and name HD1#)  3.0  1.2  0.8 ! A.12   at -1.96e+06
assign (resid  46 and name HD1#) (resid 603 and name HD1#)  3.0  1.2  1.3 ! A.13   at -3.93e+06
assign (resid  46 and name HD1#) (resid 603 and name HD2#)  4.0  2.2  2.0 ! A.14   at -1.22e+06
assign (resid  46 and name HD2#) (resid 593 and name  HE1)  4.0  2.2  1.5 ! A.9    at -1.13e+06

! K47

! L48

! V49

! E50
!assign (resid  50 and name  HG2) (resid 577 and name  HB2)  4.0  2.2  1.0 ! A.19   at -1.49e+06
assign (resid  50 and name  HG2) (resid 593 and name  HE1)  4.0  2.2  1.0 ! A.20   at -1.49e+06
!assign (resid  50 and name  HG2) (resid 593 and name  HE1)  3.0  1.2  0.3 ! A.10   at -1.48e+06

! K51

! L52

! D53

! V54

! K55
assign (resid  55 and name  HD1) (resid 574 and name HG2#)  4.0  2.2  1.5 ! A.22   at -1.29e+06
assign (resid  55 and name  HE1) (resid 574 and name HG2#)  3.0  1.2  0.8 ! A.25   at -4.61e+06
!assign (resid  55 and name  HB1) (resid 579 and name HD1#)  4.0  2.2  1.5 ! A.21   at -1.44e+06
assign (resid  55 and name  HD1) (resid 579 and name   HA)  4.0  2.2  2.0 ! A.23   at -8.76e+05
assign (resid  55 and name  HD1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.24   at -5.98e+06
assign (resid  55 and name  HE1) (resid 579 and name   HA)  4.0  2.2  1.0 ! A.26   at -2.10e+06
assign (resid  55 and name  HE1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.27   at -9.95e+06
assign (resid  55 and name  HG1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.28   at -5.70e+06
assign (resid  55 and name  HG2) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.29   at -4.65e+06

!assign (resid  55 and name  HE1) (resid 574 and name HG2#)  3.0  1.2  0.8 ! A.1    at -2.09e+06
assign (resid  55 and name   HA) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.2    at -1.66e+06
assign (resid  55 and name  HB1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.3    at -3.99e+06
!assign (resid  55 and name  HD1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.4    at -5.60e+06
!assign (resid  55 and name  HE1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.5    at -3.43e+06
!assign (resid  55 and name  HG1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.6    at -3.13e+06
assign (resid  55 and name  HG1) (resid 579 and name HD2#)  3.0  1.2  0.8 ! A.8    at -2.84e+06

! K56
assign (resid  56 and name   HA) (resid 579 and name HD1#)  4.0  2.2  1.5 ! A.7    at -1.31e+06

! D57

! W58

! S59
assign (resid  59 and name   HA) (resid 577 and name  HD1)  4.0  2.2  1.0 ! A.30   at -1.47e+06

! D60

! H61

! A62

! L63

! W64

! W65

! E66

! K67

! K68

! R69

! T70

! W71

! L72

! L73

! K74

! T75
assign (resid  75 and name HG2#) (resid 602 and name   HA)  4.0  2.2  1.5 ! A.31   at -2.18e+06
assign (resid  75 and name HG2#) (resid 602 and name  HE1)  4.0  2.2  1.5 ! A.32   at -1.72e+06
assign (resid  75 and name HG2#) (resid 602 and name  HG2)  4.0  2.2  1.5 ! A.33   at -2.48e+06
assign (resid  75 and name HG2#) (resid 603 and name   HA)  4.0  2.2  1.5 ! A.34   at -1.26e+06
assign (resid  75 and name HG2#) (resid 603 and name HD1#)  4.0  2.2  2.0 ! A.35   at -1.43e+06

!assign (resid  75 and name HG2#) (resid 602 and name  HE1)  4.0  2.2  1.5 ! A.9    at -1.16e+06
assign (resid  75 and name HG2#) (resid 602 and name  HE2)  4.0  2.2  1.5 ! A.10   at -6.73e+05

! H76

! W77

! T78

! L79

! D80

! K81

! Y82

! G83

! I84

! Q85

! A86

! D87

! A88

! K89

! L90

! Q91

! F92

! T93

! P94


! Y541

! H542

! E543

! R544

! R545

! G546

! S547

! L548

! C549

! S550

! G551

! C552

! Q553

! K554

! P555

! I556

! T557

! G558

! R559

! C560

! I561

! T562

! A563

! M564

! A565

! K566

! K567

! F568

! H569

! P570

! E571

! H572

! F573

! V574

! C575

! A576

! F577

! C578

! L579

! K580

! Q581

! L582

! N583

! K584

! G585

! T586

! F587

! K588

! E589

! Q590

! N591

! D592

! K593

! P594

! Y595

! C596

! Q597

! N598

! C599

! F600

! L601

! K602

! L603

! F604

! C605


!@ END_XPLR_NOE_FILE
# Restraints file 3: lim4c-restraints-submit-4th.xtb
!@ BEGIN_XPLR_NOE_FILE
! G534

! A535
assign (resid 535 and name   HA) (resid 536 and name   HN)  2.5  0.7  0.4 ! A.2    at -9.16e+06
assign (resid 535 and name  HB#) (resid 536 and name   HN)  2.5  0.7  0.9 ! A.17   at  1.02e+06

! M536
assign (resid 536 and name   HN) (resid 536 and name  HB1)  2.5  0.7  1.1 ! A.18   at  3.04e+06
assign (resid 536 and name   HN) (resid 536 and name  HB2)  2.5  0.7  0.4 ! A.19   at  9.84e+06
assign (resid 536 and name   HN) (resid 536 and name  HG1)  2.5  0.7  0.4 ! A.20   at  3.89e+06
assign (resid 536 and name   HN) (resid 536 and name  HG2)  2.5  0.7  0.4 ! A.21   at  3.89e+06
assign (resid 536 and name   HA) (resid 536 and name  HG2)  4.0  2.2  2.0 ! A.6    at -1.28e+07
assign (resid 536 and name  HG1) (resid 536 and name   HA)  2.5  0.7  0.8 ! A.10   at -2.58e+06
assign (resid 536 and name   HN) (resid 537 and name   HA)  4.0  2.2  2.0 ! A.22   at  8.99e+07
assign (resid 536 and name   HA) (resid 537 and name   HN)  4.0  2.2  2.0 ! A.7    at -3.91e+07
assign (resid 536 and name  HB1) (resid 537 and name   HN)  2.5  0.7  0.4 ! A.34   at  4.49e+06
assign (resid 536 and name  HB2) (resid 537 and name   HN)  2.5  0.7  0.4 ! A.35   at  2.86e+06
assign (resid 536 and name   HN) (resid 538 and name  HD1)  4.0  2.2  2.3 ! A.23   at  1.28e+06

! D537
assign (resid 537 and name   HN) (resid 537 and name  HB1)  2.5  0.7  1.0 ! A.37   at  8.05e+06
assign (resid 537 and name   HN) (resid 537 and name  HB2)  4.0  2.2  2.0 ! A.38   at  2.19e+07
assign (resid 537 and name   HN) (resid 538 and name  HD1)  3.0  1.2  1.4 ! A.39   at  2.47e+06
assign (resid 537 and name   HN) (resid 538 and name  HD2)  4.0  2.2  1.0 ! A.40   at  2.02e+06
assign (resid 537 and name  HB1) (resid 538 and name  HD1)  2.5  0.7  0.2 ! A.28   at -2.92e+06
assign (resid 537 and name  HB1) (resid 538 and name  HD2)  2.5  0.7  0.2 ! A.30   at -4.34e+06
assign (resid 537 and name  HB2) (resid 538 and name  HD1)  2.5  0.7  1.0 ! A.29   at -3.14e+06
assign (resid 537 and name  HB2) (resid 538 and name  HD2)  2.5  0.7  0.2 ! A.31   at -7.74e+06
assign (resid 537 and name   HA) (resid 538 and name  HD1)  4.0  2.2  2.0 ! A.53   at -4.99e+07
assign (resid 537 and name   HA) (resid 538 and name  HD2)  4.0  2.2  2.0 ! A.54   at -1.16e+07
assign (resid 537 and name   HA) (resid 538 and name  HG1)  2.5  0.7  1.4 ! A.66   at -4.54e+06
assign (resid 537 and name  HB2) (resid 539 and name   HN)  3.0  1.2  0.5 ! A.32   at -8.76e+05
assign (resid 537 and name   HA) (resid 539 and name   HN)  4.0  2.2  2.0 ! A.91   at  1.67e+07
assign (resid 537 and name  HB1) (resid 539 and name   HN)  2.5  0.7  0.4 ! A.92   at  2.91e+06
assign (resid 537 and name  HB1) (resid 540 and name   HN)  2.5  0.7  0.4 ! A.110  at  1.61e+06
assign (resid 537 and name  HB2) (resid 540 and name   HN)  3.0  1.2  0.5 ! A.111  at  8.65e+05

! P538
assign (resid 538 and name   HA) (resid 538 and name  HD1)  2.5  0.7  1.3 ! A.42   at -3.03e+06
assign (resid 538 and name   HA) (resid 538 and name  HD2)  2.5  0.7  1.4 ! A.43   at -3.56e+06
assign (resid 538 and name   HA) (resid 538 and name  HG1)  4.0  2.2  2.0 ! A.44   at -1.90e+07
assign (resid 538 and name   HA) (resid 538 and name  HG2)  4.0  2.2  2.0 ! A.45   at -2.38e+07
assign (resid 538 and name  HB1) (resid 538 and name  HD1)  2.5  0.7  0.8 ! A.48   at -4.58e+06
assign (resid 538 and name  HB1) (resid 538 and name  HD2)  2.5  0.7  1.3 ! A.49   at -2.43e+06
assign (resid 538 and name   HA) (resid 539 and name   HN)  4.0  2.2  2.0 ! A.46   at -4.97e+07
assign (resid 538 and name  HB1) (resid 539 and name   HN)  2.5  0.7  1.4 ! A.52   at -2.84e+06
assign (resid 538 and name  HD1) (resid 539 and name   HN)  2.5  0.7  0.4 ! A.65   at -1.67e+06
assign (resid 538 and name  HG1) (resid 539 and name   HN)  2.5  0.7  1.1 ! A.73   at -4.48e+06
assign (resid 538 and name  HD2) (resid 539 and name   HN)  2.5  0.7  0.4 ! A.97   at  6.84e+06

! E539
assign (resid 539 and name   HN) (resid 539 and name  HB2)  4.0  2.2  2.0 ! A.99   at  7.69e+07
assign (resid 539 and name   HN) (resid 539 and name  HG2)  4.0  2.2  2.0 ! A.100  at  1.09e+07
assign (resid 539 and name   HA) (resid 539 and name  HG1)  4.0  2.2  2.0 ! A.76   at -1.21e+07
assign (resid 539 and name  HG1) (resid 539 and name   HN)  2.5  0.7  0.4 ! A.87   at -5.39e+06
assign (resid 539 and name  HG2) (resid 539 and name   HA)  4.0  2.2  2.0 ! A.84   at -1.10e+07
assign (resid 539 and name   HN) (resid 540 and name   HN)  4.0  2.2  2.0 ! A.102  at  2.18e+07
assign (resid 539 and name   HN) (resid 540 and name  HB2)  2.5  0.7  1.1 ! A.101  at  2.81e+06
assign (resid 539 and name   HA) (resid 540 and name   HN)  4.0  2.2  2.0 ! A.78   at -3.06e+07
assign (resid 539 and name  HB2) (resid 540 and name   HN)  2.5  0.7  0.4 ! A.82   at -7.19e+06
assign (resid 539 and name  HG1) (resid 540 and name   HN)  2.5  0.7  0.4 ! A.89   at -2.46e+06
assign (resid 539 and name  HG2) (resid 540 and name   HN)  2.5  0.7  0.4 ! A.90   at -1.72e+06
assign (resid 539 and name  HB1) (resid 540 and name   HN)  2.5  0.7  1.4 ! A.113  at  3.96e+06
assign (resid 539 and name   HA) (resid 541 and name   HN)  2.5  0.7  0.9 ! A.127  at  1.59e+06
assign (resid 539 and name   HN) (resid 541 and name   HN)  3.0  1.2  1.2 ! A.129  at  1.95e+06
assign (resid 539 and name  HB2) (resid 541 and name   HN)  2.5  0.7  0.4 ! A.128  at  2.15e+06

! F540
assign (resid 540 and name   HN) (resid 540 and name  HB1)  4.0  2.2  2.0 ! A.119  at  6.80e+07
assign (resid 540 and name   HN) (resid 540 and name  HB2)  4.0  2.2  2.0 ! A.120  at  4.69e+07
assign (resid 540 and name   HA) (resid 541 and name   HN)  4.0  2.2  2.0 ! A.130  at  2.92e+07

! Y541
assign (resid 541 and name   HN) (resid 541 and name  HB1)  4.0  2.2  2.0 ! A.132  at  2.89e+07
assign (resid 541 and name   HN) (resid 541 and name  HB2)  4.0  2.2  2.0 ! A.133  at  2.14e+07

! H542
assign (resid 542 and name   HN) (resid 542 and name  HB1)  2.5  0.7  0.9 ! A.141  at  3.02e+06
assign (resid 542 and name   HN) (resid 542 and name  HB2)  2.5  0.7  0.4 ! A.142  at  3.88e+06
assign (resid 542 and name   HA) (resid 543 and name   HN)  4.0  2.2  2.0 ! A.136  at -1.44e+07
assign (resid 542 and name  HB1) (resid 543 and name   HN)  2.5  0.7  0.4 ! A.139  at -3.54e+06
assign (resid 542 and name  HB2) (resid 543 and name   HN)  2.5  0.7  0.4 ! A.153  at  4.83e+06

! E543
assign (resid 543 and name   HN) (resid 543 and name  HB1)  4.0  2.2  2.0 ! A.155  at  1.80e+07
assign (resid 543 and name   HN) (resid 543 and name  HG1)  2.5  0.7  1.1 ! A.156  at  5.89e+06
assign (resid 543 and name   HA) (resid 543 and name  HG1)  4.0  2.2  2.0 ! A.144  at -1.20e+07
assign (resid 543 and name   HA) (resid 544 and name   HN)  2.5  0.7  0.9 ! A.146  at -7.21e+06
assign (resid 543 and name   HN) (resid 544 and name   HN)  2.5  0.7  0.4 ! A.171  at  1.35e+06
assign (resid 543 and name  HG1) (resid 544 and name   HN)  2.5  0.7  0.4 ! A.170  at  2.56e+06

! R544
assign (resid 544 and name   HN) (resid 544 and name  HB2)  2.5  0.7  0.4 ! A.172  at  4.62e+06
assign (resid 544 and name   HN) (resid 544 and name  HD1)  2.5  0.7  0.4 ! A.173  at  1.56e+06
assign (resid 544 and name   HN) (resid 544 and name  HG1)  2.5  0.7  0.8 ! A.174  at  7.89e+06
assign (resid 544 and name   HA) (resid 544 and name  HD1)  2.5  0.7  1.0 ! A.157  at -9.57e+06
assign (resid 544 and name   HA) (resid 544 and name  HG1)  4.0  2.2  2.0 ! A.158  at -4.28e+07
assign (resid 544 and name  HB1) (resid 544 and name  HD1)  2.5  0.7  0.9 ! A.162  at -9.10e+06
assign (resid 544 and name  HB2) (resid 544 and name  HD1)  4.0  2.2  2.0 ! A.163  at -1.01e+07
assign (resid 544 and name   HA) (resid 545 and name   HN)  4.0  2.2  2.0 ! A.159  at -1.22e+07

! R545
assign (resid 545 and name   HN) (resid 545 and name  HB1)  2.5  0.7  0.9 ! A.185  at  8.20e+06
assign (resid 545 and name   HN) (resid 545 and name  HB2)  2.5  0.7  1.0 ! A.186  at  8.24e+06
assign (resid 545 and name   HN) (resid 545 and name  HD1)  2.5  0.7  0.4 ! A.187  at  2.22e+06
assign (resid 545 and name   HN) (resid 545 and name  HG1)  2.5  0.7  0.8 ! A.188  at  9.29e+06
assign (resid 545 and name   HA) (resid 545 and name  HG1)  4.0  2.2  2.0 ! A.177  at -4.09e+07
assign (resid 545 and name   HA) (resid 546 and name   HN)  2.5  0.7  1.0 ! A.190  at  6.64e+06
assign (resid 545 and name  HB2) (resid 546 and name   HN)  2.5  0.7  0.4 ! A.191  at  2.02e+06
assign (resid 545 and name  HG1) (resid 546 and name   HN)  2.5  0.7  1.5 ! A.192  at  2.17e+06

! G546
assign (resid 546 and name  HA1) (resid 547 and name   HN)  2.5  0.7  0.4 ! A.189  at -5.33e+06
assign (resid 546 and name   HN) (resid 555 and name  HB1)  2.5  0.7  0.4 ! A.194  at  1.78e+06
assign (resid 546 and name  HA1) (resid 556 and name   HN)  3.0  1.2  0.5 ! A.402  at  9.03e+05

! S547
assign (resid 547 and name   HN) (resid 547 and name  HB1)  2.5  0.7  1.4 ! A.199  at  5.01e+06
assign (resid 547 and name   HN) (resid 547 and name  HB2)  2.5  0.7  0.4 ! A.200  at  5.89e+06
assign (resid 547 and name   HN) (resid 548 and name HD1#)  3.0  1.2  1.1 ! A.201  at  1.34e+06
assign (resid 547 and name   HN) (resid 548 and name HD2#)  4.0  2.2  2.5 ! A.202  at  8.93e+05
assign (resid 547 and name   HA) (resid 548 and name   HN)  4.0  2.2  2.0 ! A.243  at  1.92e+07
assign (resid 547 and name  HB1) (resid 548 and name   HN)  2.5  0.7  1.0 ! A.244  at  3.82e+06
assign (resid 547 and name  HB2) (resid 548 and name   HN)  3.0  1.2  1.5 ! A.245  at  5.05e+06
assign (resid 547 and name   HN) (resid 555 and name  HB1)  2.5  0.7  0.4 ! A.203  at  2.92e+06
assign (resid 547 and name   HN) (resid 555 and name  HB2)  2.5  0.7  1.3 ! A.204  at  1.06e+06
assign (resid 547 and name   HN) (resid 556 and name   HB)  2.5  0.7  0.4 ! A.205  at  1.39e+06
assign (resid 547 and name   HN) (resid 556 and name HD1#)  3.0  1.2  1.3 ! A.206  at  9.19e+05
assign (resid 547 and name  HB1) (resid 556 and name   HN)  2.5  0.7  1.3 ! A.403  at  3.20e+06
assign (resid 547 and name  HB2) (resid 556 and name   HN)  2.5  0.7  0.8 ! A.387  at  2.39e+06
assign (resid 547 and name  HB1) (resid 556 and name HD1#)  2.5  0.7  0.7 ! A.355  at -3.49e+06
assign (resid 547 and name  HB2) (resid 556 and name HG2#)  2.5  0.7  1.1 ! A.372  at -1.59e+06
assign (resid 547 and name  HB1) (resid 567 and name  HE1)  2.5  0.7  1.1 ! A.634  at -1.58e+06

! L548
assign (resid 548 and name   HN) (resid 548 and name  HB1)  4.0  2.2  2.0 ! A.247  at  1.59e+07
assign (resid 548 and name   HN) (resid 548 and name  HB2)  2.5  0.7  0.4 ! A.248  at  4.97e+06
assign (resid 548 and name   HN) (resid 548 and name HD1#)  2.5  0.7  0.9 ! A.249  at  6.22e+06
assign (resid 548 and name   HN) (resid 548 and name HD2#)  2.5  0.7  1.4 ! A.250  at  6.96e+06
assign (resid 548 and name  HB1) (resid 548 and name HD1#)  2.5  0.7  0.7 ! A.209  at -2.23e+06
assign (resid 548 and name  HB1) (resid 548 and name HD2#)  2.5  0.7  0.7 ! A.211  at -3.29e+06
assign (resid 548 and name  HB2) (resid 548 and name HD1#)  2.5  0.7  0.7 ! A.210  at -2.03e+06
assign (resid 548 and name   HG) (resid 548 and name   HN)  2.5  0.7  1.4 ! A.242  at -2.78e+06
assign (resid 548 and name HD1#) (resid 548 and name   HA)  2.5  0.7  0.7 ! A.214  at -7.51e+06
assign (resid 548 and name HD2#) (resid 548 and name   HA)  2.5  0.7  1.2 ! A.228  at -6.69e+06
assign (resid 548 and name   HN) (resid 549 and name   HN)  3.0  1.2  1.7 ! A.251  at  1.48e+06
assign (resid 548 and name HD1#) (resid 549 and name   HN)  3.0  1.2  1.3 ! A.219  at -4.69e+06
assign (resid 548 and name HD2#) (resid 549 and name   HN)  3.0  1.2  1.7 ! A.232  at -3.68e+06
assign (resid 548 and name   HA) (resid 549 and name   HN)  2.5  0.7  0.4 ! A.252  at  2.41e+06
assign (resid 548 and name  HB1) (resid 549 and name   HN)  2.5  0.7  0.9 ! A.253  at  1.92e+06
assign (resid 548 and name  HB1) (resid 550 and name   HN)  3.0  1.2  1.3 ! A.265  at  1.41e+06
assign (resid 548 and name HD1#) (resid 553 and name   HA)  3.0  1.2  1.3 ! A.220  at -2.94e+06
assign (resid 548 and name HD2#) (resid 553 and name   HA)  2.5  0.7  0.7 ! A.233  at -5.76e+06
assign (resid 548 and name HD2#) (resid 553 and name  HG1)  2.5  0.7  1.3 ! A.234  at -5.80e+06
assign (resid 548 and name  HB1) (resid 553 and name   HN)  2.5  0.7  1.4 ! A.308  at  1.83e+06
assign (resid 548 and name HD2#) (resid 553 and name   HN)  3.0  1.2  1.1 ! A.309  at  1.93e+06
assign (resid 548 and name  HB1) (resid 553 and name  HG1)  4.0  2.2  1.1 ! A.297  at -1.17e+06
assign (resid 548 and name HD2#) (resid 553 and name  HG2)  2.5  0.7  1.4 ! A.299  at -2.23e+06
assign (resid 548 and name HD2#) (resid 553 and name HE21)  3.0  1.2  0.8 ! A.321  at  9.03e+05
assign (resid 548 and name HD1#) (resid 553 and name HE22)  3.0  1.2  1.8 ! A.320  at  1.18e+06
assign (resid 548 and name HD2#) (resid 553 and name HE22)  2.5  0.7  0.7 ! A.322  at  2.19e+06
assign (resid 548 and name HD1#) (resid 554 and name   HA)  2.5  0.7  1.2 ! A.221  at -3.57e+06
assign (resid 548 and name HD2#) (resid 554 and name   HA)  2.5  0.7  1.0 ! A.235  at -1.24e+06
assign (resid 548 and name   HA) (resid 554 and name   HN)  2.5  0.7  0.4 ! A.335  at  1.10e+06
assign (resid 548 and name  HB2) (resid 554 and name   HN)  3.0  1.2  1.7 ! A.336  at  1.59e+06
assign (resid 548 and name HD1#) (resid 554 and name   HN)  3.0  1.2  1.0 ! A.337  at  2.59e+06
assign (resid 548 and name HD2#) (resid 554 and name   HN)  3.0  1.2  1.0 ! A.343  at  1.21e+06
assign (resid 548 and name HD1#) (resid 555 and name   HA)  4.0  2.2  2.5 ! A.222  at -1.09e+07
assign (resid 548 and name HD1#) (resid 555 and name  HB1)  2.5  0.7  0.7 ! A.223  at -8.99e+06
assign (resid 548 and name HD1#) (resid 555 and name  HD1)  2.5  0.7  0.7 ! A.224  at -4.34e+06
!assign (resid 548 and name HD1#) (resid 555 and name  HD2)  2.5  0.7  1.0 ! A.225  at -4.62e+06
assign (resid 548 and name HD1#) (resid 555 and name  HG1)  2.5  0.7  0.7 ! A.226  at -8.97e+06
assign (resid 548 and name HD1#) (resid 555 and name  HG2)  2.5  0.7  1.0 ! A.227  at -6.28e+06
assign (resid 548 and name HD2#) (resid 555 and name   HA)  3.0  1.2  1.7 ! A.236  at -5.98e+06
assign (resid 548 and name HD2#) (resid 555 and name  HD1)  3.0  1.2  1.2 ! A.237  at -2.72e+06
assign (resid 548 and name HD2#) (resid 555 and name  HD2)  3.0  1.2  1.5 ! A.238  at -2.04e+06
assign (resid 548 and name HD2#) (resid 555 and name  HG1)  3.0  1.2  1.5 ! A.239  at -1.93e+06
assign (resid 548 and name   HA) (resid 556 and name   HN)  2.5  0.7  0.9 ! A.405  at  2.45e+06

! C549
assign (resid 549 and name   HN) (resid 549 and name  HB1)  2.5  0.7  0.4 ! A.256  at  2.11e+06
assign (resid 549 and name   HN) (resid 549 and name  HB2)  2.5  0.7  0.4 ! A.257  at  2.80e+06
assign (resid 549 and name   HN) (resid 550 and name   HN)  3.0  1.2  1.2 ! A.258  at  1.19e+06
assign (resid 549 and name   HA) (resid 550 and name   HN)  2.5  0.7  0.4 ! A.266  at  2.17e+06
assign (resid 549 and name  HB2) (resid 550 and name   HN)  3.0  1.2  1.3 ! A.267  at  1.08e+06
assign (resid 549 and name  HB1) (resid 552 and name   HN)  2.5  0.7  1.4 ! A.286  at  2.04e+06
assign (resid 549 and name  HB1) (resid 553 and name   HN)  3.0  1.2  1.0 ! A.310  at  1.03e+06
assign (resid 549 and name  HB1) (resid 554 and name   HN)  2.5  0.7  0.7 ! A.338  at  3.90e+06
assign (resid 549 and name   HN) (resid 556 and name HD1#)  2.5  0.7  0.9 ! A.259  at  2.53e+06
assign (resid 549 and name   HN) (resid 556 and name HG11)  2.5  0.7  0.4 ! A.260  at  1.10e+06
assign (resid 549 and name   HA) (resid 556 and name HD1#)  2.5  0.7  0.7 ! A.356  at -4.94e+06
assign (resid 549 and name  HB2) (resid 556 and name HD1#)  2.5  0.7  0.7 ! A.357  at -3.05e+06
assign (resid 549 and name   HA) (resid 556 and name HG2#)  3.0  1.2  2.0 ! A.373  at -2.63e+06

! S550
assign (resid 550 and name   HN) (resid 550 and name  HB1)  2.5  0.7  0.4 ! A.269  at  3.30e+06
assign (resid 550 and name   HN) (resid 550 and name  HB2)  2.5  0.7  0.4 ! A.270  at  2.98e+06
assign (resid 550 and name   HN) (resid 551 and name   HN)  3.0  1.2  1.5 ! A.271  at  1.31e+06
assign (resid 550 and name  HB2) (resid 551 and name   HN)  2.5  0.7  1.4 ! A.264  at -1.67e+06
assign (resid 550 and name   HA) (resid 551 and name   HN)  2.5  0.7  0.4 ! A.277  at  2.51e+06
assign (resid 550 and name  HB1) (resid 551 and name   HN)  3.0  1.2  1.3 ! A.278  at  1.13e+06
assign (resid 550 and name   HN) (resid 552 and name   HN)  3.0  1.2  1.5 ! A.287  at  8.49e+05
assign (resid 550 and name   HN) (resid 553 and name   HN)  3.0  1.2  1.3 ! A.272  at  1.11e+06
assign (resid 550 and name   HA) (resid 553 and name   HN)  2.5  0.7  0.7 ! A.311  at  1.29e+06
assign (resid 550 and name   HA) (resid 553 and name HE21)  2.5  0.7  0.2 ! A.323  at  4.94e+06
assign (resid 550 and name  HB1) (resid 553 and name HE21)  3.0  1.2  1.7 ! A.325  at  8.81e+05
assign (resid 550 and name   HA) (resid 553 and name HE22)  2.5  0.7  0.2 ! A.324  at  3.40e+06
assign (resid 550 and name  HB1) (resid 553 and name HE22)  4.0  2.2  1.0 ! A.326  at  7.97e+05
assign (resid 550 and name  HB2) (resid 553 and name HE22)  2.5  0.7  0.8 ! A.327  at  1.98e+06
assign (resid 550 and name   HN) (resid 554 and name   HN)  4.0  2.2  1.3 ! A.345  at  7.83e+05
assign (resid 550 and name   HN) (resid 556 and name HD1#)  2.5  0.7  1.2 ! A.273  at  2.94e+06
assign (resid 550 and name  HB1) (resid 566 and name  HD1)  3.0  1.2  0.6 ! A.578  at -8.95e+05
assign (resid 550 and name   HN) (resid 567 and name   HN)  3.0  1.2  0.5 ! A.275  at  9.49e+05
assign (resid 550 and name   HN) (resid 567 and name  HB2)  2.5  0.7  0.4 ! A.274  at  1.16e+06
assign (resid 550 and name  HB1) (resid 567 and name   HN)  2.5  0.7  0.4 ! A.601  at  2.06e+06
assign (resid 550 and name  HB2) (resid 567 and name   HN)  2.5  0.7  0.4 ! A.602  at  3.29e+06
assign (resid 550 and name   HN) (resid 568 and name   HA)  3.0  1.2  0.5 ! A.276  at  8.81e+05

! G551
assign (resid 551 and name   HN) (resid 552 and name   HN)  2.5  0.7  0.4 ! A.282  at  3.36e+06
assign (resid 551 and name  HA1) (resid 552 and name   HN)  2.5  0.7  0.4 ! A.288  at  1.83e+06
assign (resid 551 and name  HA2) (resid 552 and name   HN)  2.5  0.7  0.9 ! A.289  at  3.16e+06
assign (resid 551 and name   HN) (resid 553 and name  HG1)  2.5  0.7  1.4 ! A.283  at  2.08e+06
assign (resid 551 and name   HN) (resid 553 and name   HN)  2.5  0.7  0.4 ! A.313  at  1.29e+06
assign (resid 551 and name  HA1) (resid 553 and name   HN)  3.0  1.2  1.4 ! A.312  at  1.43e+06
assign (resid 551 and name   HN) (resid 554 and name   HN)  4.0  2.2  1.6 ! A.346  at  7.38e+05
!assign (resid 551 and name   HN) (resid 556 and name HD1#)  4.0  2.2  2.7 ! A.284  at  8.89e+05

! C552
assign (resid 552 and name   HN) (resid 552 and name  HB1)  2.5  0.7  0.9 ! A.292  at  2.21e+06
assign (resid 552 and name   HN) (resid 552 and name  HB2)  2.5  0.7  0.4 ! A.293  at  6.36e+06
assign (resid 552 and name   HN) (resid 553 and name   HN)  2.5  0.7  0.4 ! A.294  at  5.91e+06
assign (resid 552 and name  HB1) (resid 553 and name   HN)  2.5  0.7  0.8 ! A.314  at  1.50e+06
assign (resid 552 and name   HN) (resid 554 and name   HN)  3.0  1.2  1.3 ! A.295  at  1.82e+06
assign (resid 552 and name   HA) (resid 554 and name   HN)  3.0  1.2  2.0 ! A.347  at  2.08e+06
assign (resid 552 and name  HB1) (resid 554 and name   HN)  2.5  0.7  0.8 ! A.348  at  1.09e+06
assign (resid 552 and name   HN) (resid 556 and name HD1#)  4.0  2.2  2.0 ! A.296  at  1.52e+06
assign (resid 552 and name   HN) (resid 569 and name   HN)  4.0  2.2  1.6 ! A.660  at  1.49e+06

! Q553
assign (resid 553 and name   HN) (resid 553 and name  HG1)  3.0  1.2  1.2 ! A.317  at  7.56e+06
assign (resid 553 and name   HN) (resid 553 and name  HG2)  2.5  0.7  0.4 ! A.318  at  4.66e+06
assign (resid 553 and name  HG1) (resid 553 and name   HA)  2.5  0.7  1.1 ! A.300  at -5.07e+06
assign (resid 553 and name  HG1) (resid 553 and name HE21)  2.5  0.7  0.9 ! A.302  at -1.17e+06
assign (resid 553 and name  HG1) (resid 553 and name HE22)  3.0  1.2  1.2 ! A.304  at -2.00e+06
assign (resid 553 and name  HG2) (resid 553 and name   HA)  2.5  0.7  0.2 ! A.301  at -4.24e+06
assign (resid 553 and name  HG2) (resid 553 and name HE21)  2.5  0.7  0.2 ! A.303  at -1.01e+06
assign (resid 553 and name  HG2) (resid 553 and name HE22)  2.5  0.7  1.0 ! A.305  at -1.03e+06
assign (resid 553 and name HE21) (resid 553 and name   HA)  2.5  0.7  0.2 ! A.328  at  1.34e+06
assign (resid 553 and name HE21) (resid 553 and name   HN)  2.5  0.7  0.4 ! A.330  at  2.04e+06
assign (resid 553 and name HE22) (resid 553 and name   HA)  2.5  0.7  0.5 ! A.329  at  2.13e+06
assign (resid 553 and name HE22) (resid 553 and name   HN)  3.0  1.2  1.0 ! A.331  at  1.78e+06
assign (resid 553 and name   HN) (resid 554 and name   HN)  2.5  0.7  0.4 ! A.319  at  2.89e+06
assign (resid 553 and name  HG1) (resid 554 and name   HN)  4.0  2.2  1.7 ! A.309  at -1.46e+06
assign (resid 553 and name  HG2) (resid 554 and name   HN)  3.0  1.2  1.7 ! A.310  at -1.40e+06
assign (resid 553 and name   HA) (resid 554 and name   HN)  2.5  0.7  0.4 ! A.340  at  3.71e+06
assign (resid 553 and name  HB1) (resid 554 and name   HN)  3.0  1.2  1.1 ! A.351  at  3.50e+06
assign (resid 553 and name HE21) (resid 554 and name   HN)  2.5  0.7  1.2 ! A.341  at  1.48e+06

! K554
assign (resid 554 and name   HN) (resid 554 and name  HB1)  2.5  0.7  1.4 ! A.344  at  5.91e+06
assign (resid 554 and name   HN) (resid 554 and name  HB2)  2.5  0.7  0.4 ! A.345  at  3.49e+06
assign (resid 554 and name   HN) (resid 554 and name  HD1)  3.0  1.2  1.2 ! A.346  at  3.04e+06
assign (resid 554 and name   HN) (resid 554 and name  HG1)  3.0  1.2  1.4 ! A.358  at  3.43e+06
assign (resid 554 and name   HN) (resid 554 and name  HG2)  2.5  0.7  1.0 ! A.347  at  4.40e+06
assign (resid 554 and name  HB1) (resid 554 and name  HD1)  4.0  2.2  2.0 ! A.333  at -9.29e+07
assign (resid 554 and name  HD1) (resid 554 and name   HA)  2.5  0.7  0.2 ! A.337  at -3.19e+06
assign (resid 554 and name  HD2) (resid 554 and name   HA)  2.5  0.7  0.2 ! A.338  at -3.65e+06
assign (resid 554 and name   HN) (resid 555 and name   HA)  3.0  1.2  1.8 ! A.348  at  9.92e+05
assign (resid 554 and name   HN) (resid 555 and name  HD1)  3.0  1.2  1.1 ! A.361  at  3.90e+06
assign (resid 554 and name   HN) (resid 555 and name  HD2)  3.0  1.2  1.9 ! A.362  at  1.61e+06

! P555
assign (resid 555 and name  HG2) (resid 555 and name   HA)  2.5  0.7  1.4 ! A.350  at -1.21e+06
assign (resid 555 and name   HA) (resid 556 and name   HN)  2.5  0.7  0.4 ! A.406  at  7.36e+06
assign (resid 555 and name  HB1) (resid 556 and name   HN)  2.5  0.7  0.8 ! A.388  at  3.43e+06
assign (resid 555 and name  HB2) (resid 556 and name   HN)  2.5  0.7  1.2 ! A.389  at  2.41e+06
assign (resid 555 and name  HG2) (resid 556 and name   HN)  4.0  2.2  1.6 ! A.390  at  1.51e+06
assign (resid 555 and name  HB1) (resid 557 and name HG2#)  2.5  0.7  0.7 ! A.399  at -3.59e+06
assign (resid 555 and name  HB2) (resid 557 and name HG2#)  2.5  0.7  0.7 ! A.400  at -4.26e+06

! I556
assign (resid 556 and name   HN) (resid 556 and name   HB)  2.5  0.7  0.4 ! A.410  at  5.00e+06
assign (resid 556 and name   HN) (resid 556 and name HD1#)  2.5  0.7  0.9 ! A.391  at  3.38e+06
assign (resid 556 and name   HN) (resid 556 and name HG11)  2.5  0.7  0.4 ! A.392  at  1.88e+06
assign (resid 556 and name   HN) (resid 556 and name HG12)  2.5  0.7  1.3 ! A.393  at  1.84e+06
assign (resid 556 and name   HN) (resid 556 and name HG2#)  2.5  0.7  1.3 ! A.394  at  5.38e+06
assign (resid 556 and name   HB) (resid 556 and name HD1#)  2.5  0.7  0.7 ! A.353  at -1.60e+06
assign (resid 556 and name HG2#) (resid 556 and name   HA)  2.5  0.7  0.7 ! A.374  at -4.39e+06
assign (resid 556 and name HG2#) (resid 557 and name HG2#)  3.0  1.2  1.3 ! A.401  at -4.01e+06
assign (resid 556 and name HG2#) (resid 558 and name   HN)  2.5  0.7  0.9 ! A.380  at -1.82e+06
assign (resid 556 and name HG2#) (resid 559 and name   HN)  2.5  0.7  0.9 ! A.424  at  1.26e+06
assign (resid 556 and name HD1#) (resid 560 and name   HA)  2.5  0.7  0.7 ! A.364  at -1.47e+06
assign (resid 556 and name HD1#) (resid 560 and name  HB2)  2.5  0.7  0.7 ! A.365  at -3.05e+06
assign (resid 556 and name HG2#) (resid 560 and name   HA)  2.5  0.7  0.7 ! A.381  at -1.13e+06
assign (resid 556 and name HG2#) (resid 560 and name  HB2)  2.5  0.7  0.7 ! A.382  at -6.18e+06
assign (resid 556 and name HG2#) (resid 560 and name   HN)  2.5  0.7  1.4 ! A.440  at  1.70e+06
assign (resid 556 and name   HB) (resid 560 and name  HB1)  2.5  0.7  0.2 ! A.430  at -1.93e+06
assign (resid 556 and name HD1#) (resid 560 and name  HB1)  2.5  0.7  0.7 ! A.431  at -1.77e+06
assign (resid 556 and name HG2#) (resid 560 and name  HB1)  2.5  0.7  0.7 ! A.433  at -3.44e+06
assign (resid 556 and name HG2#) (resid 561 and name   HN)  2.5  0.7  1.2 ! A.383  at -1.76e+06 !! relaxed
assign (resid 556 and name HD1#) (resid 567 and name   HN)  3.0  1.2  1.4 ! A.603  at  1.11e+06
assign (resid 556 and name HD1#) (resid 567 and name  HE1)  2.5  0.7  1.4 ! A.595  at -2.96e+06
assign (resid 556 and name HD1#) (resid 568 and name   HA)  2.5  0.7  0.7 ! A.366  at -1.20e+06
assign (resid 556 and name HD1#) (resid 568 and name   HN)  2.5  0.7  0.9 ! A.367  at -1.75e+06
assign (resid 556 and name HG2#) (resid 568 and name   HN)  3.0  1.2  1.0 ! A.653  at  9.96e+05
assign (resid 556 and name HD1#) (resid 569 and name   HA)  2.5  0.7  0.7 ! A.368  at -2.17e+06
assign (resid 556 and name HD1#) (resid 569 and name   HN)  2.5  0.7  0.9 ! A.369  at -1.27e+06
assign (resid 556 and name HG2#) (resid 569 and name   HA)  2.5  0.7  0.7 ! A.384  at -1.67e+06
assign (resid 556 and name HG2#) (resid 569 and name   HN)  4.0  2.2  1.5 ! A.399  at -7.68e+05
assign (resid 556 and name HG2#) (resid 570 and name  HD2)  2.5  0.7  0.7 ! A.385  at -1.58e+06
assign (resid 556 and name HG2#) (resid 570 and name  HG1)  2.5  0.7  0.7 ! A.386  at -3.45e+06

! T557
assign (resid 557 and name   HA) (resid 557 and name HG2#)  4.0  2.2  2.5 ! A.396  at -1.56e+07
assign (resid 557 and name   HA) (resid 558 and name   HN)  2.5  0.7  0.4 ! A.405  at  2.40e+06
assign (resid 557 and name HG2#) (resid 558 and name   HN)  3.0  1.2  1.1 ! A.406  at  2.00e+06

! G558
assign (resid 558 and name   HN) (resid 559 and name   HN)  2.5  0.7  0.9 ! A.409  at  2.03e+06
assign (resid 558 and name  HA1) (resid 559 and name   HN)  2.5  0.7  0.4 ! A.425  at  6.43e+06
assign (resid 558 and name  HA2) (resid 559 and name   HN)  2.5  0.7  1.0 ! A.426  at  6.05e+06
assign (resid 558 and name   HN) (resid 570 and name  HG2)  4.0  2.2  2.0 ! A.410  at  1.15e+06

! R559
assign (resid 559 and name   HN) (resid 559 and name  HB1)  2.5  0.7  1.0 ! A.427  at  9.56e+06
assign (resid 559 and name   HN) (resid 559 and name  HD1)  3.0  1.2  1.8 ! A.428  at  2.41e+06
assign (resid 559 and name   HN) (resid 559 and name  HG2)  2.5  0.7  0.8 ! A.429  at  2.59e+06
assign (resid 559 and name  HB1) (resid 559 and name  HD1)  4.0  2.2  2.0 ! A.413  at -1.66e+07
assign (resid 559 and name  HD1) (resid 559 and name   HA)  2.5  0.7  0.2 ! A.416  at -2.63e+06
assign (resid 559 and name  HG1) (resid 559 and name   HA)  2.5  0.7  1.1 ! A.418  at -4.04e+06
assign (resid 559 and name  HG1) (resid 559 and name   HN)  3.0  1.2  1.1 ! A.422  at -4.13e+06
assign (resid 559 and name  HG2) (resid 559 and name   HA)  2.5  0.7  0.2 ! A.419  at -3.97e+06
assign (resid 559 and name   HA) (resid 560 and name   HN)  4.0  2.2  2.0 ! A.441  at  1.51e+07
assign (resid 559 and name  HB1) (resid 560 and name   HN)  4.0  2.2  2.0 ! A.442  at  1.01e+07
assign (resid 559 and name  HD1) (resid 560 and name   HN)  2.5  0.7  0.4 ! A.443  at  1.98e+06
assign (resid 559 and name  HG2) (resid 560 and name   HN)  3.0  1.2  1.4 ! A.444  at  2.69e+06
assign (resid 559 and name   HA) (resid 560 and name  HB1)  3.0  1.2  1.4 ! A.455  at -1.57e+06
assign (resid 559 and name  HB1) (resid 561 and name HD1#)  4.0  2.2  1.2 ! A.453  at -5.60e+06

! C560
assign (resid 560 and name   HN) (resid 560 and name  HB1)  2.5  0.7  0.9 ! A.446  at  4.69e+06
assign (resid 560 and name   HN) (resid 560 and name  HB2)  2.5  0.7  1.4 ! A.447  at  4.04e+06
assign (resid 560 and name  HB1) (resid 561 and name   HN)  3.0  1.2  1.1 ! A.438  at -2.37e+06
assign (resid 560 and name  HB2) (resid 561 and name   HN)  2.5  0.7  0.8 ! A.439  at -2.61e+06
assign (resid 560 and name   HA) (resid 561 and name   HN)  2.5  0.7  0.4 ! A.491  at  3.62e+06
assign (resid 560 and name   HN) (resid 561 and name   HN)  3.0  1.2  1.2 ! A.493  at  1.67e+06
assign (resid 560 and name  HB2) (resid 568 and name   HN)  2.5  0.7  0.9 ! A.612  at  1.18e+06

! I561
assign (resid 561 and name   HN) (resid 561 and name   HB)  2.5  0.7  0.4 ! A.495  at  2.14e+06
assign (resid 561 and name   HN) (resid 561 and name HD1#)  2.5  0.7  1.3 ! A.496  at  1.17e+06
assign (resid 561 and name   HN) (resid 561 and name HG11)  2.5  0.7  0.4 ! A.497  at  1.74e+06
assign (resid 561 and name   HN) (resid 561 and name HG12)  2.5  0.7  0.9 ! A.498  at  1.82e+06
assign (resid 561 and name   HN) (resid 561 and name HG2#)  2.5  0.7  1.3 ! A.499  at  3.22e+06
assign (resid 561 and name   HB) (resid 561 and name HD1#)  2.5  0.7  0.7 ! A.448  at -1.58e+06
assign (resid 561 and name HD1#) (resid 561 and name   HA)  2.5  0.7  1.2 ! A.454  at -8.47e+06
assign (resid 561 and name HG11) (resid 561 and name   HA)  2.5  0.7  0.5 ! A.466  at -1.32e+06
assign (resid 561 and name HG12) (resid 561 and name   HA)  2.5  0.7  0.2 ! A.467  at -1.96e+06
assign (resid 561 and name HG2#) (resid 561 and name   HA)  2.5  0.7  0.7 ! A.476  at -8.24e+06
assign (resid 561 and name   HB) (resid 562 and name   HN)  2.5  0.7  1.3 ! A.452  at -1.29e+06
assign (resid 561 and name HD1#) (resid 562 and name   HN)  3.0  1.2  1.7 ! A.460  at -5.59e+06
assign (resid 561 and name HG11) (resid 562 and name   HN)  3.0  1.2  1.9 ! A.474  at -1.66e+06
assign (resid 561 and name HG12) (resid 562 and name   HN)  2.5  0.7  1.3 ! A.475  at -1.58e+06
assign (resid 561 and name HG2#) (resid 562 and name   HA)  2.5  0.7  1.1 ! A.509  at -1.86e+06
assign (resid 561 and name HG2#) (resid 562 and name   HN)  2.5  0.7  0.9 ! A.482  at -8.23e+06
assign (resid 561 and name   HA) (resid 562 and name   HN)  4.0  2.2  2.0 ! A.519  at  1.05e+07
assign (resid 561 and name   HN) (resid 562 and name   HN)  3.0  1.2  1.3 ! A.522  at  1.84e+06
assign (resid 561 and name HG2#) (resid 562 and name HG2#)  3.0  1.2  1.6 ! A.507  at -2.15e+06
assign (resid 561 and name HG2#) (resid 563 and name  HB#)  2.5  0.7  1.2 ! A.483  at -6.39e+06
assign (resid 561 and name HG2#) (resid 563 and name   HN)  3.0  1.2  1.3 ! A.535  at  1.51e+06
assign (resid 561 and name   HB) (resid 563 and name  HB#)  4.0  2.2  1.3 ! A.561  at -6.05e+06
assign (resid 561 and name   HN) (resid 568 and name  HB1)  4.0  2.2  1.0 ! A.530  at  5.75e+05
assign (resid 561 and name   HB) (resid 568 and name  HB1)  2.5  0.7  0.2 ! A.475  at -1.21e+06
assign (resid 561 and name HD1#) (resid 568 and name  HB1)  2.5  0.7  0.7 ! A.484  at -1.61e+06
assign (resid 561 and name HG2#) (resid 568 and name  HB1)  2.5  0.7  1.0 ! A.512  at -1.71e+06
assign (resid 561 and name HG2#) (resid 568 and name  HB2)  2.5  0.7  0.7 ! A.484  at -2.27e+06
assign (resid 561 and name   HB) (resid 568 and name   HN)  2.5  0.7  1.2 ! A.613  at  1.80e+06
assign (resid 561 and name   HN) (resid 570 and name   HA)  2.5  0.7  1.0 ! A.500  at  1.35e+06
assign (resid 561 and name   HN) (resid 570 and name  HD1)  2.5  0.7  0.4 ! A.532  at  1.22e+06
assign (resid 561 and name   HN) (resid 570 and name  HG2)  3.0  1.2  1.5 ! A.501  at  1.04e+06
assign (resid 561 and name HG11) (resid 570 and name   HA)  2.5  0.7  0.2 ! A.501  at -2.27e+06
assign (resid 561 and name HG12) (resid 570 and name   HA)  2.5  0.7  1.1 ! A.502  at -2.51e+06
assign (resid 561 and name HD1#) (resid 570 and name   HA)  2.5  0.7  0.7 ! A.461  at -8.37e+06
assign (resid 561 and name HD1#) (resid 570 and name  HB1)  2.5  0.7  0.7 ! A.462  at -6.87e+06
assign (resid 561 and name HG2#) (resid 570 and name   HA)  3.0  1.2  1.3 ! A.485  at -3.18e+06
assign (resid 561 and name HD1#) (resid 571 and name   HN)  3.0  1.2  1.7 ! A.635  at  8.25e+05
assign (resid 561 and name HD1#) (resid 573 and name  HB1)  2.5  0.7  0.7 ! A.463  at -7.29e+06
assign (resid 561 and name HG2#) (resid 573 and name  HB1)  2.5  0.7  1.0 ! A.486  at -2.25e+06
assign (resid 561 and name HD1#) (resid 573 and name   HN)  3.0  1.2  1.0 ! A.656  at  9.50e+05
assign (resid 561 and name HD1#) (resid 583 and name   HA)  2.5  0.7  0.7 ! A.464  at -5.39e+06
assign (resid 561 and name HG2#) (resid 583 and name   HA)  2.5  0.7  1.3 ! A.487  at -2.20e+06
assign (resid 561 and name HD1#) (resid 584 and name   HA)  3.0  1.2  1.4 ! A.489  at -2.94e+06
assign (resid 561 and name HD1#) (resid 584 and name  HB1)  2.5  0.7  1.2 ! A.465  at -9.81e+06
assign (resid 561 and name HG2#) (resid 584 and name   HA)  2.5  0.7  1.2 ! A.517  at -1.13e+06
assign (resid 561 and name HG2#) (resid 584 and name  HB1)  2.5  0.7  0.7 ! A.488  at -4.47e+06
!assign (resid 561 and name HG2#) (resid 584 and name  HD1)  3.0  1.2  1.1 ! A.489  at -5.16e+06
assign (resid 561 and name HG2#) (resid 584 and name  HG1)  3.0  1.2  1.5 ! A.818  at -3.05e+06

! T562
assign (resid 562 and name   HN) (resid 562 and name   HB)  2.5  0.7  0.4 ! A.524  at  4.70e+06
assign (resid 562 and name   HN) (resid 562 and name HG2#)  2.5  0.7  1.5 ! A.525  at  5.54e+06
assign (resid 562 and name HG2#) (resid 562 and name   HA)  2.5  0.7  0.7 ! A.508  at -6.12e+06
assign (resid 562 and name   HN) (resid 563 and name  HB#)  3.0  1.2  1.8 ! A.526  at  1.78e+06
assign (resid 562 and name   HB) (resid 563 and name   HN)  2.5  0.7  1.1 ! A.505  at -1.28e+06
assign (resid 562 and name   HB) (resid 563 and name  HB#)  4.0  2.2  1.2 ! A.504  at -1.51e+06
assign (resid 562 and name HG2#) (resid 563 and name   HA)  2.5  0.7  1.2 ! A.511  at -4.48e+06
assign (resid 562 and name HG2#) (resid 563 and name   HN)  2.5  0.7  0.9 ! A.538  at  5.94e+06
assign (resid 562 and name HG2#) (resid 563 and name  HB#)  2.5  0.7  1.2 ! A.512  at -3.71e+06
assign (resid 562 and name   HA) (resid 563 and name   HN)  2.5  0.7  0.4 ! A.536  at  8.92e+06
assign (resid 562 and name   HA) (resid 563 and name  HB#)  2.5  0.7  1.2 ! A.528  at -2.97e+06
assign (resid 562 and name HG2#) (resid 564 and name   HN)  3.0  1.2  1.7 ! A.514  at -1.38e+06
assign (resid 562 and name HG2#) (resid 565 and name   HA)  2.5  0.7  0.7 ! A.515  at -2.90e+06
assign (resid 562 and name HG2#) (resid 565 and name   HN)  2.5  0.7  0.9 ! A.568  at  2.46e+06
assign (resid 562 and name HG2#) (resid 565 and name  HB#)  2.5  0.7  1.2 ! A.562  at -3.05e+06
assign (resid 562 and name HG2#) (resid 566 and name   HN)  2.5  0.7  0.9 ! A.516  at -4.17e+06
assign (resid 562 and name   HB) (resid 567 and name  HD2)  3.0  1.2  2.0 ! A.506  at -1.54e+06
assign (resid 562 and name HG2#) (resid 567 and name  HD2)  2.5  0.7  0.7 ! A.517  at -6.75e+06
assign (resid 562 and name HG2#) (resid 567 and name  HE1)  2.5  0.7  0.7 ! A.596  at -8.25e+06
!assign (resid 562 and name   HN) (resid 584 and name  HE1)  2.5  0.7  0.4 ! A.560  at  1.78e+06

! A563
assign (resid 563 and name   HN) (resid 563 and name  HB#)  2.5  0.7  0.9 ! A.540  at  4.10e+06
assign (resid 563 and name   HN) (resid 564 and name   HN)  2.5  0.7  1.1 ! A.553  at  3.79e+06
assign (resid 563 and name  HB#) (resid 564 and name   HA)  2.5  0.7  1.4 ! A.531  at -4.05e+06
assign (resid 563 and name  HB#) (resid 564 and name   HN)  2.5  0.7  0.9 ! A.533  at -4.90e+06
assign (resid 563 and name  HB#) (resid 564 and name  HG1)  2.5  0.7  0.7 ! A.532  at -2.31e+06
assign (resid 563 and name   HA) (resid 564 and name   HN)  2.5  0.7  0.9 ! A.551  at  6.50e+06
assign (resid 563 and name  HB#) (resid 564 and name  HG2)  2.5  0.7  0.7 ! A.548  at -1.34e+06
assign (resid 563 and name   HA) (resid 565 and name   HN)  2.5  0.7  1.2 ! A.569  at  1.96e+06
assign (resid 563 and name  HB#) (resid 565 and name   HN)  2.5  0.7  0.9 ! A.570  at  1.88e+06
assign (resid 563 and name  HB#) (resid 565 and name  HB#)  3.0  1.2  1.9 ! A.563  at -1.56e+06
assign (resid 563 and name   HN) (resid 566 and name   HN)  2.5  0.7  0.4 ! A.543  at  2.54e+06
assign (resid 563 and name   HN) (resid 566 and name  HB1)  3.0  1.2  1.9 ! A.542  at  9.23e+05
assign (resid 563 and name  HB#) (resid 566 and name  HB1)  2.5  0.7  1.3 ! A.534  at -6.79e+06
assign (resid 563 and name  HB#) (resid 566 and name   HN)  2.5  0.7  0.9 ! A.582  at  1.84e+06
assign (resid 563 and name   HN) (resid 567 and name  HD2)  2.5  0.7  1.3 ! A.544  at  2.40e+06

! M564
assign (resid 564 and name   HN) (resid 564 and name  HB1)  2.5  0.7  1.0 ! A.555  at  5.27e+06
assign (resid 564 and name   HN) (resid 564 and name  HB2)  2.5  0.7  0.4 ! A.556  at  5.27e+06
assign (resid 564 and name   HN) (resid 564 and name  HG1)  2.5  0.7  0.4 ! A.557  at  2.30e+06
assign (resid 564 and name  HG2) (resid 564 and name   HN)  4.0  2.2  1.0 ! A.550  at -5.93e+05
assign (resid 564 and name   HN) (resid 565 and name   HA)  4.0  2.2  1.2 ! A.558  at  1.00e+06
assign (resid 564 and name   HA) (resid 565 and name   HN)  2.5  0.7  0.4 ! A.571  at  3.10e+06
assign (resid 564 and name   HN) (resid 565 and name   HN)  2.5  0.7  0.4 ! A.574  at  3.51e+06
assign (resid 564 and name  HB1) (resid 565 and name   HN)  3.0  1.2  1.3 ! A.607  at  3.70e+06
assign (resid 564 and name  HB2) (resid 565 and name   HN)  2.5  0.7  1.3 ! A.572  at  2.52e+06
assign (resid 564 and name  HG1) (resid 565 and name   HN)  3.0  1.2  1.4 ! A.573  at  1.13e+06
assign (resid 564 and name   HA) (resid 565 and name  HB#)  3.0  1.2  1.1 ! A.564  at -3.19e+06
assign (resid 564 and name   HN) (resid 565 and name  HB#)  4.0  2.2  1.0 ! A.565  at -1.45e+06
assign (resid 564 and name   HN) (resid 566 and name   HN)  2.5  0.7  0.4 ! A.559  at  1.36e+06
assign (resid 564 and name   HA) (resid 566 and name   HN)  3.0  1.2  1.2 ! A.584  at  1.28e+06
assign (resid 564 and name  HB1) (resid 566 and name   HN)  3.0  1.2  1.8 ! A.585  at  2.68e+06
assign (resid 564 and name  HB2) (resid 566 and name   HN)  2.5  0.7  0.8 ! A.586  at  2.68e+06

! A565
assign (resid 565 and name   HN) (resid 565 and name  HB#)  4.0  2.2  2.5 ! A.576  at  1.60e+07
assign (resid 565 and name   HN) (resid 566 and name   HN)  2.5  0.7  0.4 ! A.577  at  5.28e+06
assign (resid 565 and name   HA) (resid 566 and name   HN)  2.5  0.7  0.9 ! A.561  at -2.46e+06
assign (resid 565 and name  HB#) (resid 566 and name   HA)  2.5  0.7  1.4 ! A.566  at -3.20e+06
assign (resid 565 and name  HB#) (resid 566 and name   HN)  2.5  0.7  0.9 ! A.567  at -7.40e+06

! K566
assign (resid 566 and name   HN) (resid 566 and name  HB1)  2.5  0.7  1.0 ! A.590  at  4.94e+06
assign (resid 566 and name   HN) (resid 566 and name  HB2)  4.0  2.2  2.0 ! A.628  at  1.50e+07
assign (resid 566 and name   HN) (resid 566 and name  HE1)  2.5  0.7  0.4 ! A.591  at  3.90e+06
assign (resid 566 and name   HN) (resid 566 and name  HG1)  2.5  0.7  0.9 ! A.592  at  2.43e+06
assign (resid 566 and name   HN) (resid 566 and name  HG2)  4.0  2.2  2.0 ! A.631  at  1.50e+07
assign (resid 566 and name  HG1) (resid 566 and name   HA)  3.0  1.2  0.8 ! A.617  at -8.17e+05
assign (resid 566 and name   HA) (resid 567 and name   HN)  2.5  0.7  0.4 ! A.604  at  7.02e+06
assign (resid 566 and name  HB1) (resid 567 and name   HN)  2.5  0.7  0.4 ! A.605  at  3.82e+06
assign (resid 566 and name   HA) (resid 567 and name  HE1)  4.0  2.2  1.9 ! A.637  at -1.81e+06

! K567
assign (resid 567 and name   HN) (resid 567 and name  HB2)  2.5  0.7  0.4 ! A.607  at  6.33e+06
assign (resid 567 and name   HN) (resid 567 and name  HD2)  2.5  0.7  0.9 ! A.608  at  5.26e+06
assign (resid 567 and name   HN) (resid 567 and name  HE1)  3.0  1.2  1.7 ! A.609  at  1.08e+06
assign (resid 567 and name   HN) (resid 567 and name  HG1)  2.5  0.7  1.1 ! A.610  at  4.09e+06
assign (resid 567 and name  HE1) (resid 567 and name   HA)  2.5  0.7  0.2 ! A.597  at -2.41e+06
assign (resid 567 and name  HE1) (resid 567 and name  HG1)  4.0  2.2  2.0 ! A.599  at -1.29e+07
assign (resid 567 and name   HA) (resid 568 and name   HN)  2.5  0.7  0.4 ! A.614  at  3.48e+06
assign (resid 567 and name  HG1) (resid 568 and name   HN)  3.0  1.2  1.9 ! A.615  at  2.30e+06

! F568
assign (resid 568 and name   HN) (resid 568 and name  HB1)  2.5  0.7  1.3 ! A.616  at  1.23e+06
assign (resid 568 and name   HN) (resid 568 and name  HB2)  2.5  0.7  0.4 ! A.617  at  1.03e+06
assign (resid 568 and name   HA) (resid 569 and name   HN)  2.5  0.7  0.4 ! A.619  at  1.05e+06
assign (resid 568 and name   HN) (resid 569 and name   HN)  3.0  1.2  1.3 ! A.622  at  9.96e+05
assign (resid 568 and name  HB1) (resid 569 and name   HN)  2.5  0.7  0.9 ! A.620  at  1.76e+06
assign (resid 568 and name  HB2) (resid 569 and name   HN)  3.0  1.2  1.3 ! A.621  at  1.14e+06
assign (resid 568 and name  HB2) (resid 573 and name   HN)  4.0  2.2  2.1 ! A.702  at  1.76e+06

! H569
assign (resid 569 and name   HN) (resid 569 and name  HB1)  3.0  1.2  0.5 ! A.624  at  9.25e+05
assign (resid 569 and name   HN) (resid 569 and name  HB2)  2.5  0.7  0.4 ! A.625  at  1.76e+06
assign (resid 569 and name   HA) (resid 571 and name   HN)  2.5  0.7  1.1 ! A.636  at  1.62e+06
assign (resid 569 and name  HB2) (resid 571 and name   HN)  2.5  0.7  1.1 ! A.637  at  1.60e+06
assign (resid 569 and name   HN) (resid 572 and name   HN)  4.0  2.2  1.0 ! A.626  at  7.14e+05
assign (resid 569 and name  HB1) (resid 573 and name   HN)  3.0  1.2  1.5 ! A.703  at  1.15e+06 !! relaxed

! P570
assign (resid 570 and name  HB1) (resid 571 and name   HN)  3.0  1.2  1.5 ! A.638  at  2.07e+06
assign (resid 570 and name   HA) (resid 573 and name   HN)  3.0  1.2  1.3 ! A.657  at  2.67e+06

! E571
assign (resid 571 and name   HN) (resid 571 and name  HB1)  2.5  0.7  1.2 ! A.640  at  3.21e+06
assign (resid 571 and name   HN) (resid 571 and name  HB2)  2.5  0.7  0.4 ! A.641  at  2.85e+06
assign (resid 571 and name   HN) (resid 571 and name  HG1)  2.5  0.7  0.4 ! A.642  at  3.12e+06
assign (resid 571 and name   HN) (resid 571 and name  HG2)  2.5  0.7  0.4 ! A.643  at  2.32e+06
assign (resid 571 and name  HG2) (resid 571 and name   HA)  2.5  0.7  0.2 ! A.629  at -1.09e+06
assign (resid 571 and name   HN) (resid 572 and name   HN)  2.5  0.7  0.4 ! A.644  at  1.79e+06
assign (resid 571 and name   HA) (resid 572 and name   HN)  2.5  0.7  1.0 ! A.647  at  1.30e+06
assign (resid 571 and name  HB1) (resid 572 and name   HN)  2.5  0.7  1.0 ! A.691  at  1.20e+06
assign (resid 571 and name  HG1) (resid 572 and name   HN)  2.5  0.7  0.8 ! A.692  at  1.25e+06
assign (resid 571 and name  HG2) (resid 572 and name   HN)  3.0  1.2  1.5 ! A.648  at  1.19e+06
assign (resid 571 and name   HN) (resid 573 and name   HN)  2.5  0.7  0.9 ! A.645  at  1.20e+06
assign (resid 571 and name   HA) (resid 573 and name   HN)  2.5  0.7  0.9 ! A.658  at  2.67e+06
assign (resid 571 and name   HN) (resid 574 and name HG1#)  3.0  1.2  1.2 ! A.646  at  1.03e+06
assign (resid 571 and name  HG2) (resid 574 and name HG1#)  2.5  0.7  1.4 ! A.634  at -1.15e+06
assign (resid 571 and name   HA) (resid 581 and name HE21)  2.5  0.7  0.7 ! A.750  at  3.10e+06
assign (resid 571 and name   HA) (resid 581 and name HE22)  2.5  0.7  0.2 ! A.751  at  2.53e+06

! H572
assign (resid 572 and name   HN) (resid 572 and name  HB1)  2.5  0.7  1.2 ! A.651  at  1.87e+06
assign (resid 572 and name   HN) (resid 572 and name  HB2)  2.5  0.7  0.4 ! A.652  at  1.96e+06
assign (resid 572 and name   HN) (resid 573 and name   HN)  2.5  0.7  0.4 ! A.653  at  4.02e+06
assign (resid 572 and name   HA) (resid 573 and name   HN)  2.5  0.7  0.9 ! A.659  at  2.81e+06
assign (resid 572 and name  HB2) (resid 573 and name   HN)  2.5  0.7  0.9 ! A.660  at  1.99e+06
assign (resid 572 and name   HN) (resid 574 and name HG1#)  3.0  1.2  1.3 ! A.654  at  1.78e+06 !! relaxed
assign (resid 572 and name   HA) (resid 574 and name HG1#)  3.0  1.2  1.2 ! A.670  at -2.98e+06
assign (resid 572 and name   HA) (resid 574 and name HG2#)  2.5  0.7  1.1 ! A.682  at -1.32e+06

! F573
assign (resid 573 and name   HN) (resid 573 and name  HB1)  2.5  0.7  0.4 ! A.663  at  2.40e+06
assign (resid 573 and name   HN) (resid 573 and name  HB2)  2.5  0.7  0.4 ! A.664  at  2.98e+06
assign (resid 573 and name   HN) (resid 574 and name   HA)  3.0  1.2  1.3 ! A.665  at  9.96e+05
assign (resid 573 and name   HN) (resid 574 and name   HN)  2.5  0.7  0.4 ! A.695  at  1.79e+06
assign (resid 573 and name   HN) (resid 574 and name HG1#)  2.5  0.7  0.9 ! A.666  at  3.32e+06
assign (resid 573 and name   HA) (resid 574 and name   HN)  2.5  0.7  0.4 ! A.692  at  4.51e+06
assign (resid 573 and name  HB1) (resid 574 and name   HN)  3.0  1.2  1.1 ! A.693  at  1.47e+06
assign (resid 573 and name  HB2) (resid 574 and name   HN)  3.0  1.2  1.6 ! A.694  at  1.85e+06
assign (resid 573 and name   HA) (resid 574 and name HG1#)  4.0  2.2  1.5 ! A.671  at -7.06e+05
assign (resid 573 and name   HA) (resid 574 and name HG2#)  3.0  1.2  1.0 ! A.683  at -2.31e+06
assign (resid 573 and name   HN) (resid 574 and name HG2#)  2.5  0.7  1.4 ! A.734  at -1.05e+06

! V574
assign (resid 574 and name   HN) (resid 574 and name   HB)  2.5  0.7  1.1 ! A.697  at  1.48e+06
assign (resid 574 and name   HN) (resid 574 and name HG1#)  2.5  0.7  0.9 ! A.698  at  9.09e+06
assign (resid 574 and name   HN) (resid 574 and name HG2#)  2.5  0.7  0.9 ! A.699  at  9.09e+06
assign (resid 574 and name HG1#) (resid 574 and name   HA)  2.5  0.7  0.7 ! A.672  at -3.82e+06
assign (resid 574 and name HG2#) (resid 574 and name   HA)  2.5  0.7  0.7 ! A.684  at -1.98e+06
assign (resid 574 and name HG1#) (resid 575 and name   HN)  2.5  0.7  0.9 ! A.675  at -5.38e+06
assign (resid 574 and name HG2#) (resid 575 and name   HN)  2.5  0.7  0.9 ! A.687  at -2.46e+06
assign (resid 574 and name   HB) (resid 575 and name   HN)  2.5  0.7  0.4 ! A.704  at  2.34e+06
assign (resid 574 and name HG2#) (resid 576 and name   HA)  2.5  0.7  1.3 ! A.688  at -5.60e+06
assign (resid 574 and name HG2#) (resid 576 and name  HB#)  3.0  1.2  1.3 ! A.740  at -1.94e+06
assign (resid 574 and name HG1#) (resid 579 and name   HN)  4.0  2.2  1.8 ! A.724  at -1.19e+06
assign (resid 574 and name HG2#) (resid 579 and name   HN)  3.0  1.2  1.4 ! A.743  at -1.89e+06
assign (resid 574 and name HG2#) (resid 579 and name  HB1)  2.5  0.7  0.7 ! A.741  at -3.49e+06
assign (resid 574 and name HG2#) (resid 579 and name HD1#)  3.0  1.2  1.2 ! A.742  at -8.85e+06
assign (resid 574 and name   HN) (resid 581 and name   HA)  4.0  2.2  1.6 ! A.700  at  1.50e+06
assign (resid 574 and name HG1#) (resid 581 and name   HA)  2.5  0.7  0.7 ! A.676  at -9.07e+06
assign (resid 574 and name HG1#) (resid 581 and name  HB2)  2.5  0.7  1.4 ! A.677  at -7.17e+06
assign (resid 574 and name HG1#) (resid 581 and name  HG2)  4.0  2.2  1.2 ! A.678  at -6.26e+06
assign (resid 574 and name HG1#) (resid 581 and name   HN)  2.5  0.7  1.4 ! A.743  at  3.42e+06
assign (resid 574 and name HG1#) (resid 581 and name  HG1)  3.0  1.2  1.2 ! A.737  at -4.73e+06
assign (resid 574 and name   HA) (resid 581 and name  HG2)  4.0  2.2  2.5 ! A.736  at -1.24e+06
assign (resid 574 and name   HA) (resid 581 and name HE21)  2.5  0.7  1.0 ! A.752  at  2.51e+06
assign (resid 574 and name HG1#) (resid 581 and name HE21)  2.5  0.7  0.7 ! A.753  at  2.02e+06
assign (resid 574 and name HG1#) (resid 581 and name HE22)  2.5  0.7  0.7 ! A.754  at  1.84e+06
assign (resid 574 and name   HN) (resid 582 and name   HN)  4.0  2.2  1.4 ! A.703  at  8.79e+05
assign (resid 574 and name   HN) (resid 582 and name  HB1)  3.0  1.2  1.7 ! A.701  at  1.27e+06
assign (resid 574 and name   HN) (resid 582 and name HD2#)  3.0  1.2  1.6 ! A.702  at  1.68e+06
assign (resid 574 and name HG1#) (resid 582 and name   HN)  2.5  0.7  0.9 ! A.681  at -3.04e+06
assign (resid 574 and name HG1#) (resid 582 and name  HB2)  3.0  1.2  1.3 ! A.679  at -2.31e+06
assign (resid 574 and name HG1#) (resid 582 and name HD2#)  3.0  1.2  1.7 ! A.680  at -1.63e+06
assign (resid 574 and name HG2#) (resid 582 and name   HN)  4.0  2.2  2.5 ! A.691  at -4.73e+05
assign (resid 574 and name HG2#) (resid 582 and name  HB2)  3.0  1.2  1.2 ! A.689  at -8.85e+06
assign (resid 574 and name HG2#) (resid 582 and name HD2#)  3.0  1.2  1.3 ! A.690  at -1.26e+06
assign (resid 574 and name   HB) (resid 582 and name   HN)  2.5  0.7  1.5 ! A.785  at  1.37e+06
assign (resid 574 and name   HA) (resid 582 and name HD1#)  3.0  1.2  1.1 ! A.836  at -2.16e+06

! C575
assign (resid 575 and name   HA) (resid 576 and name   HN)  2.5  0.7  0.4 ! A.712  at  3.08e+06
assign (resid 575 and name  HB1) (resid 576 and name   HN)  3.0  1.2  1.6 ! A.713  at  1.39e+06
assign (resid 575 and name  HB2) (resid 576 and name   HN)  2.5  0.7  1.2 ! A.714  at  1.32e+06
assign (resid 575 and name   HN) (resid 582 and name   HN)  3.0  1.2  0.9 ! A.787  at  8.95e+05
assign (resid 575 and name   HA) (resid 582 and name HD1#)  2.5  0.7  0.7 ! A.764  at -1.70e+06
assign (resid 575 and name   HN) (resid 582 and name HD1#)  2.5  0.7  0.9 ! A.765  at -2.90e+06
assign (resid 575 and name  HB2) (resid 582 and name HD1#)  2.5  0.7  0.7 ! A.838  at -1.79e+06
assign (resid 575 and name   HA) (resid 582 and name HD2#)  2.5  0.7  0.7 ! A.776  at -1.16e+06
assign (resid 575 and name   HN) (resid 582 and name HD2#)  2.5  0.7  0.9 ! A.777  at -1.01e+06

! A576
assign (resid 576 and name   HN) (resid 576 and name  HB#)  2.5  0.7  0.9 ! A.716  at  5.24e+06
assign (resid 576 and name  HB#) (resid 577 and name  HB2)  3.0  1.2  1.6 ! A.708  at -2.69e+06
assign (resid 576 and name   HA) (resid 579 and name HD1#)  2.5  0.7  1.3 ! A.720  at -9.09e+06
assign (resid 576 and name   HN) (resid 582 and name HD2#)  2.5  0.7  1.4 ! A.717  at  1.77e+06
assign (resid 576 and name  HB#) (resid 593 and name   HA)  2.5  0.7  1.0 ! A.709  at -2.17e+06
assign (resid 576 and name  HB#) (resid 593 and name   HN)  4.0  2.2  1.5 ! A.767  at -7.83e+05
assign (resid 576 and name  HB#) (resid 593 and name  HB1)  2.5  0.7  0.7 ! A.710  at -1.51e+06
assign (resid 576 and name  HB#) (resid 593 and name  HD1)  2.5  0.7  0.7 ! A.711  at -3.91e+06
assign (resid 576 and name   HN) (resid 594 and name  HB1)  3.0  1.2  1.1 ! A.718  at  1.00e+06
assign (resid 576 and name  HB#) (resid 594 and name  HD1)  3.0  1.2  1.0 ! A.768  at -1.79e+06
assign (resid 576 and name   HN) (resid 595 and name   HA)  2.5  0.7  0.4 ! A.719  at  1.08e+06
assign (resid 576 and name   HN) (resid 596 and name   HN)  3.0  1.2  1.7 ! A.777  at  1.17e+06

! F577

! C578

! L579
assign (resid 579 and name HD1#) (resid 579 and name   HA)  4.0  2.2  2.5 ! A.780  at -1.04e+07
assign (resid 579 and name HD1#) (resid 579 and name   HN)  2.5  0.7  0.9 ! A.723  at -5.55e+06 !new
assign (resid 579 and name HD1#) (resid 579 and name  HB1)  2.5  0.7  0.7 ! A.721  at -6.18e+06 !new
assign (resid 579 and name HD1#) (resid 579 and name  HB2)  2.5  0.7  0.7 ! A.722  at -5.38e+06 !new
assign (resid 579 and name HD2#) (resid 579 and name  HB2)  2.5  0.7  0.7 ! A.724  at -2.71e+06 !new

! K580
assign (resid 580 and name  HB1) (resid 580 and name  HD1)  2.5  0.7  0.8 ! A.721  at -7.76e+06
assign (resid 580 and name  HB1) (resid 580 and name  HE1)  3.0  1.2  1.5 ! A.722  at -2.31e+06
assign (resid 580 and name  HB2) (resid 580 and name  HE1)  3.0  1.2  1.8 ! A.790  at -2.10e+06
assign (resid 580 and name  HD1) (resid 580 and name   HA)  3.0  1.2  1.2 ! A.724  at -5.02e+06
assign (resid 580 and name  HE1) (resid 580 and name  HG2)  4.0  2.2  2.0 ! A.728  at -6.97e+07
assign (resid 580 and name  HG1) (resid 580 and name   HA)  3.0  1.2  1.3 ! A.729  at -3.19e+06
assign (resid 580 and name  HG1) (resid 580 and name  HE1)  4.0  2.2  2.0 ! A.731  at -1.89e+07
assign (resid 580 and name  HG2) (resid 580 and name   HA)  2.5  0.7  1.1 ! A.730  at -1.78e+06
assign (resid 580 and name   HA) (resid 581 and name   HN)  2.5  0.7  1.1 ! A.744  at  8.28e+06
assign (resid 580 and name  HD1) (resid 581 and name   HN)  4.0  2.2  1.0 ! A.745  at  3.30e+06
assign (resid 580 and name  HG2) (resid 581 and name   HN)  4.0  2.2  1.2 ! A.746  at  2.40e+06
assign (resid 580 and name  HD1) (resid 582 and name HD1#)  4.0  2.2  2.1 ! A.796  at -5.64e+06
assign (resid 580 and name  HE1) (resid 582 and name HD1#)  4.0  2.2  1.2 ! A.800  at -7.94e+06
assign (resid 580 and name  HG2) (resid 582 and name HD1#)  4.0  2.2  3.0 ! A.766  at -5.55e+06

! Q581
assign (resid 581 and name   HN) (resid 581 and name  HB2)  4.0  2.2  2.0 ! A.748  at  1.59e+07
assign (resid 581 and name   HN) (resid 581 and name  HG2)  4.0  2.2  1.2 ! A.749  at  3.45e+06
assign (resid 581 and name  HG1) (resid 581 and name HE22)  2.5  0.7  1.1 ! A.739  at -5.22e+06
assign (resid 581 and name  HG2) (resid 581 and name HE22)  2.5  0.7  1.4 ! A.740  at -2.18e+06
assign (resid 581 and name HE21) (resid 581 and name  HB2)  2.5  0.7  0.9 ! A.755  at  3.67e+06
assign (resid 581 and name HE21) (resid 581 and name  HG2)  4.0  2.2  2.0 ! A.759  at  1.45e+07
assign (resid 581 and name HE22) (resid 581 and name  HB2)  3.0  1.2  1.0 ! A.756  at  3.13e+06
assign (resid 581 and name  HG1) (resid 582 and name   HN)  2.5  0.7  1.1 ! A.741  at -3.16e+06
assign (resid 581 and name  HG2) (resid 582 and name   HN)  2.5  0.7  1.4 ! A.742  at -1.99e+06
assign (resid 581 and name HE21) (resid 582 and name   HN)  2.5  0.7  0.4 ! A.762  at  2.33e+06
assign (resid 581 and name HE21) (resid 582 and name  HB1)  3.0  1.2  1.1 ! A.761  at  1.63e+06
assign (resid 581 and name HE22) (resid 582 and name   HN)  2.5  0.7  0.7 ! A.763  at  1.47e+06
assign (resid 581 and name   HA) (resid 582 and name   HN)  2.5  0.7  0.4 ! A.788  at  2.86e+06
assign (resid 581 and name  HB2) (resid 582 and name   HN)  2.5  0.7  1.4 ! A.789  at  2.02e+06

! L582
assign (resid 582 and name   HN) (resid 582 and name   HG)  3.0  1.2  1.7 ! A.795  at  9.88e+05
assign (resid 582 and name   HN) (resid 582 and name  HB2)  2.5  0.7  0.4 ! A.792  at  1.31e+06
assign (resid 582 and name   HN) (resid 582 and name HD1#)  3.0  1.2  1.3 ! A.793  at  2.47e+06
assign (resid 582 and name   HN) (resid 582 and name HD2#)  3.0  1.2  1.5 ! A.794  at  1.46e+06
assign (resid 582 and name HD1#) (resid 582 and name   HA)  4.0  2.2  2.5 ! A.767  at -1.22e+07
assign (resid 582 and name HD2#) (resid 582 and name   HA)  4.0  2.2  1.5 ! A.778  at -7.45e+05
assign (resid 582 and name   HA) (resid 583 and name   HN)  2.5  0.7  0.4 ! A.798  at  5.53e+06
assign (resid 582 and name   HG) (resid 583 and name   HN)  2.5  0.7  0.4 ! A.802  at  2.65e+06
assign (resid 582 and name  HB1) (resid 583 and name   HN)  2.5  0.7  0.8 ! A.799  at  1.87e+06
assign (resid 582 and name HD1#) (resid 583 and name   HN)  2.5  0.7  0.9 ! A.800  at  5.66e+06
assign (resid 582 and name HD2#) (resid 583 and name   HN)  2.5  0.7  0.9 ! A.801  at  3.00e+06
assign (resid 582 and name HD1#) (resid 587 and name   HA)  2.5  0.7  0.7 ! A.845  at -2.43e+06
assign (resid 582 and name HD1#) (resid 587 and name  HB2)  2.5  0.7  0.7 ! A.771  at -3.23e+06
assign (resid 582 and name HD2#) (resid 587 and name  HB2)  2.5  0.7  0.7 ! A.782  at -1.32e+06
assign (resid 582 and name HD1#) (resid 587 and name   HN)  3.0  1.2  1.3 ! A.849  at  2.56e+06
assign (resid 582 and name HD2#) (resid 587 and name   HN)  3.0  1.2  1.8 ! A.850  at  1.20e+06
assign (resid 582 and name HD2#) (resid 588 and name   HN)  2.5  0.7  0.9 ! A.888  at  1.13e+06
assign (resid 582 and name HD2#) (resid 594 and name  HG1)  3.0  1.2  1.1 ! A.783  at -1.00e+06
assign (resid 582 and name HD2#) (resid 594 and name  HG2)  3.0  1.2  1.0 ! A.784  at -1.48e+06
assign (resid 582 and name HD1#) (resid 595 and name   HA)  2.5  0.7  1.1 ! A.847  at -2.29e+06
assign (resid 582 and name HD2#) (resid 595 and name   HN)  2.5  0.7  0.9 ! A.975  at  1.43e+06
assign (resid 582 and name HD1#) (resid 596 and name   HA)  2.5  0.7  0.7 ! A.772  at -5.26e+06
assign (resid 582 and name HD1#) (resid 596 and name   HN)  2.5  0.7  0.9 ! A.774  at -1.12e+06
assign (resid 582 and name HD1#) (resid 596 and name  HB1)  2.5  0.7  0.7 ! A.773  at -2.62e+06
assign (resid 582 and name HD1#) (resid 596 and name  HB2)  2.5  0.7  1.4 ! A.850  at -4.46e+06
assign (resid 582 and name HD1#) (resid 597 and name   HN)  2.5  0.7  1.4 ! A.775  at -2.16e+06

! N583
assign (resid 583 and name   HN) (resid 583 and name  HB2)  2.5  0.7  0.4 ! A.804  at  5.41e+06
assign (resid 583 and name HD21) (resid 583 and name  HB1)  2.5  0.7  0.2 ! A.805  at  3.34e+06
assign (resid 583 and name HD21) (resid 583 and name  HB2)  2.5  0.7  0.2 ! A.807  at  1.93e+06
assign (resid 583 and name HD22) (resid 583 and name  HB1)  2.5  0.7  1.1 ! A.806  at  3.54e+06
assign (resid 583 and name HD22) (resid 583 and name  HB2)  2.5  0.7  1.0 ! A.808  at  3.10e+06
assign (resid 583 and name  HB1) (resid 586 and name   HN)  2.5  0.7  0.4 ! A.839  at  2.31e+06
assign (resid 583 and name  HB2) (resid 586 and name   HN)  2.5  0.7  0.4 ! A.840  at  1.37e+06

! K584
assign (resid 584 and name   HN) (resid 584 and name  HB1)  2.5  0.7  0.4 ! A.821  at  2.61e+06
assign (resid 584 and name   HN) (resid 584 and name  HG1)  2.5  0.7  0.4 ! A.822  at  1.02e+06 
assign (resid 584 and name  HB1) (resid 584 and name  HE1)  2.5  0.7  0.2 ! A.891  at -2.74e+06
assign (resid 584 and name  HD1) (resid 584 and name   HN)  3.0  1.2  1.4 ! A.816  at -9.97e+05
assign (resid 584 and name  HG1) (resid 584 and name   HA)  2.5  0.7  1.1 ! A.898  at -4.41e+06
assign (resid 584 and name  HG1) (resid 584 and name  HE1)  4.0  2.2  2.0 ! A.899  at -1.89e+07
assign (resid 584 and name  HB1) (resid 585 and name   HN)  3.0  1.2  1.2 ! A.814  at -1.07e+06
assign (resid 584 and name  HD1) (resid 585 and name   HN)  3.0  1.2  1.5 ! A.817  at -1.67e+06
assign (resid 584 and name  HG1) (resid 585 and name   HN)  2.5  0.7  0.4 ! A.820  at -1.25e+06
assign (resid 584 and name  HG1) (resid 585 and name  HA1)  2.5  0.7  0.9 ! A.823  at -3.24e+06
assign (resid 584 and name   HA) (resid 587 and name   HN)  2.5  0.7  0.8 ! A.851  at  3.54e+06
assign (resid 584 and name  HB1) (resid 587 and name   HN)  4.0  2.2  1.7 ! A.852  at  1.84e+06 !! relaxed

! G585
assign (resid 585 and name   HN) (resid 586 and name   HN)  2.5  0.7  0.4 ! A.830  at  2.74e+06
assign (resid 585 and name   HN) (resid 586 and name HG2#)  2.5  0.7  0.9 ! A.829  at  1.26e+06
assign (resid 585 and name  HA1) (resid 586 and name   HN)  2.5  0.7  0.4 ! A.841  at  2.86e+06
assign (resid 585 and name  HA2) (resid 586 and name   HN)  2.5  0.7  0.9 ! A.842  at  2.95e+06
assign (resid 585 and name  HA2) (resid 586 and name HG2#)  2.5  0.7  1.4 ! A.833  at -1.85e+06
assign (resid 585 and name   HN) (resid 587 and name   HN)  2.5  0.7  1.2 ! A.854  at  1.20e+06
assign (resid 585 and name  HA2) (resid 587 and name   HN)  3.0  1.2  1.0 ! A.853  at  1.33e+06

! T586
assign (resid 586 and name   HN) (resid 586 and name   HB)  2.5  0.7  1.4 ! A.845  at  1.62e+06
assign (resid 586 and name   HN) (resid 586 and name HG2#)  2.5  0.7  0.9 ! A.846  at  6.33e+06
assign (resid 586 and name HG2#) (resid 586 and name   HA)  4.0  2.2  2.5 ! A.835  at -2.55e+07
assign (resid 586 and name   HN) (resid 587 and name   HN)  2.5  0.7  0.4 ! A.848  at  7.32e+06
assign (resid 586 and name   HN) (resid 587 and name  HB1)  2.5  0.7  1.2 ! A.847  at  2.31e+06
assign (resid 586 and name HG2#) (resid 587 and name   HN)  3.0  1.2  1.0 ! A.838  at -3.86e+06
assign (resid 586 and name   HA) (resid 587 and name   HN)  2.5  0.7  0.4 ! A.855  at  3.64e+06
assign (resid 586 and name   HB) (resid 587 and name   HN)  3.0  1.2  1.6 ! A.856  at  1.57e+06
assign (resid 586 and name   HB) (resid 597 and name   HN)  3.0  1.2  0.5 ! A.1004 at  1.00e+06
assign (resid 586 and name   HB) (resid 597 and name  HB1)  2.5  0.7  1.3 ! A.990  at -1.65e+06

! F587
assign (resid 587 and name   HN) (resid 587 and name  HB1)  2.5  0.7  0.4 ! A.859  at  5.39e+06
assign (resid 587 and name   HN) (resid 587 and name  HB2)  2.5  0.7  1.2 ! A.860  at  5.68e+06
assign (resid 587 and name   HN) (resid 588 and name   HN)  3.0  1.2  1.3 ! A.861  at  2.53e+06
assign (resid 587 and name   HA) (resid 588 and name   HN)  2.5  0.7  0.4 ! A.889  at  1.94e+06
assign (resid 587 and name  HB1) (resid 588 and name   HN)  3.0  1.2  1.4 ! A.890  at  1.93e+06
assign (resid 587 and name  HB2) (resid 588 and name   HN)  2.5  0.7  1.2 ! A.891  at  1.93e+06
assign (resid 587 and name  HB1) (resid 595 and name   HN)  4.0  2.2  1.6 ! A.976  at  1.31e+06

! K588
assign (resid 588 and name   HN) (resid 588 and name  HB1)  2.5  0.7  0.4 ! A.894  at  1.78e+06
assign (resid 588 and name   HN) (resid 588 and name  HB2)  2.5  0.7  0.4 ! A.895  at  1.61e+06
assign (resid 588 and name  HD1) (resid 588 and name   HA)  2.5  0.7  0.2 ! A.863  at -4.84e+06
assign (resid 588 and name  HD2) (resid 588 and name   HA)  2.5  0.7  1.2 ! A.864  at -4.28e+06
assign (resid 588 and name  HE1) (resid 588 and name   HA)  2.5  0.7  0.7 ! A.872  at -2.73e+06
assign (resid 588 and name  HE1) (resid 588 and name   HN)  3.0  1.2  0.5 ! A.883  at -9.89e+05
assign (resid 588 and name  HE1) (resid 588 and name  HB2)  2.5  0.7  0.2 ! A.874  at -6.76e+06
assign (resid 588 and name  HE1) (resid 588 and name  HG1)  2.5  0.7  1.1 ! A.879  at -5.35e+06
assign (resid 588 and name  HE1) (resid 588 and name  HG2)  2.5  0.7  0.2 ! A.881  at -6.76e+06
assign (resid 588 and name  HE2) (resid 588 and name   HA)  2.5  0.7  0.2 ! A.873  at -2.67e+06
assign (resid 588 and name  HE2) (resid 588 and name  HB2)  2.5  0.7  0.8 ! A.875  at -6.92e+06
assign (resid 588 and name  HE2) (resid 588 and name  HG1)  2.5  0.7  1.2 ! A.880  at -4.65e+06
assign (resid 588 and name  HE2) (resid 588 and name  HG2)  2.5  0.7  1.2 ! A.882  at -6.92e+06
assign (resid 588 and name  HD1) (resid 589 and name   HN)  2.5  0.7  0.8 ! A.870  at -2.32e+06
assign (resid 588 and name  HD2) (resid 589 and name   HN)  3.0  1.2  1.7 ! A.871  at -2.03e+06
assign (resid 588 and name  HE1) (resid 589 and name   HN)  4.0  2.2  1.2 ! A.884  at -1.85e+06
assign (resid 588 and name   HA) (resid 589 and name   HN)  4.0  2.2  2.0 ! A.905  at  1.64e+07
assign (resid 588 and name   HN) (resid 589 and name   HN)  3.0  1.2  1.6 ! A.993  at  2.34e+06
assign (resid 588 and name  HB1) (resid 589 and name   HN)  2.5  0.7  0.4 ! A.906  at  6.84e+06
assign (resid 588 and name  HB2) (resid 589 and name   HN)  3.0  1.2  1.1 ! A.907  at  6.05e+06
assign (resid 588 and name  HG1) (resid 589 and name   HN)  2.5  0.7  0.4 ! A.909  at  1.91e+06
assign (resid 588 and name  HE1) (resid 597 and name   HA)  2.5  0.7  1.1 ! A.885  at -1.47e+06
assign (resid 588 and name  HE2) (resid 597 and name   HA)  3.0  1.2  1.8 ! A.886  at -8.71e+05
assign (resid 588 and name  HB1) (resid 597 and name  HB1)  4.0  2.2  1.5 ! A.1077 at -1.23e+06
assign (resid 588 and name  HD1) (resid 597 and name  HB1)  4.0  2.2  2.1 ! A.1078 at -1.23e+06
assign (resid 588 and name  HG2) (resid 597 and name  HB1)  3.0  1.2  1.4 ! A.1079 at -1.79e+06
assign (resid 588 and name  HB1) (resid 597 and name  HG1)  4.0  2.2  2.1 ! A.1084 at -3.69e+06
!assign (resid 588 and name  HD1) (resid 597 and name  HG1)  4.0  2.2  2.7 ! A.1085 at -3.69e+06
assign (resid 588 and name  HD1) (resid 597 and name HE21)  3.0  1.2  1.6 ! A.1011 at  2.27e+06
assign (resid 588 and name  HG2) (resid 597 and name HE21)  2.5  0.7  0.2 ! A.1013 at  8.75e+06
assign (resid 588 and name  HD1) (resid 597 and name HE22)  3.0  1.2  1.5 ! A.1012 at  3.70e+06
assign (resid 588 and name  HG2) (resid 597 and name HE22)  2.5  0.7  0.2 ! A.1014 at  6.65e+06

! E589
assign (resid 589 and name   HN) (resid 589 and name  HB2)  4.0  2.2  2.0 ! A.911  at  1.15e+07
assign (resid 589 and name   HN) (resid 589 and name  HG1)  3.0  1.2  1.8 ! A.912  at  5.57e+06
assign (resid 589 and name   HN) (resid 589 and name  HG2)  3.0  1.2  1.2 ! A.913  at  5.57e+06
assign (resid 589 and name  HG1) (resid 589 and name   HA)  2.5  0.7  0.2 ! A.898  at -2.83e+06
assign (resid 589 and name  HG2) (resid 589 and name   HA)  2.5  0.7  1.1 ! A.899  at -2.25e+06
assign (resid 589 and name   HN) (resid 590 and name   HN)  3.0  1.2  1.2 ! A.914  at  3.19e+06
assign (resid 589 and name   HA) (resid 590 and name   HN)  2.5  0.7  0.4 ! A.896  at -1.25e+06
assign (resid 589 and name  HB2) (resid 590 and name   HN)  2.5  0.7  0.9 ! A.897  at -2.17e+06
assign (resid 589 and name  HG1) (resid 590 and name   HN)  2.5  0.7  0.4 ! A.902  at -2.22e+06
assign (resid 589 and name  HG2) (resid 590 and name   HN)  2.5  0.7  0.4 ! A.903  at -2.79e+06
assign (resid 589 and name  HB2) (resid 592 and name   HN)  4.0  2.2  1.3 ! A.957  at  2.09e+06
assign (resid 589 and name  HG1) (resid 592 and name   HN)  2.5  0.7  0.4 ! A.958  at  2.33e+06
assign (resid 589 and name  HG1) (resid 593 and name   HN)  2.5  0.7  0.4 ! A.904  at -1.68e+06
assign (resid 589 and name   HA) (resid 593 and name   HN)  3.0  1.2  1.7 ! A.966  at  1.51e+06
assign (resid 589 and name   HN) (resid 595 and name   HN)  4.0  2.2  1.0 ! A.978  at  6.98e+05
assign (resid 589 and name  HB2) (resid 595 and name   HN)  3.0  1.2  1.3 ! A.977  at  1.31e+06

! Q590
assign (resid 590 and name   HN) (resid 590 and name  HB1)  2.5  0.7  0.7 ! A.920  at  1.09e+06
assign (resid 590 and name   HN) (resid 590 and name  HG1)  3.0  1.2  1.5 ! A.921  at  2.89e+06
assign (resid 590 and name   HN) (resid 591 and name  HB1)  4.0  2.2  2.2 ! A.922  at  1.15e+06
assign (resid 590 and name  HG1) (resid 591 and name   HN)  3.0  1.2  0.5 ! A.932  at  8.34e+05
assign (resid 590 and name  HB1) (resid 591 and name HD22)  3.0  1.2  0.3 ! A.936  at  9.85e+05
assign (resid 590 and name  HB2) (resid 591 and name HD22)  2.5  0.7  0.8 ! A.1022 at  1.83e+06
assign (resid 590 and name  HG1) (resid 591 and name HD22)  2.5  0.7  0.2 ! A.937  at  2.13e+06
assign (resid 590 and name   HN) (resid 593 and name   HA)  4.0  2.2  1.1 ! A.1007 at  1.01e+06
assign (resid 590 and name   HN) (resid 593 and name   HN)  2.5  0.7  0.4 ! A.923  at  1.89e+06
assign (resid 590 and name HE22) (resid 604 and name  HB2)  2.5  0.7  0.2 ! A.924  at  1.52e+06

! N591
assign (resid 591 and name   HN) (resid 591 and name  HB1)  2.5  0.7  1.5 ! A.934  at  1.26e+06
assign (resid 591 and name   HN) (resid 591 and name  HB2)  3.0  1.2  1.0 ! A.935  at  9.52e+05
assign (resid 591 and name  HB1) (resid 591 and name HD21)  2.5  0.7  0.2 ! A.930  at -1.98e+06
assign (resid 591 and name  HB2) (resid 591 and name HD22)  3.0  1.2  1.0 ! A.931  at -2.04e+06
assign (resid 591 and name HD21) (resid 591 and name   HA)  3.0  1.2  0.3 ! A.938  at  9.46e+05
assign (resid 591 and name HD21) (resid 591 and name  HB2)  2.5  0.7  0.9 ! A.942  at  2.30e+06
assign (resid 591 and name HD22) (resid 591 and name   HA)  3.0  1.2  1.5 ! A.939  at  8.64e+05
assign (resid 591 and name HD22) (resid 591 and name  HB1)  2.5  0.7  1.4 ! A.941  at  3.62e+06
assign (resid 591 and name   HN) (resid 592 and name   HN)  2.5  0.7  0.4 ! A.959  at  1.48e+06

! D592
assign (resid 592 and name   HN) (resid 592 and name  HB1)  3.0  1.2  1.1 ! A.961  at  7.90e+06
assign (resid 592 and name   HN) (resid 592 and name  HB2)  2.5  0.7  1.3 ! A.962  at  5.20e+06
assign (resid 592 and name   HN) (resid 593 and name   HN)  2.5  0.7  0.4 ! A.964  at  6.04e+06
assign (resid 592 and name   HN) (resid 593 and name  HB2)  3.0  1.2  1.8 ! A.963  at  1.30e+06
assign (resid 592 and name  HB2) (resid 593 and name   HN)  2.5  0.7  0.8 ! A.956  at -1.43e+06
assign (resid 592 and name  HB2) (resid 593 and name  HB1)  4.0  2.2  1.7 ! A.955  at -2.19e+06
assign (resid 592 and name   HA) (resid 593 and name   HN)  2.5  0.7  0.9 ! A.967  at  5.83e+06
assign (resid 592 and name  HB1) (resid 593 and name   HN)  3.0  1.2  1.4 ! A.968  at  5.23e+06

! K593
assign (resid 593 and name   HN) (resid 593 and name  HB1)  2.5  0.7  1.0 ! A.971  at  6.08e+06
assign (resid 593 and name   HN) (resid 593 and name  HB2)  2.5  0.7  0.4 ! A.972  at  5.60e+06
assign (resid 593 and name   HN) (resid 593 and name  HG1)  2.5  0.7  0.4 ! A.973  at  2.78e+06
assign (resid 593 and name   HN) (resid 593 and name  HG2)  2.5  0.7  0.4 ! A.974  at  3.52e+06
assign (resid 593 and name  HD1) (resid 593 and name   HN)  3.0  1.2  1.8 ! A.965  at -2.10e+06

! P594
assign (resid 594 and name   HA) (resid 595 and name   HN)  2.5  0.7  0.4 ! A.979  at  1.97e+06
assign (resid 594 and name  HB1) (resid 595 and name   HN)  2.5  0.7  0.4 ! A.980  at  1.46e+06

! Y595
assign (resid 595 and name   HA) (resid 596 and name   HN)  3.0  1.2  0.5 ! A.982  at  8.68e+05
assign (resid 595 and name  HB2) (resid 596 and name   HN)  3.0  1.2  1.1 ! A.983  at  1.56e+06

! C596
assign (resid 596 and name   HN) (resid 596 and name  HB1)  2.5  0.7  1.1 ! A.985  at  1.66e+06
assign (resid 596 and name   HN) (resid 597 and name   HN)  3.0  1.2  1.7 ! A.986  at  1.23e+06
assign (resid 596 and name   HA) (resid 597 and name   HN)  2.5  0.7  0.4 ! A.1005 at  2.20e+06
assign (resid 596 and name  HB1) (resid 597 and name   HN)  2.5  0.7  0.4 ! A.1006 at  1.60e+06
assign (resid 596 and name  HB2) (resid 597 and name   HN)  2.5  0.7  1.0 ! A.1098 at  1.54e+06
assign (resid 596 and name   HA) (resid 597 and name  HG1)  4.0  2.2  2.2 ! A.995  at -1.73e+06
assign (resid 596 and name   HA) (resid 598 and name   HN)  3.0  1.2  1.5 ! A.1025 at  3.93e+06
assign (resid 596 and name  HB1) (resid 598 and name   HN)  2.5  0.7  1.0 ! A.1026 at  1.81e+06

! Q597
assign (resid 597 and name   HN) (resid 597 and name  HB1)  2.5  0.7  0.4 ! A.1008 at  7.12e+06
assign (resid 597 and name   HN) (resid 597 and name  HG1)  3.0  1.2  1.0 ! A.1009 at  2.09e+06
assign (resid 597 and name   HA) (resid 597 and name  HG1)  2.5  0.7  0.7 ! A.988  at -3.96e+06
assign (resid 597 and name  HG1) (resid 597 and name HE21)  4.0  2.2  2.0 ! A.998  at -1.12e+07
assign (resid 597 and name  HG1) (resid 597 and name HE22)  2.5  0.7  1.2 ! A.999  at -8.56e+06
assign (resid 597 and name HE21) (resid 597 and name   HA)  2.5  0.7  0.2 ! A.1015 at  1.68e+06
assign (resid 597 and name HE21) (resid 597 and name  HB1)  2.5  0.7  1.0 ! A.1017 at  1.51e+06
assign (resid 597 and name HE22) (resid 597 and name   HA)  3.0  1.2  0.3 ! A.1016 at  9.12e+05
assign (resid 597 and name HE22) (resid 597 and name  HB1)  3.0  1.2  1.6 ! A.1018 at  1.88e+06
assign (resid 597 and name   HN) (resid 598 and name   HN)  2.5  0.7  0.4 ! A.1010 at  1.76e+06
assign (resid 597 and name  HB1) (resid 598 and name   HN)  2.5  0.7  0.4 ! A.994  at -3.04e+06
assign (resid 597 and name  HG1) (resid 598 and name   HA)  2.5  0.7  0.5 ! A.1001 at -5.83e+06
assign (resid 597 and name  HG1) (resid 598 and name   HN)  2.5  0.7  0.4 ! A.1002 at -7.27e+06
assign (resid 597 and name   HA) (resid 598 and name   HN)  2.5  0.7  1.0 ! A.1027 at  3.86e+06
assign (resid 597 and name  HB1) (resid 599 and name   HN)  3.0  1.2  1.8 ! A.1043 at  1.31e+06
assign (resid 597 and name HE21) (resid 601 and name  HB1)  2.5  0.7  0.6 ! A.1023 at  1.27e+06
assign (resid 597 and name HE22) (resid 601 and name  HB1)  2.5  0.7  0.8 ! A.1024 at  1.20e+06
assign (resid 597 and name  HG1) (resid 601 and name HD1#)  3.0  1.2  1.8 ! A.1066 at -2.91e+06
assign (resid 597 and name  HG1) (resid 601 and name HD2#)  4.0  2.2  2.5 ! A.1072 at -1.66e+07
assign (resid 597 and name  HG1) (resid 602 and name   HN)  4.0  2.2  1.2 ! A.1086 at  9.86e+05

! N598
assign (resid 598 and name   HN) (resid 598 and name  HB1)  2.5  0.7  0.9 ! A.1032 at  9.13e+06
assign (resid 598 and name   HN) (resid 598 and name  HB2)  4.0  2.2  2.0 ! A.1033 at  1.12e+07
assign (resid 598 and name   HN) (resid 598 and name HD21)  2.5  0.7  0.4 ! A.1034 at  1.36e+06
assign (resid 598 and name   HN) (resid 598 and name HD22)  2.5  0.7  0.4 ! A.1035 at  1.49e+06
assign (resid 598 and name HD21) (resid 598 and name  HB1)  2.5  0.7  0.2 ! A.1038 at  3.41e+06
assign (resid 598 and name HD21) (resid 598 and name  HB2)  2.5  0.7  0.9 ! A.1040 at  3.02e+06
assign (resid 598 and name HD22) (resid 598 and name  HB1)  2.5  0.7  1.0 ! A.1039 at  3.05e+06
assign (resid 598 and name HD22) (resid 598 and name  HB2)  3.0  1.2  1.2 ! A.1041 at  3.14e+06
assign (resid 598 and name   HN) (resid 599 and name   HN)  2.5  0.7  0.4 ! A.1036 at  2.56e+06
assign (resid 598 and name  HB2) (resid 599 and name   HN)  2.5  0.7  0.4 ! A.1044 at  2.04e+06
assign (resid 598 and name   HN) (resid 601 and name  HB1)  3.0  1.2  1.5 ! A.1037 at  1.37e+06
assign (resid 598 and name   HN) (resid 601 and name HD2#)  2.5  0.7  1.3 ! A.1130 at  1.32e+06
assign (resid 598 and name HD21) (resid 601 and name HD2#)  3.0  1.2  0.8 ! A.1042 at  9.42e+05
assign (resid 598 and name   HA) (resid 601 and name HD2#)  2.5  0.7  0.7 ! A.1073 at -7.16e+06
assign (resid 598 and name   HA) (resid 602 and name   HN)  2.5  0.7  1.4 ! A.1087 at  1.05e+06

! C599
assign (resid 599 and name   HN) (resid 599 and name  HB1)  2.5  0.7  1.0 ! A.1047 at  1.05e+06
assign (resid 599 and name   HN) (resid 599 and name  HB2)  2.5  0.7  0.4 ! A.1048 at  2.92e+06
assign (resid 599 and name   HN) (resid 600 and name   HN)  2.5  0.7  0.4 ! A.1053 at  1.50e+06
assign (resid 599 and name   HA) (resid 600 and name   HN)  2.5  0.7  1.1 ! A.1051 at  1.44e+06
assign (resid 599 and name  HB2) (resid 600 and name   HN)  2.5  0.7  0.4 ! A.1052 at  2.19e+06
assign (resid 599 and name   HN) (resid 603 and name   HG)  4.0  2.2  2.0 ! A.1050 at  4.16e+05

! F600
assign (resid 600 and name   HN) (resid 600 and name  HB2)  2.5  0.7  0.4 ! A.1055 at  2.09e+06
assign (resid 600 and name   HN) (resid 601 and name   HN)  3.0  1.2  0.5 ! A.1057 at  8.72e+05
assign (resid 600 and name   HN) (resid 601 and name  HB1)  3.0  1.2  1.6 ! A.1056 at  1.55e+06
assign (resid 600 and name   HA) (resid 603 and name HD1#)  2.5  0.7  0.7 ! A.1097 at -2.84e+06
assign (resid 600 and name   HA) (resid 603 and name HD2#)  3.0  1.2  0.8 ! A.1198 at -8.78e+05

! L601
assign (resid 601 and name   HN) (resid 601 and name  HB1)  2.5  0.7  0.4 ! A.1081 at  2.86e+06
assign (resid 601 and name   HN) (resid 601 and name  HB2)  2.5  0.7  0.9 ! A.1082 at  1.73e+06
assign (resid 601 and name   HG) (resid 601 and name   HN)  2.5  0.7  1.0 ! A.1079 at -1.83e+06
assign (resid 601 and name HD1#) (resid 601 and name   HA)  4.0  2.2  2.5 ! A.1067 at -2.41e+07
assign (resid 601 and name HD1#) (resid 601 and name   HN)  3.0  1.2  1.2 ! A.1070 at -6.02e+06
assign (resid 601 and name HD1#) (resid 601 and name  HB1)  4.0  2.2  2.5 ! A.1068 at -2.01e+07
assign (resid 601 and name HD1#) (resid 601 and name  HB2)  2.5  0.7  0.7 ! A.1069 at -7.58e+06
assign (resid 601 and name HD2#) (resid 601 and name   HA)  3.0  1.2  1.1 ! A.1074 at -6.21e+06
assign (resid 601 and name HD2#) (resid 601 and name   HN)  2.5  0.7  1.5 ! A.1077 at -3.67e+06
assign (resid 601 and name HD2#) (resid 601 and name  HB1)  4.0  2.2  2.5 ! A.1075 at -2.56e+07
assign (resid 601 and name HD2#) (resid 601 and name  HB2)  4.0  2.2  2.5 ! A.1076 at -1.47e+07
assign (resid 601 and name   HN) (resid 602 and name   HN)  2.5  0.7  0.4 ! A.1089 at  2.59e+06
assign (resid 601 and name  HB1) (resid 602 and name   HN)  2.5  0.7  0.8 ! A.1064 at -1.10e+06
assign (resid 601 and name  HB2) (resid 602 and name   HN)  2.5  0.7  1.5 ! A.1065 at -1.37e+06
assign (resid 601 and name HD1#) (resid 602 and name   HN)  2.5  0.7  0.9 ! A.1071 at -2.59e+06
assign (resid 601 and name HD2#) (resid 602 and name   HN)  2.5  0.7  1.3 ! A.1078 at -3.35e+06
assign (resid 601 and name   HA) (resid 602 and name   HN)  2.5  0.7  1.1 ! A.1183 at  2.58e+06
assign (resid 601 and name   HG) (resid 602 and name   HN)  2.5  0.7  0.4 ! A.1185 at  4.81e+06
assign (resid 601 and name  HB1) (resid 602 and name   HA)  4.0  2.2  1.2 ! A.1084 at -9.07e+05
assign (resid 601 and name HD2#) (resid 605 and name  HB2)  3.0  1.2  1.5 ! A.1172 at -1.54e+06

! K602
assign (resid 602 and name   HN) (resid 602 and name  HB1)  2.5  0.7  1.1 ! A.1091 at  2.67e+06
assign (resid 602 and name   HN) (resid 602 and name  HB2)  2.5  0.7  1.1 ! A.1092 at  4.11e+06
assign (resid 602 and name   HN) (resid 602 and name  HD1)  3.0  1.2  1.7 ! A.1093 at  1.04e+06
assign (resid 602 and name   HN) (resid 602 and name  HG2)  3.0  1.2  1.5 ! A.1094 at  1.48e+06
assign (resid 602 and name  HE1) (resid 602 and name  HB2)  3.0  1.2  1.5 ! A.1180 at -9.16e+06
assign (resid 602 and name   HN) (resid 603 and name   HG)  2.5  0.7  1.2 ! A.1096 at  4.69e+06
assign (resid 602 and name   HN) (resid 603 and name HD1#)  4.0  2.2  1.0 ! A.1095 at  1.22e+06

! L603
assign (resid 603 and name HD1#) (resid 603 and name   HA)  2.5  0.7  1.3 ! A.1098 at -2.41e+06

! F604

! C605

!@ END_XPLR_NOE_FILE
# Restraints file 4: D_1000242893_mr_P2.xplor-nih.V1
!@ BEGIN_XPLR_PCK_SUM
! LBL   File-Name                             All  Intra   Seq.  Short   Long
! A   nc-noesy.PCK                           1273   366    396    202    309
!    Total                                   1273   366    396    202    309

!@ END_XPLR_PCK_SUM
!@ BEGIN_XPLR_NOE_FILE
! G-6

! A-5

! M-4

! D-3

! P-2

! E-1

! F0

! M1
assign (resid   1 and name   HA) (resid   1 and name  HG2)  2.5  0.7  0.2 ! A.2    at -4.52e+07
assign (resid   1 and name  HB1) (resid   2 and name   HN)  2.5  0.7  0.4 ! A.10   at  4.66e+07
assign (resid   1 and name  HB2) (resid   2 and name   HN)  3.0  1.2  0.5 ! A.11   at  2.59e+07
assign (resid   1 and name  HG1) (resid   2 and name   HN)  3.0  1.2  0.5 ! A.12   at  7.99e+06
assign (resid   1 and name  HG2) (resid   2 and name   HN)  3.0  1.2  0.5 ! A.13   at  1.01e+07
assign (resid   1 and name  HB1) (resid   3 and name   HN)  3.0  1.2  0.5 ! A.35   at  1.32e+07

! A2
assign (resid   2 and name   HN) (resid   2 and name  HB#)  2.5  0.7  0.9 ! A.15   at  2.21e+08
assign (resid   2 and name   HN) (resid   3 and name  HB2)  3.0  1.2  0.5 ! A.16   at  6.05e+06
assign (resid   2 and name   HA) (resid   3 and name   HN)  2.5  0.7  1.0 ! A.36   at  3.22e+08
assign (resid   2 and name  HB#) (resid   3 and name   HN)  2.5  0.7  0.9 ! A.37   at  7.74e+07
assign (resid   2 and name  HB#) (resid   4 and name   HN)  3.0  1.2  1.0 ! A.52   at  2.16e+07

! L3
assign (resid   3 and name   HN) (resid   3 and name  HB1)  2.5  0.7  1.2 ! A.39   at  2.68e+08
assign (resid   3 and name   HN) (resid   3 and name  HB2)  2.5  0.7  0.4 ! A.40   at  2.94e+08
assign (resid   3 and name   HN) (resid   3 and name HD1#)  2.5  0.7  0.9 ! A.41   at  5.18e+07
assign (resid   3 and name   HN) (resid   3 and name HD2#)  2.5  0.7  0.9 ! A.42   at  5.18e+07
assign (resid   3 and name   HA) (resid   3 and name   HG)  2.5  0.7  0.2 ! A.20   at -2.59e+08
assign (resid   3 and name   HA) (resid   3 and name HD1#)  2.5  0.7  1.3 ! A.18   at -1.92e+08
assign (resid   3 and name   HA) (resid   3 and name HD2#)  2.5  0.7  0.7 ! A.19   at -1.92e+08
assign (resid   3 and name  HB1) (resid   3 and name HD1#)  2.5  0.7  0.7 ! A.23   at -8.10e+07
assign (resid   3 and name  HB1) (resid   3 and name HD2#)  2.5  0.7  0.7 ! A.25   at -8.10e+07
assign (resid   3 and name  HB2) (resid   3 and name HD1#)  2.5  0.7  0.7 ! A.24   at -1.38e+08
assign (resid   3 and name  HB2) (resid   3 and name HD2#)  2.5  0.7  0.7 ! A.26   at -1.49e+08
assign (resid   3 and name   HG) (resid   3 and name   HN)  2.5  0.7  0.4 ! A.34   at -3.78e+07
assign (resid   3 and name   HN) (resid   4 and name  HB1)  3.0  1.2  1.2 ! A.43   at  1.14e+07
assign (resid   3 and name   HA) (resid   4 and name   HN)  2.5  0.7  1.0 ! A.53   at  1.69e+08
assign (resid   3 and name  HB1) (resid   4 and name   HN)  2.5  0.7  0.4 ! A.54   at  7.67e+07
assign (resid   3 and name  HB2) (resid   4 and name   HN)  2.5  0.7  0.4 ! A.55   at  7.25e+07
assign (resid   3 and name HD1#) (resid   4 and name   HN)  3.0  1.2  1.0 ! A.56   at  2.48e+07
assign (resid   3 and name HD2#) (resid   4 and name   HN)  3.0  1.2  1.0 ! A.57   at  2.48e+07
assign (resid   3 and name  HB1) (resid   4 and name   HA)  3.0  1.2  1.1 ! A.44   at -9.09e+06
assign (resid   3 and name  HB2) (resid   4 and name   HA)  3.0  1.2  1.0 ! A.45   at -9.09e+06
assign (resid   3 and name   HA) (resid   5 and name   HN)  3.0  1.2  0.5 ! A.70   at  1.90e+07
assign (resid   3 and name HD1#) (resid   5 and name   HN)  3.0  1.2  1.5 ! A.71   at  1.34e+07

! D4
assign (resid   4 and name   HN) (resid   4 and name  HB1)  2.5  0.7  0.4 ! A.59   at  1.30e+08
assign (resid   4 and name   HN) (resid   5 and name  HA1)  4.0  2.2  1.1 ! A.60   at  9.90e+06
assign (resid   4 and name   HA) (resid   5 and name   HN)  2.5  0.7  0.4 ! A.72   at  1.34e+08
assign (resid   4 and name  HB1) (resid   5 and name   HN)  2.5  0.7  1.2 ! A.73   at  5.56e+07
assign (resid   4 and name   HA) (resid   5 and name  HA1)  4.0  2.2  1.0 ! A.61   at -8.48e+06
assign (resid   4 and name  HB1) (resid   5 and name  HA1)  4.0  2.2  1.0 ! A.62   at -3.32e+06
assign (resid   4 and name   HA) (resid   6 and name   HN)  3.0  1.2  1.3 ! A.49   at -9.86e+06
assign (resid   4 and name   HA) (resid   6 and name HD1#)  3.0  1.2  0.8 ! A.48   at -1.04e+07
assign (resid   4 and name  HB1) (resid   6 and name   HN)  3.0  1.2  1.9 ! A.118  at  1.26e+07

! G5
assign (resid   5 and name   HN) (resid   6 and name   HB)  4.0  2.2  1.1 ! A.75   at  1.12e+07
assign (resid   5 and name   HN) (resid   6 and name   HN)  2.5  0.7  0.4 ! A.79   at  6.81e+07
assign (resid   5 and name   HN) (resid   6 and name HD1#)  3.0  1.2  1.0 ! A.76   at  1.34e+07
assign (resid   5 and name   HN) (resid   6 and name HG11)  3.0  1.2  1.5 ! A.77   at  2.56e+07
assign (resid   5 and name   HN) (resid   6 and name HG12)  3.0  1.2  0.5 ! A.78   at  4.87e+06
assign (resid   5 and name  HA1) (resid   6 and name   HB)  4.0  2.2  1.6 ! A.64   at -6.20e+06
assign (resid   5 and name  HA1) (resid   6 and name   HN)  2.5  0.7  0.4 ! A.69   at -5.00e+07
assign (resid   5 and name  HA1) (resid   6 and name HD1#)  3.0  1.2  0.8 ! A.65   at -1.03e+07
assign (resid   5 and name  HA1) (resid   6 and name HG11)  4.0  2.2  1.5 ! A.66   at -1.10e+07
assign (resid   5 and name  HA1) (resid   6 and name HG12)  3.0  1.2  1.0 ! A.67   at -4.36e+06
assign (resid   5 and name  HA1) (resid   6 and name HG2#)  3.0  1.2  1.3 ! A.68   at -1.03e+07

! I6
assign (resid   6 and name   HN) (resid   6 and name   HB)  2.5  0.7  1.0 ! A.122  at  1.83e+08
assign (resid   6 and name   HN) (resid   6 and name HD1#)  2.5  0.7  0.9 ! A.123  at  8.60e+07
assign (resid   6 and name   HN) (resid   6 and name HG11)  2.5  0.7  0.9 ! A.124  at  1.09e+08
assign (resid   6 and name   HN) (resid   6 and name HG12)  2.5  0.7  0.4 ! A.125  at  8.80e+07
assign (resid   6 and name   HN) (resid   6 and name HG2#)  2.5  0.7  0.9 ! A.126  at  8.60e+07
assign (resid   6 and name   HA) (resid   6 and name HD1#)  2.5  0.7  0.7 ! A.81   at -7.05e+07
assign (resid   6 and name   HA) (resid   6 and name HG11)  3.0  1.2  1.2 ! A.82   at -2.57e+07
assign (resid   6 and name   HA) (resid   6 and name HG12)  3.0  1.2  0.3 ! A.83   at -2.46e+07
assign (resid   6 and name   HA) (resid   6 and name HG2#)  2.5  0.7  0.7 ! A.84   at -7.05e+07
assign (resid   6 and name   HB) (resid   6 and name HD1#)  2.5  0.7  0.7 ! A.89   at -9.32e+07
assign (resid   6 and name   HN) (resid   7 and name   HN)  2.5  0.7  0.9 ! A.128  at  4.02e+07
assign (resid   6 and name   HN) (resid   7 and name  HD1)  4.0  2.2  1.2 ! A.127  at  8.35e+06
assign (resid   6 and name   HA) (resid   7 and name   HN)  2.5  0.7  1.0 ! A.87   at -9.97e+07
assign (resid   6 and name   HA) (resid   7 and name  HB1)  3.0  1.2  1.3 ! A.86   at -9.39e+06
assign (resid   6 and name   HB) (resid   7 and name   HN)  3.0  1.2  0.5 ! A.94   at -1.39e+07
assign (resid   6 and name HG11) (resid   7 and name   HN)  3.0  1.2  0.5 ! A.110  at -8.33e+06
assign (resid   6 and name HG12) (resid   7 and name   HN)  3.0  1.2  0.5 ! A.111  at -3.79e+06
assign (resid   6 and name HG2#) (resid   7 and name   HN)  2.5  0.7  0.9 ! A.116  at -3.57e+07
assign (resid   6 and name HG2#) (resid   8 and name   HN)  4.0  2.2  1.6 ! A.174  at  5.37e+06
assign (resid   6 and name HG11) (resid  11 and name   HN)  3.0  1.2  1.3 ! A.242  at  7.13e+06
assign (resid   6 and name HG12) (resid  11 and name   HN)  4.0  2.2  1.0 ! A.243  at  2.20e+06
assign (resid   6 and name HG11) (resid  11 and name  HA1)  4.0  2.2  1.0 ! A.228  at -2.87e+06
assign (resid   6 and name HG11) (resid  11 and name  HA2)  4.0  2.2  1.0 ! A.229  at -3.18e+06
assign (resid   6 and name HG11) (resid  12 and name   HN)  4.0  2.2  1.0 ! A.261  at  6.60e+06

! R7
assign (resid   7 and name   HN) (resid   7 and name  HB1)  2.5  0.7  0.9 ! A.154  at  5.36e+07
assign (resid   7 and name   HN) (resid   7 and name  HB2)  2.5  0.7  1.1 ! A.155  at  5.36e+07
assign (resid   7 and name   HN) (resid   7 and name  HD1)  3.0  1.2  0.5 ! A.156  at  5.49e+06
assign (resid   7 and name   HN) (resid   7 and name  HG1)  3.0  1.2  1.1 ! A.157  at  1.95e+07
assign (resid   7 and name   HA) (resid   7 and name  HD1)  3.0  1.2  0.8 ! A.129  at -1.55e+07
assign (resid   7 and name  HB1) (resid   7 and name  HD1)  3.0  1.2  0.3 ! A.132  at -2.33e+07
assign (resid   7 and name  HB2) (resid   7 and name  HD1)  3.0  1.2  0.3 ! A.133  at -1.68e+07
assign (resid   7 and name  HG1) (resid   7 and name   HA)  2.5  0.7  1.4 ! A.145  at -3.01e+07
assign (resid   7 and name   HN) (resid   8 and name  HB1)  4.0  2.2  1.5 ! A.158  at  3.71e+06
assign (resid   7 and name   HN) (resid   8 and name  HG2)  4.0  2.2  1.0 ! A.159  at  2.25e+06
assign (resid   7 and name  HB1) (resid   8 and name  HG2)  3.0  1.2  1.0 ! A.138  at -3.57e+06
assign (resid   7 and name  HB2) (resid   8 and name  HG2)  3.0  1.2  0.3 ! A.139  at -5.30e+06
assign (resid   7 and name  HB1) (resid   8 and name   HN)  2.5  0.7  0.9 ! A.175  at  3.80e+07
assign (resid   7 and name  HB2) (resid   8 and name   HN)  2.5  0.7  0.4 ! A.176  at  3.80e+07
assign (resid   7 and name  HD1) (resid   8 and name   HN)  3.0  1.2  1.0 ! A.177  at  1.02e+07
assign (resid   7 and name  HG1) (resid   8 and name   HN)  2.5  0.7  0.4 ! A.178  at  3.38e+07
assign (resid   7 and name  HG1) (resid   8 and name  HG1)  3.0  1.2  0.3 ! A.164  at -8.00e+06
assign (resid   7 and name  HB1) (resid  11 and name   HN)  3.0  1.2  1.9 ! A.244  at  6.48e+06
assign (resid   7 and name  HD1) (resid  11 and name  HA1)  3.0  1.2  1.5 ! A.231  at -4.19e+06
assign (resid   7 and name  HB1) (resid  11 and name  HA2)  4.0  2.2  1.8 ! A.230  at -2.69e+06

! M8
assign (resid   8 and name   HN) (resid   8 and name  HB1)  2.5  0.7  1.1 ! A.180  at  9.50e+07
assign (resid   8 and name   HN) (resid   8 and name  HG1)  3.0  1.2  0.5 ! A.181  at  2.37e+07
assign (resid   8 and name   HN) (resid   8 and name  HG2)  2.5  0.7  0.4 ! A.182  at  4.03e+07
assign (resid   8 and name   HA) (resid   8 and name  HG2)  3.0  1.2  0.3 ! A.161  at -5.42e+06
assign (resid   8 and name  HG1) (resid   8 and name   HA)  3.0  1.2  0.3 ! A.165  at -1.33e+07
assign (resid   8 and name   HN) (resid   9 and name  HD1)  3.0  1.2  0.5 ! A.183  at  1.12e+07
assign (resid   8 and name   HN) (resid   9 and name  HD2)  3.0  1.2  0.5 ! A.184  at  8.84e+06
assign (resid   8 and name  HG1) (resid   9 and name  HD1)  3.0  1.2  0.3 ! A.171  at -5.89e+06
assign (resid   8 and name  HG1) (resid   9 and name  HD2)  3.0  1.2  0.3 ! A.173  at -4.83e+06
assign (resid   8 and name  HG2) (resid   9 and name  HD1)  3.0  1.2  0.3 ! A.172  at -7.70e+06
assign (resid   8 and name   HN) (resid   9 and name  HB2)  4.0  2.2  1.2 ! A.191  at -7.43e+06
assign (resid   8 and name   HN) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.185  at  4.71e+06
assign (resid   8 and name  HG1) (resid  11 and name  HA1)  4.0  2.2  1.0 ! A.232  at -3.06e+06
assign (resid   8 and name   HN) (resid  12 and name   HN)  3.0  1.2  0.5 ! A.186  at  9.27e+06
assign (resid   8 and name  HG1) (resid  12 and name   HN)  3.0  1.2  1.5 ! A.262  at  1.04e+07
assign (resid   8 and name   HA) (resid  12 and name  HB1)  3.0  1.2  0.3 ! A.255  at -5.39e+06

! P9
assign (resid   9 and name   HA) (resid   9 and name  HD1)  3.0  1.2  0.3 ! A.189  at -8.85e+06
assign (resid   9 and name  HB2) (resid   9 and name  HD1)  3.0  1.2  0.3 ! A.195  at -2.04e+07
assign (resid   9 and name  HD2) (resid   9 and name   HA)  3.0  1.2  0.9 ! A.201  at -4.88e+06
assign (resid   9 and name  HG1) (resid   9 and name   HA)  2.5  0.7  0.2 ! A.206  at -3.50e+07
assign (resid   9 and name   HA) (resid  10 and name   HN)  2.5  0.7  0.9 ! A.190  at -4.19e+07
assign (resid   9 and name  HB2) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.196  at -8.11e+06
assign (resid   9 and name  HD1) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.204  at -5.71e+06
assign (resid   9 and name  HD2) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.205  at -3.46e+06
assign (resid   9 and name  HB1) (resid  10 and name   HN)  3.0  1.2  0.5 ! A.219  at  1.78e+07
assign (resid   9 and name  HG1) (resid  10 and name   HN)  2.5  0.7  1.5 ! A.223  at  4.36e+07
assign (resid   9 and name  HG1) (resid  11 and name   HN)  4.0  2.2  1.3 ! A.245  at  1.77e+07
!assign (resid   9 and name  HG1) (resid  11 and name  HA2)  4.0  2.2  2.4 ! A.233  at -2.19e+06
assign (resid   9 and name  HG1) (resid  12 and name   HN)  4.0  2.2  1.5 ! A.263  at  3.61e+07
assign (resid   9 and name  HG1) (resid  12 and name  HB1)  4.0  2.2  1.1 ! A.256  at -7.74e+06
assign (resid   9 and name  HG1) (resid  13 and name   HN)  4.0  2.2  1.0 ! A.275  at  2.71e+06

! D10
assign (resid  10 and name   HN) (resid  10 and name  HB1)  2.5  0.7  0.4 ! A.225  at  2.91e+07
assign (resid  10 and name   HN) (resid  10 and name  HB2)  2.5  0.7  0.4 ! A.226  at  4.25e+07
assign (resid  10 and name   HN) (resid  11 and name   HN)  2.5  0.7  0.4 ! A.227  at  2.82e+07
assign (resid  10 and name   HA) (resid  11 and name   HN)  2.5  0.7  0.9 ! A.214  at -4.26e+07
assign (resid  10 and name   HA) (resid  11 and name  HA2)  3.0  1.2  1.4 ! A.213  at -1.01e+07
assign (resid  10 and name  HB1) (resid  11 and name  HA1)  3.0  1.2  1.2 ! A.217  at -5.01e+06
assign (resid  10 and name  HB1) (resid  11 and name   HN)  3.0  1.2  0.5 ! A.247  at  2.14e+07
assign (resid  10 and name  HB2) (resid  11 and name   HN)  3.0  1.2  0.5 ! A.248  at  1.92e+07
assign (resid  10 and name   HA) (resid  11 and name  HA1)  4.0  2.2  1.2 ! A.234  at -4.66e+06
assign (resid  10 and name   HA) (resid  12 and name   HN)  3.0  1.2  1.1 ! A.264  at  1.81e+07

! G11
assign (resid  11 and name   HN) (resid  12 and name   HN)  2.5  0.7  0.4 ! A.252  at  3.27e+07
assign (resid  11 and name   HN) (resid  12 and name  HB1)  3.0  1.2  1.0 ! A.251  at  4.69e+06
assign (resid  11 and name  HA1) (resid  12 and name   HN)  2.5  0.7  0.4 ! A.265  at  3.07e+07
assign (resid  11 and name  HA2) (resid  12 and name   HN)  2.5  0.7  1.0 ! A.266  at  4.08e+07

! C12
assign (resid  12 and name   HN) (resid  12 and name  HB1)  2.5  0.7  0.4 ! A.269  at  9.99e+07
assign (resid  12 and name   HN) (resid  13 and name   HN)  3.0  1.2  0.5 ! A.270  at  2.02e+07
assign (resid  12 and name   HA) (resid  13 and name   HN)  3.0  1.2  0.5 ! A.254  at -2.78e+07
assign (resid  12 and name  HB1) (resid  13 and name   HN)  3.0  1.2  0.5 ! A.260  at -1.23e+07

! Y13
assign (resid  13 and name   HN) (resid  13 and name  HB1)  3.0  1.2  0.5 ! A.278  at  1.05e+07
assign (resid  13 and name   HN) (resid  13 and name  HB2)  2.5  0.7  0.4 ! A.279  at  4.19e+07
assign (resid  13 and name   HN) (resid  14 and name  HB#)  3.0  1.2  1.6 ! A.280  at  4.48e+06
assign (resid  13 and name   HA) (resid  14 and name   HN)  3.0  1.2  0.5 ! A.290  at  1.09e+07
assign (resid  13 and name  HB1) (resid  14 and name   HN)  3.0  1.2  0.5 ! A.291  at  9.07e+06
assign (resid  13 and name  HB2) (resid  14 and name   HN)  3.0  1.2  0.5 ! A.292  at  7.73e+06
assign (resid  13 and name  HB1) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.341  at  3.58e+06

! A14
assign (resid  14 and name   HN) (resid  14 and name  HB#)  3.0  1.2  1.0 ! A.294  at  2.74e+07
assign (resid  14 and name   HN) (resid  15 and name   HN)  3.0  1.2  0.5 ! A.296  at  4.49e+06
assign (resid  14 and name   HN) (resid  15 and name  HB2)  4.0  2.2  1.0 ! A.295  at  1.79e+06
assign (resid  14 and name   HA) (resid  15 and name   HN)  2.5  0.7  1.0 ! A.307  at  3.26e+07
assign (resid  14 and name  HB#) (resid  15 and name   HN)  2.5  0.7  0.9 ! A.288  at -3.06e+07
assign (resid  14 and name  HB#) (resid  15 and name  HB1)  3.0  1.2  1.3 ! A.286  at -2.02e+07
assign (resid  14 and name  HB#) (resid  15 and name  HB2)  3.0  1.2  0.8 ! A.287  at -1.33e+07
assign (resid  14 and name   HA) (resid  15 and name   HA)  3.0  1.2  1.4 ! A.297  at -8.31e+06
assign (resid  14 and name  HB#) (resid  16 and name   HN)  3.0  1.2  1.0 ! A.289  at -5.20e+06
assign (resid  14 and name   HN) (resid  16 and name   HN)  3.0  1.2  0.5 ! A.323  at  5.70e+06
assign (resid  14 and name  HB#) (resid  17 and name   HN)  4.0  2.2  1.5 ! A.342  at  2.58e+06

! D15
assign (resid  15 and name   HN) (resid  15 and name  HB1)  3.0  1.2  0.5 ! A.311  at  2.77e+07
assign (resid  15 and name   HN) (resid  15 and name  HB2)  3.0  1.2  0.5 ! A.312  at  2.21e+07
assign (resid  15 and name   HN) (resid  16 and name   HN)  2.5  0.7  0.4 ! A.327  at  3.49e+07
assign (resid  15 and name   HN) (resid  16 and name  HA2)  3.0  1.2  1.3 ! A.313  at  4.86e+06
assign (resid  15 and name   HA) (resid  16 and name   HN)  3.0  1.2  0.5 ! A.302  at -9.69e+06
assign (resid  15 and name   HA) (resid  16 and name  HA1)  3.0  1.2  1.9 ! A.301  at -8.31e+06
assign (resid  15 and name  HB1) (resid  16 and name   HN)  3.0  1.2  0.5 ! A.325  at  1.70e+07
assign (resid  15 and name  HB2) (resid  16 and name   HN)  3.0  1.2  1.3 ! A.326  at  9.57e+06
assign (resid  15 and name   HN) (resid  17 and name HG2#)  3.0  1.2  1.0 ! A.315  at  5.18e+06
assign (resid  15 and name   HA) (resid  17 and name   HN)  3.0  1.2  1.9 ! A.343  at  9.84e+06
assign (resid  15 and name  HB1) (resid  17 and name   HN)  3.0  1.2  1.3 ! A.344  at  8.91e+06

! G16
assign (resid  16 and name   HN) (resid  17 and name HG2#)  3.0  1.2  1.0 ! A.330  at  8.45e+06
assign (resid  16 and name  HA1) (resid  17 and name HG2#)  4.0  2.2  1.5 ! A.320  at -3.03e+06
assign (resid  16 and name   HN) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.347  at  1.87e+07
assign (resid  16 and name  HA1) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.345  at  1.40e+07
assign (resid  16 and name  HA2) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.346  at  1.43e+07
assign (resid  16 and name  HA1) (resid  18 and name   HN)  4.0  2.2  1.4 ! A.352  at  3.24e+06
assign (resid  16 and name  HA1) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.321  at -3.50e+06

! T17
assign (resid  17 and name   HN) (resid  17 and name   HB)  3.0  1.2  0.5 ! A.349  at  1.25e+07
assign (resid  17 and name   HN) (resid  17 and name HG2#)  3.0  1.2  1.0 ! A.350  at  2.50e+07
assign (resid  17 and name HG2#) (resid  17 and name   HA)  2.5  0.7  0.7 ! A.336  at -6.94e+07
assign (resid  17 and name   HN) (resid  18 and name   HN)  3.0  1.2  1.3 ! A.351  at  8.50e+06
assign (resid  17 and name   HB) (resid  18 and name   HN)  3.0  1.2  1.4 ! A.333  at -4.03e+06
assign (resid  17 and name HG2#) (resid  18 and name   HN)  3.0  1.2  1.0 ! A.339  at -3.85e+07
assign (resid  17 and name   HA) (resid  18 and name   HN)  3.0  1.2  0.5 ! A.353  at  2.45e+07
assign (resid  17 and name   HB) (resid  34 and name  HD1)  4.0  2.2  1.0 ! A.334  at -1.88e+06
assign (resid  17 and name   HB) (resid  34 and name  HG1)  4.0  2.2  1.0 ! A.335  at -2.66e+06
assign (resid  17 and name HG2#) (resid  34 and name  HG1)  3.0  1.2  0.8 ! A.340  at -2.22e+07
assign (resid  17 and name HG2#) (resid  34 and name  HD2)  3.0  1.2  0.8 ! A.718  at -3.97e+06
assign (resid  17 and name   HA) (resid  36 and name   HN)  3.0  1.2  1.8 ! A.806  at  6.56e+06
assign (resid  17 and name   HA) (resid  36 and name   HA)  4.0  2.2  1.0 ! A.789  at -2.76e+06
assign (resid  17 and name   HA) (resid  36 and name   HB)  3.0  1.2  1.3 ! A.794  at -4.60e+06
assign (resid  17 and name   HA) (resid  36 and name HG2#)  2.5  0.7  0.7 ! A.800  at -6.43e+07
assign (resid  17 and name   HN) (resid  36 and name HG2#)  4.0  2.2  1.5 ! A.801  at -2.98e+06

! W18
assign (resid  18 and name   HN) (resid  18 and name  HB1)  3.0  1.2  0.5 ! A.357  at  3.27e+06
assign (resid  18 and name   HN) (resid  18 and name  HB2)  3.0  1.2  0.5 ! A.358  at  3.71e+06
assign (resid  18 and name   HN) (resid  18 and name  HE1)  4.0  2.2  1.0 ! A.359  at  1.49e+06
assign (resid  18 and name   HN) (resid  19 and name   HN)  3.0  1.2  1.3 ! A.360  at  3.65e+06
assign (resid  18 and name   HA) (resid  19 and name   HN)  3.0  1.2  0.5 ! A.383  at  7.67e+06
assign (resid  18 and name  HB1) (resid  19 and name   HN)  3.0  1.2  1.0 ! A.384  at  4.57e+06
assign (resid  18 and name  HB2) (resid  19 and name   HN)  3.0  1.2  0.5 ! A.385  at  5.98e+06
assign (resid  18 and name  HE1) (resid  20 and name HD2#)  4.0  2.2  2.0 ! A.365  at  2.57e+06
assign (resid  18 and name   HN) (resid  34 and name  HG1)  3.0  1.2  1.6 ! A.361  at  4.33e+06
assign (resid  18 and name   HN) (resid  35 and name HG2#)  3.0  1.2  1.0 ! A.362  at  6.86e+06
assign (resid  18 and name  HE1) (resid  35 and name HG2#)  4.0  2.2  1.5 ! A.366  at  1.80e+06
assign (resid  18 and name   HN) (resid  36 and name HG2#)  3.0  1.2  1.0 ! A.363  at  1.19e+07
assign (resid  18 and name  HE1) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.367  at  4.06e+06
assign (resid  18 and name  HE1) (resid  36 and name   HN)  4.0  2.2  1.0 ! A.807  at  2.20e+06
assign (resid  18 and name  HE1) (resid  36 and name   HA)  4.0  2.2  1.0 ! A.790  at -2.49e+06
assign (resid  18 and name  HE1) (resid  37 and name   HN)  3.0  1.2  0.5 ! A.370  at  4.20e+06
assign (resid  18 and name  HE1) (resid  37 and name  HA1)  3.0  1.2  0.3 ! A.368  at  5.96e+06
assign (resid  18 and name  HE1) (resid  37 and name  HA2)  4.0  2.2  1.0 ! A.369  at  1.95e+06
assign (resid  18 and name  HE1) (resid  38 and name   HN)  4.0  2.2  1.0 ! A.845  at  1.96e+06
assign (resid  18 and name  HE1) (resid  85 and name  HG1)  4.0  2.2  1.0 ! A.371  at  2.27e+06
assign (resid  18 and name  HB1) (resid  86 and name   HN)  3.0  1.2  1.0 ! A.1757 at  3.27e+06
assign (resid  18 and name  HB2) (resid  86 and name   HN)  4.0  2.2  1.0 ! A.1758 at  3.10e+06
assign (resid  18 and name   HA) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1742 at -1.09e+07
assign (resid  18 and name  HB1) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1743 at -1.63e+07
assign (resid  18 and name  HB2) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1744 at -1.62e+07

! E19
assign (resid  19 and name   HN) (resid  19 and name  HB1)  3.0  1.2  0.5 ! A.387  at  5.95e+06
assign (resid  19 and name   HN) (resid  19 and name  HB2)  4.0  2.2  1.0 ! A.388  at  2.88e+06
assign (resid  19 and name   HN) (resid  19 and name  HG1)  4.0  2.2  1.0 ! A.389  at  2.23e+06
assign (resid  19 and name   HN) (resid  19 and name  HG2)  3.0  1.2  0.5 ! A.390  at  5.21e+06
assign (resid  19 and name  HG1) (resid  19 and name   HA)  3.0  1.2  0.3 ! A.373  at -5.67e+06
assign (resid  19 and name  HG1) (resid  32 and name HG2#)  3.0  1.2  0.8 ! A.379  at -6.93e+06
assign (resid  19 and name  HG2) (resid  32 and name HG2#)  2.5  0.7  0.7 ! A.671  at -4.80e+07
assign (resid  19 and name  HB2) (resid  32 and name   HB)  3.0  1.2  0.3 ! A.659  at -5.52e+06
assign (resid  19 and name  HG1) (resid  32 and name   HB)  3.0  1.2  1.3 ! A.660  at -3.27e+06
assign (resid  19 and name  HG2) (resid  32 and name   HB)  3.0  1.2  0.3 ! A.661  at -6.04e+06
assign (resid  19 and name  HB2) (resid  32 and name HG2#)  2.5  0.7  0.7 ! A.669  at -4.03e+07
assign (resid  19 and name  HB2) (resid  33 and name   HN)  4.0  2.2  1.0 ! A.709  at  2.83e+06
assign (resid  19 and name  HG1) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.381  at -4.05e+06
assign (resid  19 and name  HG1) (resid  34 and name  HG1)  4.0  2.2  1.0 ! A.382  at -1.77e+06
assign (resid  19 and name   HA) (resid  34 and name   HN)  3.0  1.2  0.5 ! A.733  at  8.10e+06
assign (resid  19 and name  HB1) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.734  at  2.55e+06
assign (resid  19 and name  HB2) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.735  at  2.24e+06
assign (resid  19 and name   HA) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.777  at  5.17e+06
assign (resid  19 and name  HB1) (resid  35 and name   HN)  4.0  2.2  1.0 ! A.778  at  2.79e+06
assign (resid  19 and name   HA) (resid  35 and name HG2#)  3.0  1.2  0.8 ! A.765  at -5.44e+06
assign (resid  19 and name   HN) (resid  86 and name  HB#)  3.0  1.2  1.0 ! A.391  at  5.23e+06

! L20
assign (resid  20 and name HD2#) (resid  20 and name   HA)  3.0  1.2  0.8 ! A.392  at -8.35e+06
assign (resid  20 and name HD2#) (resid  20 and name   HN)  3.0  1.2  1.0 ! A.396  at -3.29e+06
assign (resid  20 and name HD2#) (resid  20 and name  HB1)  3.0  1.2  0.8 ! A.393  at -1.58e+07
assign (resid  20 and name HD2#) (resid  21 and name   HN)  3.0  1.2  1.5 ! A.397  at -1.02e+07
assign (resid  20 and name   HA) (resid  21 and name   HN)  3.0  1.2  0.5 ! A.412  at  7.19e+06
assign (resid  20 and name   HG) (resid  21 and name   HN)  3.0  1.2  1.2 ! A.416  at  3.88e+06
assign (resid  20 and name  HB1) (resid  21 and name   HN)  4.0  2.2  1.0 ! A.413  at  2.00e+06
assign (resid  20 and name HD1#) (resid  21 and name   HN)  3.0  1.2  1.0 ! A.414  at  3.82e+06
assign (resid  20 and name HD1#) (resid  21 and name  HB1)  3.0  1.2  0.8 ! A.400  at -5.00e+06
assign (resid  20 and name HD2#) (resid  35 and name HG2#)  3.0  1.2  1.3 ! A.398  at -1.08e+07
assign (resid  20 and name  HB2) (resid  35 and name HG2#)  3.0  1.2  0.8 ! A.766  at -1.02e+07
assign (resid  20 and name HD1#) (resid  85 and name   HN)  3.0  1.2  1.0 ! A.1718 at  4.76e+06
assign (resid  20 and name HD2#) (resid  86 and name   HA)  3.0  1.2  0.8 ! A.399  at -6.81e+06
assign (resid  20 and name   HA) (resid  86 and name   HA)  4.0  2.2  1.0 ! A.1739 at -2.04e+06
assign (resid  20 and name   HA) (resid  86 and name  HB#)  4.0  2.2  2.5 ! A.1747 at  3.25e+05
assign (resid  20 and name HD2#) (resid  86 and name  HB#)  3.0  1.2  1.3 ! A.1748 at -8.58e+06
assign (resid  20 and name HD1#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1783 at  1.04e+07
assign (resid  20 and name HD2#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1784 at  9.54e+06
assign (resid  20 and name HD1#) (resid  88 and name  HB#)  2.5  0.7  1.2 ! A.1772 at -3.20e+07
assign (resid  20 and name   HG) (resid  90 and name   HN)  3.0  1.2  1.6 ! A.1844 at  8.07e+06
assign (resid  20 and name HD1#) (resid  90 and name   HN)  3.0  1.2  1.0 ! A.1843 at  3.85e+06
assign (resid  20 and name HD1#) (resid  90 and name HD1#)  3.0  1.2  1.3 ! A.1821 at -1.30e+07
assign (resid  20 and name HD1#) (resid  90 and name HD2#)  3.0  1.2  1.3 ! A.1829 at -5.00e+06

! S21
assign (resid  21 and name   HN) (resid  21 and name  HB1)  3.0  1.2  0.5 ! A.418  at  6.19e+06
assign (resid  21 and name  HB1) (resid  22 and name   HA)  3.0  1.2  1.1 ! A.403  at -3.95e+06
assign (resid  21 and name  HB1) (resid  22 and name   HN)  3.0  1.2  0.5 ! A.404  at -1.14e+07
assign (resid  21 and name   HA) (resid  22 and name HG2#)  3.0  1.2  0.8 ! A.436  at -1.14e+07
assign (resid  21 and name   HA) (resid  31 and name   HN)  4.0  2.2  1.0 ! A.635  at  2.04e+06
assign (resid  21 and name   HN) (resid  32 and name   HA)  4.0  2.2  1.0 ! A.419  at  1.81e+06
assign (resid  21 and name  HB1) (resid  32 and name   HA)  4.0  2.2  1.2 ! A.405  at -6.10e+06
assign (resid  21 and name  HB1) (resid  32 and name HG2#)  3.0  1.2  0.8 ! A.406  at -7.58e+06
assign (resid  21 and name   HA) (resid  32 and name   HA)  3.0  1.2  0.3 ! A.652  at -5.32e+06
assign (resid  21 and name   HA) (resid  32 and name HG2#)  2.5  0.7  0.7 ! A.672  at -3.27e+07
assign (resid  21 and name   HN) (resid  89 and name   HA)  3.0  1.2  0.5 ! A.420  at  6.07e+06
assign (resid  21 and name  HB1) (resid  89 and name  HB1)  3.0  1.2  0.3 ! A.407  at -5.22e+06
assign (resid  21 and name  HB1) (resid  89 and name  HD1)  2.5  0.7  0.2 ! A.1795 at -2.85e+07
assign (resid  21 and name  HB1) (resid  89 and name  HE1)  3.0  1.2  1.6 ! A.409  at -3.89e+06
assign (resid  21 and name  HB1) (resid  89 and name  HG2)  3.0  1.2  1.4 ! A.410  at -1.09e+07
assign (resid  21 and name  HB1) (resid  89 and name  HG1)  3.0  1.2  1.1 ! A.1801 at -6.55e+06
assign (resid  21 and name  HB1) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.411  at -4.77e+06

! V22
assign (resid  22 and name   HB) (resid  22 and name   HN)  4.0  2.2  1.0 ! A.423  at -2.71e+06
assign (resid  22 and name HG1#) (resid  22 and name   HA)  3.0  1.2  0.8 ! A.426  at -1.06e+07
assign (resid  22 and name HG1#) (resid  22 and name   HN)  3.0  1.2  1.0 ! A.428  at -1.36e+07
assign (resid  22 and name HG2#) (resid  22 and name   HA)  3.0  1.2  0.8 ! A.437  at -1.17e+07
assign (resid  22 and name HG2#) (resid  22 and name   HN)  3.0  1.2  1.0 ! A.440  at -1.07e+07
assign (resid  22 and name HG1#) (resid  23 and name   HN)  3.0  1.2  1.0 ! A.429  at -1.49e+07
assign (resid  22 and name   HA) (resid  23 and name   HN)  3.0  1.2  0.5 ! A.451  at  3.40e+06
assign (resid  22 and name   HB) (resid  23 and name   HN)  4.0  2.2  1.0 ! A.452  at  2.40e+06
assign (resid  22 and name HG2#) (resid  23 and name   HN)  3.0  1.2  1.0 ! A.453  at  7.93e+06
assign (resid  22 and name HG1#) (resid  24 and name HG2#)  3.0  1.2  1.3 ! A.465  at -1.54e+07
assign (resid  22 and name   HN) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.637  at  3.42e+06
assign (resid  22 and name HG2#) (resid  31 and name   HN)  3.0  1.2  1.6 ! A.636  at  3.30e+06
assign (resid  22 and name   HN) (resid  31 and name   HB)  4.0  2.2  1.0 ! A.613  at -2.89e+06
assign (resid  22 and name HG2#) (resid  32 and name   HA)  3.0  1.2  0.8 ! A.441  at -9.61e+06
assign (resid  22 and name   HN) (resid  32 and name   HA)  3.0  1.2  0.5 ! A.654  at -5.85e+06
assign (resid  22 and name   HN) (resid  32 and name   HB)  4.0  2.2  1.8 ! A.662  at -1.24e+07
assign (resid  22 and name   HN) (resid  32 and name HG2#)  2.5  0.7  0.9 ! A.673  at -2.99e+07
assign (resid  22 and name   HB) (resid  48 and name HD1#)  2.5  0.7  0.7 ! A.1025 at -2.87e+07
assign (resid  22 and name   HB) (resid  48 and name HD2#)  3.0  1.2  0.8 ! A.1033 at -5.26e+06
assign (resid  22 and name HG1#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.430  at -8.01e+06
assign (resid  22 and name HG1#) (resid  48 and name HD2#)  2.5  0.7  1.2 ! A.431  at -2.96e+07
assign (resid  22 and name HG2#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.442  at -1.26e+07
assign (resid  22 and name HG2#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.443  at -1.25e+07
assign (resid  22 and name HG2#) (resid  90 and name   HA)  3.0  1.2  1.5 ! A.444  at -9.61e+06
assign (resid  22 and name HG2#) (resid  90 and name   HN)  3.0  1.2  1.0 ! A.446  at -1.04e+07
assign (resid  22 and name HG2#) (resid  90 and name  HB2)  2.5  0.7  0.7 ! A.445  at -2.82e+07
assign (resid  22 and name   HA) (resid  90 and name   HN)  4.0  2.2  1.0 ! A.1846 at  2.67e+06
assign (resid  22 and name HG1#) (resid  91 and name   HA)  3.0  1.2  0.8 ! A.432  at -1.04e+07
assign (resid  22 and name HG2#) (resid  91 and name   HA)  3.0  1.2  0.8 ! A.447  at -3.77e+06
assign (resid  22 and name HG2#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.448  at -1.06e+07
assign (resid  22 and name HG1#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1878 at  1.39e+07
assign (resid  22 and name HG1#) (resid  92 and name   HN)  3.0  1.2  1.0 ! A.435  at -5.24e+06
assign (resid  22 and name HG1#) (resid  92 and name  HB1)  3.0  1.2  0.8 ! A.433  at -1.22e+07
assign (resid  22 and name HG1#) (resid  92 and name  HB2)  3.0  1.2  0.8 ! A.434  at -9.10e+06
assign (resid  22 and name HG2#) (resid  92 and name  HB1)  3.0  1.2  1.3 ! A.449  at -3.76e+06
assign (resid  22 and name HG2#) (resid  92 and name  HB2)  3.0  1.2  0.8 ! A.450  at -5.74e+06

! H23
assign (resid  23 and name   HN) (resid  23 and name  HB1)  3.0  1.2  0.5 ! A.454  at  3.61e+06
assign (resid  23 and name   HN) (resid  23 and name  HB2)  3.0  1.2  0.5 ! A.455  at  3.61e+06
assign (resid  23 and name   HN) (resid  24 and name   HN)  4.0  2.2  1.0 ! A.456  at  2.05e+06
assign (resid  23 and name  HB1) (resid  25 and name HG2#)  3.0  1.2  0.8 ! A.480  at -8.90e+06
assign (resid  23 and name   HA) (resid  29 and name   HN)  3.0  1.2  1.7 ! A.565  at  5.45e+06
assign (resid  23 and name   HA) (resid  30 and name   HN)  4.0  2.2  1.0 ! A.596  at  1.69e+06
assign (resid  23 and name   HA) (resid  31 and name   HN)  4.0  2.2  1.0 ! A.638  at  2.23e+06
assign (resid  23 and name  HB2) (resid  31 and name   HN)  4.0  2.2  1.7 ! A.639  at  1.72e+06
assign (resid  23 and name   HN) (resid  90 and name  HB2)  4.0  2.2  1.0 ! A.457  at  2.07e+06
assign (resid  23 and name   HN) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.458  at  1.75e+06
assign (resid  23 and name   HN) (resid  91 and name  HB2)  4.0  2.2  1.0 ! A.459  at  1.44e+06
assign (resid  23 and name   HN) (resid  91 and name  HG1)  4.0  2.2  1.0 ! A.460  at  1.67e+06
assign (resid  23 and name   HN) (resid  91 and name   HN)  4.0  2.2  1.0 ! A.1880 at  2.77e+06
assign (resid  23 and name  HB2) (resid  91 and name   HN)  4.0  2.2  1.0 ! A.1879 at  2.09e+06
assign (resid  23 and name  HB2) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.1856 at -1.81e+06
assign (resid  23 and name  HB2) (resid  91 and name  HG1)  3.0  1.2  0.3 ! A.1862 at -3.61e+06
assign (resid  23 and name  HB1) (resid  91 and name  HG2)  3.0  1.2  0.3 ! A.1861 at -3.71e+06
assign (resid  23 and name  HB2) (resid  91 and name  HG2)  3.0  1.2  0.3 ! A.1863 at -4.43e+06
assign (resid  23 and name  HB2) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1895 at  2.55e+06
assign (resid  23 and name   HN) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.461  at  1.60e+06
assign (resid  23 and name  HB1) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.1913 at  2.84e+06

! V24
assign (resid  24 and name   HN) (resid  24 and name   HB)  4.0  2.2  1.0 ! A.468  at  1.79e+06
assign (resid  24 and name   HN) (resid  24 and name HG1#)  4.0  2.2  1.5 ! A.469  at  2.15e+06
assign (resid  24 and name   HN) (resid  24 and name HG2#)  4.0  2.2  1.5 ! A.470  at  2.76e+06
assign (resid  24 and name HG2#) (resid  25 and name   HN)  3.0  1.2  1.0 ! A.490  at  5.73e+06
assign (resid  24 and name   HN) (resid  27 and name  HB1)  4.0  2.2  1.0 ! A.471  at  1.72e+06
assign (resid  24 and name HG1#) (resid  27 and name   HA)  3.0  1.2  1.3 ! A.498  at -1.28e+07
assign (resid  24 and name HG1#) (resid  27 and name HD1#)  2.5  0.7  1.2 ! A.504  at -3.05e+07
assign (resid  24 and name HG1#) (resid  28 and name   HN)  3.0  1.2  1.0 ! A.530  at  7.85e+06
assign (resid  24 and name   HN) (resid  29 and name   HA)  4.0  2.2  1.0 ! A.472  at  1.47e+06
assign (resid  24 and name   HB) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.566  at  1.25e+07
assign (resid  24 and name   HN) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.569  at  1.14e+07
assign (resid  24 and name HG1#) (resid  29 and name   HN)  3.0  1.2  1.1 ! A.567  at  2.94e+07
assign (resid  24 and name HG2#) (resid  29 and name   HN)  3.0  1.2  1.0 ! A.568  at  1.98e+07
assign (resid  24 and name   HN) (resid  30 and name   HN)  3.0  1.2  1.2 ! A.597  at  6.41e+06
assign (resid  24 and name   HN) (resid  30 and name   HA)  4.0  2.2  1.0 ! A.589  at -2.78e+06
assign (resid  24 and name   HN) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.642  at  9.91e+06
assign (resid  24 and name HG1#) (resid  31 and name   HN)  4.0  2.2  1.5 ! A.640  at  2.05e+06
assign (resid  24 and name HG2#) (resid  31 and name   HN)  4.0  2.2  1.5 ! A.641  at  2.10e+06
assign (resid  24 and name HG2#) (resid  31 and name   HB)  4.0  2.2  1.5 ! A.614  at -2.56e+06
assign (resid  24 and name HG2#) (resid  92 and name  HB2)  3.0  1.2  0.8 ! A.467  at -4.92e+06
assign (resid  24 and name HG1#) (resid  92 and name   HN)  3.0  1.2  1.0 ! A.1915 at  3.48e+06
assign (resid  24 and name HG2#) (resid  92 and name   HN)  4.0  2.2  1.5 ! A.1916 at  2.99e+06

! T25
assign (resid  25 and name   HN) (resid  25 and name   HB)  3.0  1.2  0.5 ! A.492  at  4.52e+06
assign (resid  25 and name   HN) (resid  25 and name HG2#)  3.0  1.2  1.0 ! A.493  at  2.67e+07
assign (resid  25 and name   HA) (resid  25 and name HG2#)  3.0  1.2  0.8 ! A.474  at -1.12e+07
assign (resid  25 and name   HN) (resid  27 and name   HN)  4.0  2.2  1.0 ! A.494  at  3.13e+06
assign (resid  25 and name   HA) (resid  27 and name   HN)  3.0  1.2  0.5 ! A.476  at -6.56e+06
assign (resid  25 and name   HN) (resid  28 and name   HN)  3.0  1.2  1.1 ! A.531  at  4.55e+06
assign (resid  25 and name   HA) (resid  29 and name   HN)  3.0  1.2  1.3 ! A.570  at  4.35e+06
assign (resid  25 and name   HN) (resid  91 and name  HB2)  4.0  2.2  1.0 ! A.495  at  3.07e+06
assign (resid  25 and name HG2#) (resid  91 and name   HA)  3.0  1.2  0.8 ! A.484  at -6.91e+06
assign (resid  25 and name HG2#) (resid  91 and name  HB2)  3.0  1.2  0.8 ! A.485  at -1.46e+07
assign (resid  25 and name HG2#) (resid  91 and name  HG1)  3.0  1.2  0.8 ! A.487  at -1.45e+07
assign (resid  25 and name HG2#) (resid  91 and name  HG2)  3.0  1.2  0.8 ! A.488  at -9.76e+06
assign (resid  25 and name HG2#) (resid  91 and name HE22)  2.5  0.7  0.7 ! A.486  at -3.45e+07
assign (resid  25 and name HG2#) (resid  91 and name HE21)  3.0  1.2  0.8 ! A.1896 at  4.73e+06
assign (resid  25 and name   HN) (resid  92 and name   HA)  4.0  2.2  1.0 ! A.496  at  2.14e+06
assign (resid  25 and name   HN) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.497  at  2.07e+06
assign (resid  25 and name HG2#) (resid  92 and name   HN)  3.0  1.2  1.0 ! A.489  at -8.73e+06
assign (resid  25 and name   HB) (resid  93 and name   HB)  4.0  2.2  1.0 ! A.1924 at -1.44e+06
assign (resid  25 and name HG2#) (resid  93 and name   HB)  3.0  1.2  0.8 ! A.1925 at -5.55e+06

! D26

! L27
assign (resid  27 and name   HA) (resid  27 and name   HG)  3.0  1.2  0.3 ! A.501  at -1.22e+07
assign (resid  27 and name   HA) (resid  27 and name HD2#)  3.0  1.2  0.8 ! A.500  at -1.52e+07
assign (resid  27 and name  HB1) (resid  27 and name HD2#)  3.0  1.2  0.8 ! A.503  at -3.21e+06
assign (resid  27 and name HD1#) (resid  27 and name   HA)  3.0  1.2  0.8 ! A.505  at -1.40e+07
assign (resid  27 and name HD1#) (resid  27 and name  HB1)  2.5  0.7  0.7 ! A.506  at -2.95e+07
assign (resid  27 and name   HA) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.532  at  8.07e+06
assign (resid  27 and name   HN) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.536  at  1.45e+07
assign (resid  27 and name  HB1) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.533  at  8.81e+06
assign (resid  27 and name  HB2) (resid  28 and name   HN)  3.0  1.2  0.5 ! A.534  at  7.85e+06
assign (resid  27 and name HD2#) (resid  28 and name   HN)  3.0  1.2  1.0 ! A.535  at  4.83e+06
assign (resid  27 and name  HB1) (resid  28 and name  HB1)  4.0  2.2  1.0 ! A.517  at -2.81e+06
assign (resid  27 and name HD1#) (resid  29 and name  HD1)  3.0  1.2  0.8 ! A.507  at -8.87e+06
assign (resid  27 and name   HA) (resid  29 and name   HN)  3.0  1.2  1.3 ! A.571  at  7.19e+06
assign (resid  27 and name  HB1) (resid  29 and name   HN)  2.5  0.7  0.4 ! A.572  at  3.27e+07
assign (resid  27 and name  HB2) (resid  29 and name   HN)  2.5  0.7  0.4 ! A.573  at  2.94e+07
assign (resid  27 and name HD1#) (resid  29 and name   HN)  3.0  1.2  1.0 ! A.574  at  1.69e+07
assign (resid  27 and name HD2#) (resid  29 and name   HN)  3.0  1.2  1.0 ! A.575  at  1.82e+07
assign (resid  27 and name HD2#) (resid  29 and name  HD1)  3.0  1.2  0.8 ! A.556  at -9.15e+06
assign (resid  27 and name HD1#) (resid  52 and name HD1#)  3.0  1.2  1.3 ! A.508  at -1.81e+07
assign (resid  27 and name HD2#) (resid  52 and name HD1#)  3.0  1.2  1.3 ! A.1096 at -2.55e+07
assign (resid  27 and name HD1#) (resid  56 and name  HE2)  3.0  1.2  0.8 ! A.510  at -9.16e+06
assign (resid  27 and name HD2#) (resid  56 and name  HE1)  3.0  1.2  0.8 ! A.513  at -1.98e+07

! N28
assign (resid  28 and name   HN) (resid  28 and name  HB1)  3.0  1.2  0.5 ! A.538  at  6.42e+06
assign (resid  28 and name   HN) (resid  28 and name  HB2)  3.0  1.2  0.5 ! A.539  at  8.52e+06
assign (resid  28 and name  HB1) (resid  28 and name HD21)  3.0  1.2  0.3 ! A.522  at -9.66e+06
assign (resid  28 and name  HB1) (resid  28 and name HD22)  3.0  1.2  0.8 ! A.524  at -1.04e+07
assign (resid  28 and name  HB2) (resid  28 and name HD21)  3.0  1.2  0.3 ! A.523  at -7.94e+06
assign (resid  28 and name  HB2) (resid  28 and name HD22)  3.0  1.2  1.1 ! A.525  at -7.91e+06
assign (resid  28 and name HD21) (resid  28 and name   HA)  3.0  1.2  0.3 ! A.542  at  3.56e+06
assign (resid  28 and name HD22) (resid  28 and name   HA)  3.0  1.2  0.3 ! A.543  at  4.37e+06
assign (resid  28 and name   HN) (resid  29 and name   HA)  3.0  1.2  1.5 ! A.540  at  1.44e+07
assign (resid  28 and name   HN) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.541  at  1.75e+07
assign (resid  28 and name   HA) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.516  at -6.57e+06
assign (resid  28 and name  HB1) (resid  29 and name   HA)  4.0  2.2  1.0 ! A.528  at -2.21e+06
assign (resid  28 and name  HB2) (resid  29 and name   HA)  4.0  2.2  1.6 ! A.529  at -2.90e+06
assign (resid  28 and name HD21) (resid  29 and name   HA)  3.0  1.2  0.8 ! A.550  at  8.08e+06
assign (resid  28 and name HD22) (resid  29 and name   HA)  3.0  1.2  1.9 ! A.551  at  7.24e+06
assign (resid  28 and name  HB1) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.577  at  1.10e+07
assign (resid  28 and name  HB2) (resid  29 and name   HN)  3.0  1.2  1.4 ! A.578  at  1.68e+07
assign (resid  28 and name HD21) (resid  29 and name   HN)  4.0  2.2  1.0 ! A.579  at  2.86e+06

! R29
assign (resid  29 and name   HN) (resid  29 and name  HB1)  2.5  0.7  1.2 ! A.582  at  3.93e+07
assign (resid  29 and name   HN) (resid  29 and name  HB2)  2.5  0.7  0.4 ! A.583  at  3.93e+07
assign (resid  29 and name   HN) (resid  29 and name  HD1)  3.0  1.2  0.5 ! A.584  at  7.89e+06
assign (resid  29 and name   HN) (resid  29 and name  HG2)  2.5  0.7  1.1 ! A.585  at  3.69e+07
assign (resid  29 and name  HB1) (resid  29 and name  HD1)  4.0  2.2  1.0 ! A.553  at -2.38e+06
assign (resid  29 and name  HD1) (resid  29 and name   HA)  3.0  1.2  1.4 ! A.557  at -2.71e+07
assign (resid  29 and name  HG1) (resid  29 and name   HA)  3.0  1.2  0.3 ! A.560  at -1.04e+07
assign (resid  29 and name  HG1) (resid  29 and name   HN)  3.0  1.2  0.5 ! A.563  at -6.62e+06
assign (resid  29 and name  HG2) (resid  29 and name   HA)  3.0  1.2  0.3 ! A.561  at -1.38e+07
assign (resid  29 and name   HN) (resid  30 and name   HA)  4.0  2.2  1.0 ! A.586  at  3.05e+06
assign (resid  29 and name   HN) (resid  30 and name   HN)  3.0  1.2  1.3 ! A.587  at  1.18e+07
assign (resid  29 and name   HA) (resid  30 and name   HN)  2.5  0.7  0.4 ! A.598  at  3.01e+07
assign (resid  29 and name  HB1) (resid  30 and name   HN)  3.0  1.2  0.5 ! A.599  at  2.01e+07
assign (resid  29 and name  HD1) (resid  30 and name   HN)  3.0  1.2  1.8 ! A.600  at  6.03e+06
assign (resid  29 and name  HG1) (resid  30 and name   HN)  3.0  1.2  1.1 ! A.601  at  2.06e+07
assign (resid  29 and name  HG2) (resid  30 and name   HN)  3.0  1.2  1.0 ! A.602  at  1.54e+07
assign (resid  29 and name   HA) (resid  30 and name   HA)  4.0  2.2  1.0 ! A.590  at -1.50e+06
assign (resid  29 and name   HN) (resid  31 and name HG2#)  3.0  1.2  1.7 ! A.588  at  7.32e+06
assign (resid  29 and name  HB2) (resid  31 and name HG2#)  3.0  1.2  0.8 ! A.555  at -7.35e+06
assign (resid  29 and name  HD1) (resid  31 and name HG2#)  3.0  1.2  0.8 ! A.559  at -7.01e+06

! D30
assign (resid  30 and name   HN) (resid  30 and name  HB1)  3.0  1.2  0.5 ! A.605  at  2.77e+07
assign (resid  30 and name   HN) (resid  31 and name   HA)  4.0  2.2  1.0 ! A.606  at  2.87e+06
assign (resid  30 and name   HN) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.608  at  6.93e+06
assign (resid  30 and name   HN) (resid  31 and name HG2#)  3.0  1.2  1.0 ! A.607  at  6.94e+06
assign (resid  30 and name   HA) (resid  31 and name   HA)  4.0  2.2  1.0 ! A.593  at -1.98e+06
assign (resid  30 and name   HA) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.643  at  7.41e+06
assign (resid  30 and name  HB1) (resid  31 and name   HA)  4.0  2.2  1.0 ! A.595  at -3.07e+06
assign (resid  30 and name  HB1) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.644  at  5.32e+06
assign (resid  30 and name   HA) (resid  31 and name   HB)  4.0  2.2  1.0 ! A.615  at -2.41e+06
assign (resid  30 and name  HB1) (resid  31 and name   HB)  4.0  2.2  1.9 ! A.616  at -1.98e+06
assign (resid  30 and name   HA) (resid  31 and name HG1#)  4.0  2.2  1.3 ! A.625  at -6.67e+06

! V31
assign (resid  31 and name   HN) (resid  31 and name   HB)  3.0  1.2  0.5 ! A.647  at  6.02e+06
assign (resid  31 and name   HN) (resid  31 and name HG1#)  3.0  1.2  1.0 ! A.648  at  8.64e+06
assign (resid  31 and name   HA) (resid  31 and name HG1#)  3.0  1.2  0.8 ! A.610  at -1.19e+07
assign (resid  31 and name   HA) (resid  31 and name HG2#)  3.0  1.2  0.8 ! A.611  at -1.08e+07
assign (resid  31 and name   HN) (resid  32 and name   HA)  4.0  2.2  1.0 ! A.649  at  1.99e+06
assign (resid  31 and name   HN) (resid  32 and name   HN)  4.0  2.2  1.0 ! A.650  at  1.89e+06
assign (resid  31 and name   HA) (resid  32 and name   HN)  3.0  1.2  0.5 ! A.612  at -1.00e+07
assign (resid  31 and name   HB) (resid  32 and name   HA)  4.0  2.2  1.0 ! A.620  at -2.54e+06
assign (resid  31 and name   HB) (resid  32 and name   HN)  3.0  1.2  0.5 ! A.680  at  8.83e+06
assign (resid  31 and name HG1#) (resid  32 and name   HN)  3.0  1.2  1.0 ! A.629  at -5.82e+06
assign (resid  31 and name HG2#) (resid  32 and name   HN)  3.0  1.2  1.0 ! A.633  at -1.47e+07
assign (resid  31 and name   HA) (resid  32 and name   HB)  4.0  2.2  1.0 ! A.663  at -8.56e+06
assign (resid  31 and name HG1#) (resid  32 and name   HB)  3.0  1.2  1.5 ! A.664  at -7.78e+06
assign (resid  31 and name   HN) (resid  48 and name HD1#)  4.0  2.2  1.5 ! A.651  at  1.90e+06
assign (resid  31 and name   HB) (resid  48 and name   HG)  4.0  2.2  1.0 ! A.624  at -2.56e+06
assign (resid  31 and name   HB) (resid  48 and name HD1#)  2.5  0.7  0.7 ! A.1026 at -2.87e+07
assign (resid  31 and name   HB) (resid  48 and name HD2#)  3.0  1.2  0.8 ! A.1035 at -5.26e+06
assign (resid  31 and name HG1#) (resid  48 and name   HG)  3.0  1.2  1.3 ! A.632  at -2.32e+07
assign (resid  31 and name HG1#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.630  at -1.86e+07
assign (resid  31 and name HG1#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.631  at -5.19e+06
assign (resid  31 and name HG2#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.634  at -1.14e+07

! T32
assign (resid  32 and name   HN) (resid  32 and name   HB)  3.0  1.2  0.5 ! A.683  at  6.46e+06
assign (resid  32 and name   HN) (resid  32 and name HG2#)  3.0  1.2  1.0 ! A.684  at  4.13e+06
assign (resid  32 and name   HA) (resid  32 and name HG2#)  3.0  1.2  0.8 ! A.656  at -4.89e+06
assign (resid  32 and name   HA) (resid  33 and name   HN)  3.0  1.2  0.5 ! A.658  at -6.09e+06
assign (resid  32 and name   HA) (resid  33 and name  HB1)  4.0  2.2  1.5 ! A.657  at -2.59e+06
assign (resid  32 and name   HB) (resid  33 and name   HN)  3.0  1.2  0.5 ! A.668  at -1.25e+07
assign (resid  32 and name HG2#) (resid  33 and name   HN)  2.5  0.7  0.9 ! A.678  at -5.08e+07
assign (resid  32 and name HG2#) (resid  33 and name HD2#)  3.0  1.2  1.3 ! A.677  at -2.14e+07
assign (resid  32 and name   HN) (resid  33 and name   HN)  4.0  2.2  1.0 ! A.712  at  2.21e+06

! L33
assign (resid  33 and name   HN) (resid  33 and name  HB1)  3.0  1.2  0.5 ! A.714  at  7.11e+06
assign (resid  33 and name   HN) (resid  33 and name  HB2)  3.0  1.2  0.5 ! A.715  at  5.85e+06
assign (resid  33 and name   HN) (resid  33 and name HD1#)  3.0  1.2  1.0 ! A.716  at  8.80e+06
assign (resid  33 and name   HN) (resid  33 and name HD2#)  3.0  1.2  1.0 ! A.717  at  8.80e+06
assign (resid  33 and name HD1#) (resid  33 and name   HA)  3.0  1.2  0.8 ! A.689  at -9.58e+06
assign (resid  33 and name HD2#) (resid  33 and name   HA)  2.5  0.7  0.7 ! A.701  at -4.49e+07
assign (resid  33 and name HD2#) (resid  33 and name  HB1)  2.5  0.7  0.7 ! A.702  at -9.79e+07
assign (resid  33 and name HD2#) (resid  33 and name  HB2)  2.5  0.7  0.7 ! A.703  at -3.89e+07
assign (resid  33 and name HD1#) (resid  34 and name   HN)  3.0  1.2  1.0 ! A.691  at -5.22e+06
assign (resid  33 and name HD2#) (resid  34 and name   HN)  3.0  1.2  1.0 ! A.705  at -1.33e+07
assign (resid  33 and name   HA) (resid  34 and name   HN)  2.5  0.7  0.4 ! A.736  at  2.94e+07
assign (resid  33 and name   HN) (resid  34 and name   HN)  3.0  1.2  1.1 ! A.739  at  4.30e+06
assign (resid  33 and name  HB2) (resid  34 and name   HN)  3.0  1.2  1.4 ! A.737  at  1.00e+07
assign (resid  33 and name HD1#) (resid  44 and name   HA)  3.0  1.2  0.8 ! A.692  at -5.31e+06
assign (resid  33 and name  HB1) (resid  44 and name   HA)  4.0  2.2  1.0 ! A.974  at -2.93e+06
assign (resid  33 and name HD1#) (resid  47 and name  HB1)  3.0  1.2  0.8 ! A.693  at -2.28e+07
assign (resid  33 and name HD1#) (resid  47 and name  HB2)  3.0  1.2  0.8 ! A.694  at -2.28e+07
assign (resid  33 and name HD1#) (resid  48 and name   HA)  3.0  1.2  0.8 ! A.695  at -7.66e+06
assign (resid  33 and name HD1#) (resid  48 and name   HN)  3.0  1.2  1.0 ! A.698  at -6.03e+06
assign (resid  33 and name HD1#) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.696  at -6.19e+06
assign (resid  33 and name HD1#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.697  at -5.76e+06
assign (resid  33 and name HD2#) (resid  48 and name   HA)  3.0  1.2  0.8 ! A.706  at -2.31e+07
assign (resid  33 and name HD2#) (resid  48 and name   HN)  3.0  1.2  1.0 ! A.707  at -8.26e+06
assign (resid  33 and name HD1#) (resid  48 and name  HB1)  4.0  2.2  1.5 ! A.1022 at -2.20e+06
assign (resid  33 and name HD2#) (resid  48 and name  HB1)  4.0  2.2  1.5 ! A.1023 at -3.05e+06
assign (resid  33 and name HD2#) (resid  48 and name HD2#)  3.0  1.2  1.3 ! A.1036 at -1.53e+07
assign (resid  33 and name HD1#) (resid  51 and name  HD1)  3.0  1.2  0.8 ! A.699  at -2.61e+07
assign (resid  33 and name HD1#) (resid  51 and name  HE1)  3.0  1.2  0.8 ! A.700  at -5.84e+06
assign (resid  33 and name HD2#) (resid  51 and name  HE1)  3.0  1.2  0.8 ! A.708  at -2.05e+07
assign (resid  33 and name HD2#) (resid  51 and name  HD1)  3.0  1.2  0.8 ! A.1071 at -2.59e+07
assign (resid  33 and name HD1#) (resid  51 and name  HD2)  3.0  1.2  0.8 ! A.1070 at -4.77e+06
assign (resid  33 and name HD1#) (resid  51 and name  HG1)  3.0  1.2  0.8 ! A.1076 at -2.45e+07

! R34
assign (resid  34 and name   HN) (resid  34 and name  HB1)  2.5  0.7  0.4 ! A.741  at  2.82e+07
assign (resid  34 and name   HN) (resid  34 and name  HD1)  4.0  2.2  1.0 ! A.742  at  3.06e+06
assign (resid  34 and name   HN) (resid  34 and name  HD2)  3.0  1.2  1.7 ! A.743  at  4.07e+06
assign (resid  34 and name   HN) (resid  34 and name  HG1)  3.0  1.2  1.4 ! A.744  at  2.99e+07
assign (resid  34 and name  HD1) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.719  at -1.26e+07
assign (resid  34 and name  HD1) (resid  34 and name  HB1)  3.0  1.2  0.3 ! A.721  at -1.13e+07
assign (resid  34 and name  HD2) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.720  at -1.43e+07
assign (resid  34 and name  HD2) (resid  34 and name  HB1)  3.0  1.2  0.9 ! A.722  at -9.64e+06
assign (resid  34 and name  HG2) (resid  34 and name   HA)  3.0  1.2  0.3 ! A.727  at -8.62e+06
assign (resid  34 and name  HG2) (resid  34 and name   HN)  3.0  1.2  1.3 ! A.732  at -3.95e+06
assign (resid  34 and name   HN) (resid  35 and name   HN)  3.0  1.2  1.3 ! A.747  at  4.79e+06
assign (resid  34 and name   HN) (resid  35 and name HG1#)  3.0  1.2  1.0 ! A.745  at  4.74e+06
assign (resid  34 and name   HN) (resid  35 and name HG2#)  4.0  2.2  1.5 ! A.746  at  3.08e+06
assign (resid  34 and name   HA) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.779  at  1.52e+07
assign (resid  34 and name  HD1) (resid  35 and name   HN)  4.0  2.2  1.0 ! A.780  at  3.53e+06
assign (resid  34 and name  HG1) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.781  at  7.39e+06
assign (resid  34 and name   HA) (resid  35 and name HG1#)  3.0  1.2  0.8 ! A.756  at -1.06e+07

! V35
assign (resid  35 and name   HN) (resid  35 and name   HB)  3.0  1.2  0.5 ! A.784  at  9.48e+06
assign (resid  35 and name   HN) (resid  35 and name HG1#)  3.0  1.2  1.0 ! A.785  at  8.72e+06
assign (resid  35 and name   HN) (resid  35 and name HG2#)  3.0  1.2  1.0 ! A.786  at  1.45e+07
assign (resid  35 and name   HA) (resid  35 and name HG1#)  3.0  1.2  0.8 ! A.749  at -8.73e+06
assign (resid  35 and name   HA) (resid  35 and name HG2#)  3.0  1.2  0.8 ! A.750  at -5.42e+06
assign (resid  35 and name   HN) (resid  36 and name   HN)  4.0  2.2  1.0 ! A.787  at  2.75e+06
assign (resid  35 and name   HA) (resid  36 and name   HN)  3.0  1.2  0.5 ! A.752  at -5.32e+06
assign (resid  35 and name   HA) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.751  at -9.49e+06
assign (resid  35 and name   HB) (resid  36 and name   HN)  3.0  1.2  0.5 ! A.809  at  1.52e+07
assign (resid  35 and name HG1#) (resid  36 and name   HN)  3.0  1.2  1.0 ! A.762  at -1.21e+07
assign (resid  35 and name HG2#) (resid  36 and name   HA)  4.0  2.2  1.5 ! A.772  at -2.45e+06
assign (resid  35 and name HG2#) (resid  36 and name   HN)  3.0  1.2  1.0 ! A.773  at -7.19e+06
assign (resid  35 and name HG2#) (resid  37 and name   HN)  4.0  2.2  1.5 ! A.826  at  1.58e+06
assign (resid  35 and name   HB) (resid  38 and name   HN)  4.0  2.2  1.0 ! A.846  at  2.12e+06
assign (resid  35 and name   HN) (resid  39 and name HG1#)  3.0  1.2  1.9 ! A.788  at  7.06e+06
assign (resid  35 and name   HA) (resid  39 and name HG1#)  2.5  0.7  0.7 ! A.872  at -2.86e+07
assign (resid  35 and name HG1#) (resid  39 and name   HB)  3.0  1.2  0.8 ! A.763  at -1.22e+07
assign (resid  35 and name HG2#) (resid  39 and name HG1#)  3.0  1.2  1.3 ! A.774  at -1.23e+07
assign (resid  35 and name   HB) (resid  39 and name   HN)  3.0  1.2  1.1 ! A.895  at  6.39e+06
assign (resid  35 and name HG1#) (resid  39 and name   HN)  3.0  1.2  1.8 ! A.896  at  3.59e+06
assign (resid  35 and name HG2#) (resid  39 and name   HN)  4.0  2.2  1.5 ! A.897  at  3.00e+06
assign (resid  35 and name   HB) (resid  39 and name HG1#)  3.0  1.2  0.8 ! A.873  at -2.77e+07
assign (resid  35 and name HG1#) (resid  39 and name HG1#)  3.0  1.2  1.3 ! A.874  at -2.68e+07
assign (resid  35 and name HG1#) (resid  39 and name HG2#)  3.0  1.2  1.3 ! A.886  at -2.39e+07
assign (resid  35 and name HG2#) (resid  39 and name HG2#)  3.0  1.2  1.3 ! A.887  at -4.90e+06
assign (resid  35 and name HG1#) (resid  47 and name  HE1)  3.0  1.2  0.8 ! A.764  at -4.05e+06
assign (resid  35 and name HG2#) (resid  47 and name  HE1)  4.0  2.2  1.5 ! A.775  at -2.20e+06
assign (resid  35 and name HG2#) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.776  at -2.70e+07
assign (resid  35 and name HG2#) (resid  84 and name HG2#)  4.0  2.2  2.0 ! A.1691 at -2.33e+06

! T36
assign (resid  36 and name   HN) (resid  36 and name   HB)  3.0  1.2  0.5 ! A.814  at  1.49e+07
assign (resid  36 and name   HN) (resid  36 and name HG2#)  2.5  0.7  0.9 ! A.815  at  3.09e+07
assign (resid  36 and name   HA) (resid  36 and name HG2#)  3.0  1.2  0.8 ! A.792  at -7.18e+06
assign (resid  36 and name   HN) (resid  37 and name   HN)  4.0  2.2  1.0 ! A.816  at  2.97e+06
assign (resid  36 and name   HA) (resid  37 and name   HN)  3.0  1.2  0.5 ! A.793  at -4.85e+06
assign (resid  36 and name   HB) (resid  37 and name   HN)  3.0  1.2  1.2 ! A.798  at -4.47e+06
assign (resid  36 and name HG2#) (resid  37 and name   HN)  3.0  1.2  1.0 ! A.804  at -1.66e+07
assign (resid  36 and name   HN) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.847  at  3.23e+06
assign (resid  36 and name   HB) (resid  38 and name   HN)  4.0  2.2  1.0 ! A.799  at -2.11e+06
assign (resid  36 and name HG2#) (resid  38 and name   HN)  3.0  1.2  1.5 ! A.805  at -7.28e+06
assign (resid  36 and name   HN) (resid  39 and name   HA)  4.0  2.2  1.0 ! A.818  at  3.02e+06
assign (resid  36 and name   HN) (resid  39 and name   HB)  3.0  1.2  1.1 ! A.819  at  5.77e+06
assign (resid  36 and name   HN) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.820  at  4.34e+06
assign (resid  36 and name   HN) (resid  39 and name HG1#)  2.5  0.7  0.9 ! A.876  at -3.89e+07
assign (resid  36 and name   HN) (resid  39 and name HG2#)  3.0  1.2  1.5 ! A.888  at -1.03e+07
assign (resid  36 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.8 ! A.821  at  1.08e+07
assign (resid  36 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.822  at  9.78e+06

! G37
assign (resid  37 and name   HN) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.833  at  5.17e+06
assign (resid  37 and name   HN) (resid  38 and name  HB1)  4.0  2.2  1.0 ! A.832  at  2.01e+06
assign (resid  37 and name  HA1) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.848  at  1.89e+07
assign (resid  37 and name  HA2) (resid  38 and name   HN)  3.0  1.2  0.5 ! A.849  at  5.39e+06
assign (resid  37 and name   HN) (resid  39 and name   HN)  3.0  1.2  1.5 ! A.900  at  3.64e+06
assign (resid  37 and name   HN) (resid  39 and name HG1#)  3.0  1.2  1.5 ! A.834  at  8.43e+06
assign (resid  37 and name  HA2) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.899  at  4.66e+06
assign (resid  37 and name  HA2) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1503 at -5.35e+06
assign (resid  37 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.836  at  3.22e+06
assign (resid  37 and name  HA1) (resid  79 and name HD2#)  3.0  1.2  0.8 ! A.1546 at -4.36e+06
assign (resid  37 and name  HA2) (resid  79 and name HD2#)  3.0  1.2  0.8 ! A.1547 at -5.00e+06
assign (resid  37 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.5 ! A.1567 at  1.67e+06
assign (resid  37 and name  HA1) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1565 at  1.12e+07
assign (resid  37 and name  HA2) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1566 at  5.11e+06

! E38
assign (resid  38 and name   HN) (resid  38 and name  HB1)  3.0  1.2  0.5 ! A.852  at  1.62e+07
assign (resid  38 and name   HN) (resid  38 and name  HB2)  3.0  1.2  0.5 ! A.853  at  2.68e+07
assign (resid  38 and name   HN) (resid  38 and name  HG1)  2.5  0.7  0.4 ! A.854  at  2.84e+07
assign (resid  38 and name  HG1) (resid  38 and name   HA)  3.0  1.2  0.3 ! A.841  at -2.78e+07
assign (resid  38 and name   HN) (resid  39 and name   HA)  3.0  1.2  1.2 ! A.855  at  4.00e+06
assign (resid  38 and name   HN) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.857  at  1.53e+07
assign (resid  38 and name   HN) (resid  39 and name HG1#)  3.0  1.2  1.0 ! A.856  at  1.53e+07
assign (resid  38 and name  HG1) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.844  at -5.65e+06
assign (resid  38 and name   HA) (resid  39 and name   HN)  3.0  1.2  0.5 ! A.901  at  1.07e+07
assign (resid  38 and name  HB1) (resid  39 and name   HN)  3.0  1.2  1.0 ! A.902  at  1.03e+07
assign (resid  38 and name  HB2) (resid  39 and name   HN)  3.0  1.2  1.3 ! A.903  at  1.12e+07
assign (resid  38 and name   HA) (resid  39 and name   HA)  4.0  2.2  1.0 ! A.863  at -3.06e+06
assign (resid  38 and name  HG1) (resid  39 and name HG1#)  3.0  1.2  0.8 ! A.878  at -8.51e+06
assign (resid  38 and name   HN) (resid  78 and name   HB)  3.0  1.2  1.4 ! A.858  at  4.04e+06
assign (resid  38 and name   HN) (resid  78 and name HG2#)  3.0  1.2  1.0 ! A.859  at  4.53e+06
assign (resid  38 and name   HA) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1504 at -1.35e+07
assign (resid  38 and name  HB1) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1505 at -6.35e+06
assign (resid  38 and name  HG1) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1506 at -6.08e+06
assign (resid  38 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.0 ! A.860  at  6.25e+06
assign (resid  38 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.861  at  7.59e+06
assign (resid  38 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.0 ! A.862  at  2.12e+06
assign (resid  38 and name   HA) (resid  80 and name   HN)  3.0  1.2  1.7 ! A.1568 at  1.12e+07

! V39
assign (resid  39 and name   HN) (resid  39 and name   HB)  3.0  1.2  0.5 ! A.907  at  2.34e+07
assign (resid  39 and name   HN) (resid  39 and name HG1#)  2.5  0.7  0.9 ! A.908  at  4.83e+07
assign (resid  39 and name   HN) (resid  39 and name HG2#)  2.5  0.7  0.9 ! A.909  at  4.83e+07
assign (resid  39 and name   HA) (resid  39 and name HG1#)  3.0  1.2  0.8 ! A.864  at -1.42e+07
assign (resid  39 and name   HA) (resid  39 and name HG2#)  3.0  1.2  0.8 ! A.865  at -1.42e+07
assign (resid  39 and name   HN) (resid  40 and name   HN)  3.0  1.2  1.5 ! A.910  at  5.83e+06
assign (resid  39 and name   HA) (resid  40 and name   HN)  3.0  1.2  0.5 ! A.867  at -6.10e+06
assign (resid  39 and name HG1#) (resid  40 and name   HN)  3.0  1.2  1.0 ! A.883  at -1.53e+07
assign (resid  39 and name HG2#) (resid  40 and name   HN)  3.0  1.2  1.0 ! A.892  at -1.41e+07
assign (resid  39 and name   HB) (resid  40 and name   HN)  3.0  1.2  0.5 ! A.917  at  3.22e+06
assign (resid  39 and name HG1#) (resid  44 and name HG2#)  3.0  1.2  1.3 ! A.884  at -2.68e+07
assign (resid  39 and name HG2#) (resid  44 and name   HB)  3.0  1.2  0.8 ! A.893  at -8.53e+06
assign (resid  39 and name HG2#) (resid  44 and name HG2#)  3.0  1.2  1.3 ! A.894  at -2.39e+07
assign (resid  39 and name HG2#) (resid  44 and name   HN)  3.0  1.2  1.0 ! A.990  at  1.00e+07
assign (resid  39 and name HG1#) (resid  47 and name  HE1)  3.0  1.2  0.8 ! A.885  at -7.51e+06
assign (resid  39 and name   HN) (resid  78 and name   HB)  4.0  2.2  1.0 ! A.911  at  2.72e+06
assign (resid  39 and name   HA) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1507 at -8.32e+06
assign (resid  39 and name   HN) (resid  78 and name HG2#)  3.0  1.2  1.0 ! A.1508 at -9.39e+06
assign (resid  39 and name   HN) (resid  79 and name   HN)  4.0  2.2  1.0 ! A.914  at  2.84e+06
assign (resid  39 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.0 ! A.912  at  1.26e+07
assign (resid  39 and name   HN) (resid  79 and name HD2#)  3.0  1.2  1.0 ! A.913  at  1.26e+07
assign (resid  39 and name   HA) (resid  79 and name HD1#)  4.0  2.2  1.5 ! A.868  at -2.91e+06
assign (resid  39 and name   HB) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.1548 at -9.40e+06
assign (resid  39 and name HG1#) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.1549 at -1.13e+07
assign (resid  39 and name HG2#) (resid  79 and name HD2#)  3.0  1.2  1.3 ! A.1550 at -1.15e+07
assign (resid  39 and name   HN) (resid  80 and name   HN)  4.0  2.2  1.0 ! A.915  at  2.19e+06

! H40
assign (resid  40 and name   HN) (resid  40 and name  HB1)  4.0  2.2  1.0 ! A.921  at  1.59e+06
assign (resid  40 and name  HB1) (resid  41 and name   HN)  4.0  2.2  1.0 ! A.955  at  2.92e+06
assign (resid  40 and name  HB1) (resid  42 and name   HN)  4.0  2.2  1.0 ! A.961  at  2.30e+06
assign (resid  40 and name   HN) (resid  43 and name  HA1)  3.0  1.2  0.5 ! A.922  at  6.37e+06
assign (resid  40 and name   HA) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1509 at -7.04e+06
assign (resid  40 and name   HN) (resid  78 and name HG2#)  4.0  2.2  1.5 ! A.1511 at -2.95e+06
assign (resid  40 and name  HB1) (resid  78 and name HG2#)  3.0  1.2  0.8 ! A.1510 at -5.07e+06

! I41
assign (resid  41 and name   HN) (resid  41 and name   HB)  4.0  2.2  1.0 ! A.956  at  2.32e+06
assign (resid  41 and name   HN) (resid  41 and name HD1#)  3.0  1.2  1.0 ! A.957  at  3.73e+06
assign (resid  41 and name   HN) (resid  41 and name HG11)  4.0  2.2  1.0 ! A.958  at  2.02e+06
assign (resid  41 and name   HN) (resid  41 and name HG2#)  3.0  1.2  1.0 ! A.959  at  3.71e+06
assign (resid  41 and name   HA) (resid  41 and name HD1#)  3.0  1.2  0.8 ! A.923  at -4.50e+06
assign (resid  41 and name   HA) (resid  41 and name HG11)  4.0  2.2  1.0 ! A.924  at -2.02e+06
assign (resid  41 and name   HA) (resid  41 and name HG12)  4.0  2.2  1.0 ! A.925  at -2.02e+06
assign (resid  41 and name   HA) (resid  41 and name HG2#)  3.0  1.2  0.8 ! A.926  at -7.77e+06
assign (resid  41 and name HD1#) (resid  41 and name   HB)  3.0  1.2  0.8 ! A.930  at -1.41e+07
assign (resid  41 and name HG2#) (resid  42 and name   HN)  3.0  1.2  1.0 ! A.945  at -4.07e+06
assign (resid  41 and name   HA) (resid  42 and name   HN)  4.0  2.2  1.0 ! A.962  at  2.69e+06
assign (resid  41 and name   HN) (resid  42 and name   HN)  4.0  2.2  1.0 ! A.965  at  1.59e+06
assign (resid  41 and name HD1#) (resid  42 and name   HN)  3.0  1.2  1.0 ! A.963  at  3.37e+06
assign (resid  41 and name HD1#) (resid  43 and name   HN)  4.0  2.2  1.6 ! A.933  at -1.11e+07
assign (resid  41 and name HG2#) (resid  43 and name   HN)  3.0  1.2  1.0 ! A.946  at -1.17e+07
assign (resid  41 and name   HA) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.991  at  7.74e+06
assign (resid  41 and name HG2#) (resid  44 and name   HN)  3.0  1.2  1.0 ! A.947  at -7.31e+06
assign (resid  41 and name   HA) (resid  44 and name HG2#)  3.0  1.2  0.8 ! A.983  at -6.58e+06
assign (resid  41 and name HG2#) (resid  45 and name  HG1)  3.0  1.2  0.8 ! A.948  at -9.92e+06
assign (resid  41 and name HG11) (resid  45 and name  HE#)  4.0  2.2  2.1 ! A.1001 at -5.61e+07
assign (resid  41 and name HD1#) (resid  72 and name   HG)  3.0  1.2  1.3 ! A.936  at -1.67e+07
assign (resid  41 and name HD1#) (resid  72 and name HD1#)  2.5  0.7  1.2 ! A.1403 at -3.65e+07
assign (resid  41 and name HD1#) (resid  72 and name HD2#)  3.0  1.2  1.3 ! A.935  at -5.72e+06
assign (resid  41 and name HG2#) (resid  72 and name   HG)  3.0  1.2  1.4 ! A.951  at -1.61e+07
assign (resid  41 and name HG2#) (resid  72 and name   HN)  4.0  2.2  1.5 ! A.952  at -3.11e+06
assign (resid  41 and name HG2#) (resid  72 and name HD1#)  2.5  0.7  1.2 ! A.949  at -2.84e+07
assign (resid  41 and name HG2#) (resid  72 and name HD2#)  3.0  1.2  1.3 ! A.950  at -2.72e+07
assign (resid  41 and name HD1#) (resid  73 and name   HN)  3.0  1.2  1.0 ! A.937  at -6.56e+06
assign (resid  41 and name HG2#) (resid  73 and name   HN)  3.0  1.2  1.0 ! A.953  at -1.24e+07
assign (resid  41 and name HG2#) (resid  74 and name   HN)  3.0  1.2  1.0 ! A.954  at -7.71e+06
assign (resid  41 and name   HN) (resid  75 and name   HA)  4.0  2.2  1.0 ! A.960  at  1.81e+06
assign (resid  41 and name HD1#) (resid  75 and name   HA)  3.0  1.2  0.8 ! A.938  at -2.01e+07
assign (resid  41 and name HG12) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1676 at -5.28e+06

! G42
assign (resid  42 and name   HN) (resid  43 and name  HA1)  3.0  1.2  1.8 ! A.968  at  5.43e+06
assign (resid  42 and name   HN) (resid  44 and name   HB)  4.0  2.2  1.0 ! A.969  at  2.55e+06
assign (resid  42 and name   HN) (resid  44 and name   HN)  4.0  2.2  1.0 ! A.970  at  1.90e+06
assign (resid  42 and name   HN) (resid  45 and name  HE#)  3.0  1.2  1.0 ! A.1003 at -9.07e+06
assign (resid  42 and name  HA2) (resid  45 and name  HE#)  2.5  0.7  0.7 ! A.1002 at -3.85e+07
assign (resid  42 and name   HN) (resid  75 and name   HA)  3.0  1.2  0.5 ! A.971  at  5.43e+06
assign (resid  42 and name   HN) (resid  75 and name   HB)  4.0  2.2  1.0 ! A.972  at  1.81e+06
assign (resid  42 and name   HN) (resid  75 and name HG2#)  3.0  1.2  1.0 ! A.973  at  3.21e+06
assign (resid  42 and name  HA1) (resid  75 and name HG2#)  3.0  1.2  0.8 ! A.1487 at -5.81e+06
assign (resid  42 and name  HA2) (resid  75 and name HG2#)  3.0  1.2  0.8 ! A.1488 at -6.57e+06

! G43
assign (resid  43 and name   HN) (resid  44 and name   HN)  4.0  2.2  1.0 ! A.994  at  1.63e+06
assign (resid  43 and name  HA1) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.992  at  5.99e+06
assign (resid  43 and name  HA2) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.993  at  7.74e+06
assign (resid  43 and name   HN) (resid  44 and name HG2#)  3.0  1.2  1.0 ! A.984  at -4.12e+06

! V44
assign (resid  44 and name   HN) (resid  44 and name   HB)  3.0  1.2  0.5 ! A.996  at  9.28e+06
assign (resid  44 and name   HN) (resid  44 and name HG1#)  3.0  1.2  1.0 ! A.997  at  1.78e+07
assign (resid  44 and name   HN) (resid  44 and name HG2#)  3.0  1.2  1.0 ! A.998  at  1.06e+07
assign (resid  44 and name   HA) (resid  44 and name HG1#)  3.0  1.2  0.8 ! A.976  at -6.11e+06
assign (resid  44 and name   HA) (resid  44 and name HG2#)  3.0  1.2  0.8 ! A.977  at -7.27e+06
assign (resid  44 and name   HN) (resid  46 and name   HN)  3.0  1.2  0.5 ! A.1000 at  4.98e+06
assign (resid  44 and name   HN) (resid  46 and name  HB2)  3.0  1.2  1.6 ! A.999  at  4.32e+06
assign (resid  44 and name HG1#) (resid  46 and name   HN)  4.0  2.2  1.5 ! A.1010 at  2.00e+06
assign (resid  44 and name   HA) (resid  47 and name  HB2)  3.0  1.2  0.3 ! A.979  at -4.54e+06
assign (resid  44 and name   HA) (resid  47 and name  HG1)  3.0  1.2  0.3 ! A.980  at -3.96e+06
assign (resid  44 and name HG2#) (resid  48 and name HD2#)  3.0  1.2  1.8 ! A.989  at -6.86e+06

! M45
assign (resid  45 and name  HE#) (resid  45 and name   HN)  3.0  1.2  1.0 ! A.1005 at -6.83e+06
assign (resid  45 and name  HE#) (resid  45 and name  HG1)  2.5  0.7  0.7 ! A.1004 at -2.94e+07
assign (resid  45 and name  HE#) (resid  46 and name   HN)  3.0  1.2  1.0 ! A.1006 at -3.48e+07
assign (resid  45 and name  HB1) (resid  46 and name   HN)  4.0  2.2  1.0 ! A.1011 at  1.88e+06
assign (resid  45 and name  HE#) (resid  62 and name  HB#)  3.0  1.2  1.3 ! A.1120 at -6.31e+06
assign (resid  45 and name  HE#) (resid  63 and name   HN)  4.0  2.2  1.1 ! A.1008 at -1.53e+07
assign (resid  45 and name  HE#) (resid  63 and name HD2#)  2.5  0.7  1.2 ! A.1007 at -8.76e+07
assign (resid  45 and name  HE#) (resid  75 and name HG2#)  2.5  0.7  1.2 ! A.1009 at -7.68e+07

! L46
assign (resid  46 and name   HN) (resid  46 and name HD1#)  4.0  2.2  1.5 ! A.1012 at  1.80e+06
assign (resid  46 and name   HN) (resid  46 and name HD2#)  4.0  2.2  1.5 ! A.1013 at  2.00e+06
assign (resid  46 and name HD2#) (resid  50 and name  HG1)  3.0  1.2  0.8 ! A.1057 at -3.74e+06
assign (resid  46 and name   HA) (resid  50 and name  HG2)  3.0  1.2  0.3 ! A.1056 at -5.22e+06
assign (resid  46 and name HD2#) (resid  50 and name  HG2)  3.0  1.2  0.8 ! A.1058 at -7.63e+06

! K47
assign (resid  47 and name   HN) (resid  48 and name   HN)  3.0  1.2  0.5 ! A.1045 at  4.59e+06
assign (resid  47 and name  HG1) (resid  48 and name   HN)  3.0  1.2  0.5 ! A.1044 at  4.19e+06
assign (resid  47 and name   HA) (resid  50 and name  HG2)  3.0  1.2  0.3 ! A.1059 at -5.22e+06

! L48
assign (resid  48 and name   HN) (resid  48 and name  HB1)  3.0  1.2  0.5 ! A.1047 at  5.28e+06
assign (resid  48 and name   HN) (resid  48 and name HD2#)  4.0  2.2  1.5 ! A.1048 at  1.83e+06
assign (resid  48 and name   HA) (resid  48 and name HD1#)  3.0  1.2  0.8 ! A.1017 at -3.66e+06
assign (resid  48 and name HD1#) (resid  48 and name   HN)  3.0  1.2  1.0 ! A.1030 at -5.06e+06
assign (resid  48 and name   HN) (resid  49 and name   HN)  3.0  1.2  0.5 ! A.1049 at  3.42e+06
assign (resid  48 and name HD1#) (resid  49 and name   HN)  3.0  1.2  1.0 ! A.1031 at -5.13e+06
assign (resid  48 and name HD2#) (resid  49 and name   HN)  4.0  2.2  1.5 ! A.1040 at -2.16e+06
assign (resid  48 and name HD2#) (resid  49 and name HG2#)  3.0  1.2  1.3 ! A.1039 at -1.39e+07
assign (resid  48 and name   HA) (resid  50 and name   HN)  4.0  2.2  1.0 ! A.1019 at -2.58e+06
assign (resid  48 and name   HA) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.1020 at -2.63e+06
assign (resid  48 and name   HA) (resid  51 and name  HG1)  3.0  1.2  0.3 ! A.1077 at -4.71e+06
assign (resid  48 and name   HA) (resid  52 and name   HN)  4.0  2.2  1.0 ! A.1021 at -2.63e+06
assign (resid  48 and name HD1#) (resid  92 and name  HB1)  3.0  1.2  0.8 ! A.1032 at -3.57e+06
assign (resid  48 and name HD2#) (resid  92 and name   HA)  4.0  2.2  1.5 ! A.1041 at -1.79e+06
assign (resid  48 and name HD2#) (resid  92 and name  HB1)  4.0  2.2  1.5 ! A.1042 at -1.55e+06
assign (resid  48 and name HD2#) (resid  92 and name  HB2)  4.0  2.2  1.5 ! A.1043 at -1.54e+06

! V49
assign (resid  49 and name HG2#) (resid  49 and name   HA)  3.0  1.2  0.8 ! A.1050 at -1.65e+07
assign (resid  49 and name HG2#) (resid  50 and name   HN)  3.0  1.2  1.0 ! A.1051 at -1.05e+07
assign (resid  49 and name   HB) (resid  51 and name   HN)  3.0  1.2  1.4 ! A.1087 at  5.32e+06
assign (resid  49 and name HG2#) (resid  51 and name   HN)  4.0  2.2  1.5 ! A.1088 at  2.76e+06

! E50
assign (resid  50 and name   HA) (resid  50 and name  HG1)  4.0  2.2  1.0 ! A.1053 at -2.71e+06
assign (resid  50 and name  HG2) (resid  50 and name   HA)  3.0  1.2  0.3 ! A.1061 at -1.48e+07
assign (resid  50 and name  HB1) (resid  51 and name   HN)  3.0  1.2  0.5 ! A.1055 at -7.81e+06
assign (resid  50 and name  HG1) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.1065 at -2.22e+06
assign (resid  50 and name  HG2) (resid  51 and name   HN)  3.0  1.2  1.1 ! A.1066 at -6.81e+06
assign (resid  50 and name   HA) (resid  51 and name   HN)  3.0  1.2  0.5 ! A.1089 at  3.61e+06
assign (resid  50 and name  HB2) (resid  51 and name   HN)  3.0  1.2  0.5 ! A.1090 at  5.32e+06
assign (resid  50 and name  HB1) (resid  51 and name  HG1)  3.0  1.2  0.9 ! A.1078 at -8.59e+06

! K51
assign (resid  51 and name   HN) (resid  51 and name  HB1)  3.0  1.2  0.5 ! A.1092 at  8.89e+06
assign (resid  51 and name   HN) (resid  51 and name  HD1)  3.0  1.2  1.4 ! A.1093 at  4.52e+06
assign (resid  51 and name   HN) (resid  51 and name  HE1)  4.0  2.2  1.0 ! A.1094 at  2.55e+06
assign (resid  51 and name   HN) (resid  51 and name  HG1)  3.0  1.2  0.5 ! A.1095 at  4.70e+06
assign (resid  51 and name  HD1) (resid  51 and name   HA)  3.0  1.2  1.1 ! A.1072 at -2.26e+07
assign (resid  51 and name  HD2) (resid  51 and name   HA)  3.0  1.2  1.2 ! A.1073 at -3.47e+06
assign (resid  51 and name  HD2) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.1075 at -2.44e+06
assign (resid  51 and name  HG1) (resid  51 and name   HA)  2.5  0.7  0.2 ! A.1079 at -3.18e+07
assign (resid  51 and name  HG1) (resid  51 and name  HE1)  2.5  0.7  0.2 ! A.1083 at -4.00e+07
assign (resid  51 and name  HG2) (resid  51 and name   HA)  3.0  1.2  0.3 ! A.1080 at -5.26e+06
assign (resid  51 and name  HG2) (resid  51 and name  HE1)  3.0  1.2  0.3 ! A.1084 at -6.59e+06

! L52

! D53
assign (resid  53 and name  HB1) (resid  53 and name   HN)  3.0  1.2  0.5 ! A.1099 at -4.10e+06
assign (resid  53 and name   HA) (resid  54 and name   HN)  2.5  0.7  0.4 ! A.1104 at  3.16e+07
assign (resid  53 and name  HB2) (resid  54 and name   HN)  3.0  1.2  1.4 ! A.1105 at  1.04e+07
assign (resid  53 and name   HA) (resid  54 and name HG1#)  3.0  1.2  0.8 ! A.1100 at -1.67e+07

! V54
assign (resid  54 and name   HN) (resid  54 and name   HB)  3.0  1.2  0.5 ! A.1106 at  8.52e+06
assign (resid  54 and name HG1#) (resid  54 and name   HA)  3.0  1.2  0.8 ! A.1101 at -2.39e+07
assign (resid  54 and name HG1#) (resid  54 and name   HN)  3.0  1.2  1.0 ! A.1102 at -1.54e+07
assign (resid  54 and name HG1#) (resid  56 and name   HN)  3.0  1.2  1.0 ! A.1103 at -8.48e+06

! K55
assign (resid  55 and name  HD1) (resid  55 and name   HA)  3.0  1.2  0.3 ! A.1107 at -1.62e+07
assign (resid  55 and name  HG1) (resid  55 and name   HA)  3.0  1.2  0.3 ! A.1108 at -1.88e+07
assign (resid  55 and name  HG1) (resid  55 and name  HE1)  2.5  0.7  0.2 ! A.1110 at -4.43e+07
assign (resid  55 and name  HG2) (resid  55 and name   HA)  3.0  1.2  0.3 ! A.1109 at -1.63e+07

! K56
assign (resid  56 and name   HA) (resid  57 and name   HN)  3.0  1.2  0.5 ! A.1107 at  1.38e+07
assign (resid  56 and name   HN) (resid  57 and name   HN)  3.0  1.2  1.2 ! A.1110 at  5.52e+06
assign (resid  56 and name  HB1) (resid  57 and name   HN)  4.0  2.2  1.0 ! A.1108 at  1.40e+06
assign (resid  56 and name  HB2) (resid  57 and name   HN)  3.0  1.2  0.5 ! A.1109 at  5.96e+06

! D57
assign (resid  57 and name   HN) (resid  57 and name  HB1)  3.0  1.2  0.5 ! A.1111 at  9.16e+06
assign (resid  57 and name   HN) (resid  57 and name  HB2)  3.0  1.2  0.5 ! A.1112 at  8.38e+06

! W58


! S59
assign (resid  59 and name   HN) (resid  59 and name  HB1)  3.0  1.2  0.5 ! A.1113 at  3.51e+06
assign (resid  59 and name   HN) (resid  59 and name  HB2)  3.0  1.2  0.5 ! A.1114 at  3.51e+06

! D60
assign (resid  60 and name   HN) (resid  60 and name  HB1)  4.0  2.2  1.0 ! A.1115 at  2.24e+06

! H61
assign (resid  61 and name   HN) (resid  61 and name  HB1)  3.0  1.2  0.5 ! A.1117 at  3.50e+06
assign (resid  61 and name   HN) (resid  61 and name  HB2)  3.0  1.2  0.5 ! A.1118 at  7.17e+06
assign (resid  61 and name   HA) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1125 at  2.98e+06
assign (resid  61 and name   HN) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1128 at  2.31e+06
assign (resid  61 and name  HB1) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1126 at  1.30e+06
assign (resid  61 and name  HB2) (resid  62 and name   HN)  4.0  2.2  1.0 ! A.1127 at  2.42e+06
assign (resid  61 and name   HA) (resid  62 and name  HB#)  3.0  1.2  0.8 ! A.1121 at -4.93e+06
assign (resid  61 and name   HN) (resid  94 and name   HA)  3.0  1.2  0.5 ! A.1119 at  4.52e+06

! A62
assign (resid  62 and name   HN) (resid  62 and name  HB#)  3.0  1.2  1.0 ! A.1130 at  7.15e+06
assign (resid  62 and name   HN) (resid  63 and name HD1#)  4.0  2.2  1.5 ! A.1131 at  2.51e+06
assign (resid  62 and name  HB#) (resid  63 and name   HN)  3.0  1.2  1.0 ! A.1124 at -1.20e+07
assign (resid  62 and name   HN) (resid  92 and name   HA)  4.0  2.2  1.0 ! A.1132 at  1.39e+06
assign (resid  62 and name   HN) (resid  94 and name   HA)  3.0  1.2  0.5 ! A.1133 at  4.30e+06

! L63
assign (resid  63 and name   HN) (resid  63 and name   HG)  3.0  1.2  0.5 ! A.1140 at  6.59e+06
assign (resid  63 and name   HN) (resid  63 and name HD1#)  3.0  1.2  1.0 ! A.1139 at  8.37e+06
assign (resid  63 and name HD1#) (resid  63 and name   HA)  3.0  1.2  0.8 ! A.1134 at -2.00e+07
assign (resid  63 and name HD1#) (resid  63 and name  HB2)  3.0  1.2  0.8 ! A.1135 at -1.91e+07
assign (resid  63 and name   HN) (resid  64 and name   HN)  4.0  2.2  1.0 ! A.1141 at  2.79e+06
assign (resid  63 and name HD1#) (resid  64 and name   HN)  3.0  1.2  1.0 ! A.1136 at -8.10e+06
assign (resid  63 and name   HA) (resid  64 and name   HN)  3.0  1.2  0.5 ! A.1144 at  4.45e+06
assign (resid  63 and name   HG) (resid  64 and name   HN)  4.0  2.2  1.0 ! A.1147 at  2.68e+06
assign (resid  63 and name  HB1) (resid  64 and name   HN)  4.0  2.2  1.0 ! A.1145 at  2.78e+06
assign (resid  63 and name  HB2) (resid  72 and name   HN)  4.0  2.2  1.3 ! A.1432 at  3.92e+06
assign (resid  63 and name   HA) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1404 at -4.25e+06
assign (resid  63 and name   HG) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1407 at -1.34e+07
assign (resid  63 and name  HB1) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1405 at -1.20e+07
assign (resid  63 and name  HB2) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1406 at -2.40e+07
assign (resid  63 and name  HB2) (resid  72 and name HD2#)  3.0  1.2  1.2 ! A.1419 at -4.75e+07
assign (resid  63 and name HD1#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1881 at  1.03e+07
assign (resid  63 and name   HA) (resid  93 and name   HN)  3.0  1.2  0.5 ! A.1933 at  6.15e+06

! W64
assign (resid  64 and name   HN) (resid  64 and name  HB1)  3.0  1.2  0.5 ! A.1148 at  3.45e+06
assign (resid  64 and name   HN) (resid  64 and name  HB2)  3.0  1.2  1.0 ! A.1149 at  3.79e+06
assign (resid  64 and name  HE1) (resid  64 and name  HB2)  3.0  1.2  1.9 ! A.1158 at  5.83e+06
assign (resid  64 and name   HN) (resid  65 and name   HN)  3.0  1.2  1.1 ! A.1164 at  3.76e+06
!assign (resid  64 and name   HN) (resid  65 and name  HE1)  4.0  2.2  1.0 ! A.1150 at  1.39e+06
assign (resid  64 and name   HA) (resid  65 and name  HB2)  4.0  2.2  1.0 ! A.1142 at -2.65e+06
assign (resid  64 and name   HA) (resid  65 and name   HN)  3.0  1.2  0.5 ! A.1161 at  6.12e+06
assign (resid  64 and name  HB1) (resid  65 and name   HN)  4.0  2.2  1.0 ! A.1162 at  2.76e+06
assign (resid  64 and name  HB2) (resid  65 and name   HN)  3.0  1.2  0.5 ! A.1163 at  1.09e+07
assign (resid  64 and name  HE1) (resid  66 and name   HA)  3.0  1.2  0.3 ! A.1159 at  3.62e+06
assign (resid  64 and name  HE1) (resid  66 and name   HN)  4.0  2.2  1.0 ! A.1160 at  1.62e+06
assign (resid  64 and name  HE1) (resid  66 and name  HG1)  3.0  1.2  1.3 ! A.1200 at -5.14e+06
assign (resid  64 and name  HE1) (resid  66 and name  HG2)  3.0  1.2  0.3 ! A.1201 at -5.56e+06
assign (resid  64 and name   HA) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1356 at  4.44e+06
assign (resid  64 and name  HB1) (resid  70 and name   HN)  4.0  2.2  1.0 ! A.1357 at  2.14e+06
assign (resid  64 and name  HB2) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1358 at  8.83e+06
assign (resid  64 and name   HA) (resid  70 and name   HB)  4.0  2.2  1.5 ! A.1327 at -2.95e+06
assign (resid  64 and name  HB2) (resid  70 and name   HB)  4.0  2.2  1.5 ! A.1328 at -5.58e+06
assign (resid  64 and name   HA) (resid  70 and name HG2#)  3.0  1.2  0.8 ! A.1340 at -6.98e+06
assign (resid  64 and name  HB2) (resid  70 and name HG2#)  3.0  1.2  0.8 ! A.1341 at -1.74e+07
assign (resid  64 and name   HN) (resid  71 and name   HA)  4.0  2.2  1.0 ! A.1152 at  2.60e+06
assign (resid  64 and name  HB1) (resid  71 and name   HA)  3.0  1.2  0.3 ! A.1143 at -1.30e+07
assign (resid  64 and name   HA) (resid  71 and name   HN)  3.0  1.2  1.2 ! A.1379 at  4.68e+06
assign (resid  64 and name   HN) (resid  72 and name HD1#)  4.0  2.2  1.5 ! A.1153 at  2.36e+06
assign (resid  64 and name   HA) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1433 at  3.01e+06
assign (resid  64 and name   HN) (resid  90 and name   HA)  4.0  2.2  1.0 ! A.1154 at  1.67e+06
assign (resid  64 and name   HN) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1155 at  3.69e+06
assign (resid  64 and name  HE1) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1898 at  2.03e+06
assign (resid  64 and name   HN) (resid  91 and name HE22)  4.0  2.2  1.0 ! A.1899 at  2.17e+06
assign (resid  64 and name   HN) (resid  92 and name   HA)  3.0  1.2  1.2 ! A.1156 at  4.23e+06
assign (resid  64 and name   HN) (resid  93 and name HG2#)  3.0  1.2  1.0 ! A.1157 at  3.22e+06
assign (resid  64 and name  HB1) (resid  93 and name HG2#)  3.0  1.2  0.8 ! A.1930 at -1.07e+07

! W65
assign (resid  65 and name   HN) (resid  65 and name  HB1)  3.0  1.2  0.5 ! A.1166 at  9.70e+06
assign (resid  65 and name   HN) (resid  65 and name  HB2)  3.0  1.2  0.5 ! A.1167 at  9.70e+06
assign (resid  65 and name  HE1) (resid  65 and name   HA)  3.0  1.2  1.4 ! A.1180 at  1.04e+07
assign (resid  65 and name  HE1) (resid  65 and name  HB1)  3.0  1.2  1.8 ! A.1181 at  3.60e+06
assign (resid  65 and name   HN) (resid  66 and name   HN)  4.0  2.2  1.0 ! A.1168 at  2.42e+06
assign (resid  65 and name  HE1) (resid  66 and name   HN)  4.0  2.2  1.2 ! A.1182 at  3.46e+06
assign (resid  65 and name   HA) (resid  66 and name   HN)  4.0  2.2  1.0 ! A.1213 at  2.30e+06
assign (resid  65 and name   HA) (resid  66 and name  HG1)  4.0  2.2  1.0 ! A.1202 at -2.43e+06
assign (resid  65 and name   HA) (resid  66 and name  HG2)  4.0  2.2  1.0 ! A.1203 at -2.20e+06
assign (resid  65 and name   HN) (resid  67 and name   HN)  4.0  2.2  1.0 ! A.1169 at  2.72e+06
assign (resid  65 and name  HE1) (resid  67 and name   HA)  3.0  1.2  1.7 ! A.1183 at  4.07e+06
assign (resid  65 and name  HE1) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1190 at  1.12e+07
assign (resid  65 and name  HE1) (resid  67 and name  HB1)  3.0  1.2  0.3 ! A.1184 at  1.58e+07
assign (resid  65 and name  HE1) (resid  67 and name  HB2)  3.0  1.2  0.3 ! A.1185 at  1.12e+07
assign (resid  65 and name  HE1) (resid  67 and name  HD1)  3.0  1.2  1.1 ! A.1186 at  9.47e+06
assign (resid  65 and name  HE1) (resid  67 and name  HE1)  3.0  1.2  0.3 ! A.1187 at  3.73e+06
assign (resid  65 and name  HE1) (resid  67 and name  HG1)  3.0  1.2  0.3 ! A.1188 at  7.09e+06
assign (resid  65 and name  HE1) (resid  67 and name  HG2)  3.0  1.2  0.3 ! A.1189 at  2.09e+07
assign (resid  65 and name   HA) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1240 at  6.40e+06
assign (resid  65 and name  HE1) (resid  68 and name  HE1)  3.0  1.2  0.3 ! A.1191 at  3.80e+06
assign (resid  65 and name  HE1) (resid  68 and name  HG1)  3.0  1.2  1.9 ! A.1192 at  6.61e+06
assign (resid  65 and name   HA) (resid  68 and name   HN)  3.0  1.2  1.1 ! A.1295 at  2.04e+07
assign (resid  65 and name  HE1) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.1296 at  3.08e+06
assign (resid  65 and name   HA) (resid  68 and name   HA)  4.0  2.2  2.7 ! A.1257 at -3.35e+06
assign (resid  65 and name   HA) (resid  68 and name  HG1)  4.0  2.2  1.0 ! A.1283 at -3.04e+06
assign (resid  65 and name   HA) (resid  68 and name  HG2)  3.0  1.2  1.3 ! A.1284 at -4.85e+06
assign (resid  65 and name   HN) (resid  69 and name   HN)  4.0  2.2  1.0 ! A.1170 at  3.07e+06
assign (resid  65 and name   HA) (resid  69 and name   HN)  3.0  1.2  1.3 ! A.1315 at  9.24e+06
assign (resid  65 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1172 at  5.78e+06
assign (resid  65 and name   HN) (resid  70 and name HG2#)  3.0  1.2  1.0 ! A.1171 at  7.93e+06
assign (resid  65 and name   HA) (resid  70 and name   HN)  3.0  1.2  1.4 ! A.1359 at  9.00e+06
assign (resid  65 and name  HB1) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1360 at  1.57e+07
assign (resid  65 and name  HB2) (resid  70 and name   HN)  3.0  1.2  1.0 ! A.1361 at  1.57e+07
assign (resid  65 and name   HN) (resid  70 and name   HB)  3.0  1.2  1.2 ! A.1330 at -3.45e+06
assign (resid  65 and name  HB1) (resid  70 and name   HB)  3.0  1.2  0.8 ! A.1329 at -7.37e+06
assign (resid  65 and name  HB1) (resid  70 and name HG2#)  2.5  0.7  0.7 ! A.1342 at -2.82e+07
assign (resid  65 and name  HB2) (resid  70 and name HG2#)  2.5  0.7  0.7 ! A.1343 at -2.88e+07
assign (resid  65 and name   HN) (resid  71 and name   HA)  3.0  1.2  1.0 ! A.1173 at  1.21e+07
assign (resid  65 and name   HN) (resid  71 and name   HN)  4.0  2.2  1.0 ! A.1174 at  2.42e+06
assign (resid  65 and name   HN) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1178 at  2.64e+06
assign (resid  65 and name   HN) (resid  72 and name  HB2)  3.0  1.2  1.9 ! A.1175 at  4.41e+06
assign (resid  65 and name   HN) (resid  72 and name HD1#)  3.0  1.2  1.0 ! A.1176 at  7.50e+06
assign (resid  65 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.0 ! A.1177 at  5.26e+06
assign (resid  65 and name  HB2) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1434 at  2.36e+06
assign (resid  65 and name  HB2) (resid  72 and name HD1#)  3.0  1.2  0.8 ! A.1408 at -8.08e+06
assign (resid  65 and name  HB2) (resid  72 and name HD2#)  3.0  1.2  0.8 ! A.1420 at -1.24e+07
assign (resid  65 and name  HE1) (resid  84 and name HG2#)  3.0  1.2  1.4 ! A.1193 at  6.48e+06
assign (resid  65 and name  HE1) (resid  88 and name   HA)  3.0  1.2  0.3 ! A.1194 at  7.24e+06
assign (resid  65 and name  HE1) (resid  88 and name  HB#)  3.0  1.2  0.8 ! A.1195 at  1.59e+07
assign (resid  65 and name  HE1) (resid  89 and name   HN)  3.0  1.2  1.2 ! A.1196 at  5.22e+06
assign (resid  65 and name   HN) (resid  90 and name HD2#)  3.0  1.2  1.5 ! A.1179 at  7.50e+06
assign (resid  65 and name  HE1) (resid  90 and name HD2#)  3.0  1.2  0.8 ! A.1197 at  7.25e+06
assign (resid  65 and name   HA) (resid  90 and name HD2#)  3.0  1.2  0.8 ! A.1830 at -6.70e+06
assign (resid  65 and name  HB2) (resid  90 and name HD2#)  3.0  1.2  0.8 ! A.1831 at -3.65e+06

! E66
assign (resid  66 and name   HN) (resid  66 and name  HB1)  3.0  1.2  0.5 ! A.1214 at  3.76e+06
assign (resid  66 and name   HN) (resid  66 and name  HG1)  3.0  1.2  0.5 ! A.1215 at  3.76e+06
assign (resid  66 and name   HN) (resid  66 and name  HG2)  3.0  1.2  0.5 ! A.1216 at  3.76e+06
assign (resid  66 and name   HA) (resid  66 and name  HG2)  4.0  2.2  1.0 ! A.1199 at -1.88e+06
assign (resid  66 and name  HG1) (resid  66 and name   HA)  3.0  1.2  0.3 ! A.1204 at -6.52e+06
assign (resid  66 and name  HG1) (resid  67 and name   HA)  3.0  1.2  0.3 ! A.1208 at -3.39e+06
assign (resid  66 and name  HG1) (resid  67 and name   HN)  4.0  2.2  1.0 ! A.1210 at -2.93e+06
assign (resid  66 and name  HG2) (resid  67 and name   HA)  4.0  2.2  1.0 ! A.1209 at -1.96e+06
assign (resid  66 and name  HG2) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1211 at -5.10e+06
assign (resid  66 and name   HA) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1242 at  4.49e+06
assign (resid  66 and name   HN) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1246 at  3.48e+06
assign (resid  66 and name  HB1) (resid  67 and name   HN)  3.0  1.2  1.2 ! A.1243 at  1.11e+07
assign (resid  66 and name  HB2) (resid  67 and name   HN)  3.0  1.2  1.0 ! A.1244 at  1.02e+07
assign (resid  66 and name   HN) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.1297 at  2.35e+06
assign (resid  66 and name  HB1) (resid  69 and name   HN)  3.0  1.2  1.2 ! A.1316 at  4.53e+06
assign (resid  66 and name  HG2) (resid  69 and name   HN)  3.0  1.2  1.5 ! A.1317 at  4.90e+06
assign (resid  66 and name  HB1) (resid  69 and name  HD1)  3.0  1.2  1.2 ! A.1308 at -5.73e+06
assign (resid  66 and name  HG1) (resid  69 and name  HD1)  4.0  2.2  1.0 ! A.1309 at -3.16e+06

! K67
assign (resid  67 and name   HN) (resid  67 and name  HB1)  3.0  1.2  0.5 ! A.1248 at  1.65e+07
assign (resid  67 and name   HN) (resid  67 and name  HB2)  3.0  1.2  0.5 ! A.1249 at  7.54e+06
assign (resid  67 and name   HN) (resid  67 and name  HG1)  3.0  1.2  0.5 ! A.1250 at  8.65e+06
assign (resid  67 and name   HN) (resid  67 and name  HG2)  3.0  1.2  0.5 ! A.1251 at  7.62e+06
assign (resid  67 and name   HA) (resid  67 and name  HD1)  3.0  1.2  0.3 ! A.1219 at -1.26e+07
assign (resid  67 and name   HA) (resid  67 and name  HE1)  4.0  2.2  1.0 ! A.1220 at -2.95e+06
assign (resid  67 and name   HA) (resid  67 and name  HG1)  3.0  1.2  0.8 ! A.1221 at -1.25e+07
assign (resid  67 and name  HD1) (resid  67 and name   HN)  3.0  1.2  0.5 ! A.1229 at -7.15e+06
assign (resid  67 and name  HG1) (resid  67 and name  HE1)  3.0  1.2  0.3 ! A.1236 at -1.31e+07
assign (resid  67 and name  HG2) (resid  67 and name   HA)  3.0  1.2  0.3 ! A.1233 at -1.81e+07
assign (resid  67 and name  HG2) (resid  67 and name  HE1)  2.5  0.7  0.2 ! A.1237 at -4.29e+07
assign (resid  67 and name   HN) (resid  68 and name   HN)  3.0  1.2  0.5 ! A.1254 at  4.10e+06
assign (resid  67 and name   HN) (resid  68 and name  HG1)  4.0  2.2  1.0 ! A.1252 at  3.02e+06
assign (resid  67 and name   HN) (resid  68 and name  HG2)  4.0  2.2  1.0 ! A.1253 at  3.02e+06
assign (resid  67 and name   HA) (resid  68 and name  HG2)  4.0  2.2  1.0 ! A.1223 at -2.39e+06
assign (resid  67 and name   HA) (resid  68 and name   HN)  3.0  1.2  0.5 ! A.1298 at  5.02e+06
assign (resid  67 and name  HB2) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.1299 at  2.30e+06
assign (resid  67 and name   HN) (resid  69 and name   HN)  3.0  1.2  0.5 ! A.1255 at  4.10e+06
assign (resid  67 and name   HN) (resid  70 and name   HN)  4.0  2.2  1.0 ! A.1256 at  1.76e+06

! K68
assign (resid  68 and name   HN) (resid  68 and name  HB2)  3.0  1.2  0.5 ! A.1302 at  5.64e+06
assign (resid  68 and name   HN) (resid  68 and name  HD1)  3.0  1.2  0.5 ! A.1303 at  7.07e+06
assign (resid  68 and name   HN) (resid  68 and name  HG1)  3.0  1.2  0.5 ! A.1304 at  5.45e+06
assign (resid  68 and name   HN) (resid  68 and name  HG2)  3.0  1.2  0.5 ! A.1305 at  5.45e+06
assign (resid  68 and name   HA) (resid  68 and name  HD1)  3.0  1.2  0.3 ! A.1260 at -1.06e+07
assign (resid  68 and name   HA) (resid  68 and name  HG1)  3.0  1.2  1.0 ! A.1261 at -9.95e+06
assign (resid  68 and name   HA) (resid  68 and name  HG2)  3.0  1.2  0.3 ! A.1262 at -7.76e+06
assign (resid  68 and name  HB1) (resid  68 and name  HD1)  3.0  1.2  0.3 ! A.1266 at -4.78e+06
assign (resid  68 and name  HD1) (resid  68 and name  HB2)  3.0  1.2  0.3 ! A.1271 at -1.45e+07
assign (resid  68 and name  HE1) (resid  68 and name  HG1)  2.5  0.7  0.2 ! A.1279 at -3.48e+07
assign (resid  68 and name  HE1) (resid  68 and name  HG2)  2.5  0.7  0.2 ! A.1281 at -3.93e+07
assign (resid  68 and name  HE2) (resid  68 and name  HG1)  2.5  0.7  1.0 ! A.1280 at -3.30e+07
assign (resid  68 and name  HE2) (resid  68 and name  HG2)  2.5  0.7  0.2 ! A.1282 at -3.30e+07
assign (resid  68 and name   HA) (resid  69 and name   HN)  3.0  1.2  0.5 ! A.1319 at  5.29e+06
assign (resid  68 and name  HB2) (resid  69 and name   HN)  3.0  1.2  0.5 ! A.1320 at  5.64e+06
assign (resid  68 and name   HA) (resid  69 and name  HD1)  3.0  1.2  0.3 ! A.1310 at -3.55e+06
assign (resid  68 and name   HA) (resid  70 and name   HN)  3.0  1.2  1.4 ! A.1364 at  4.98e+06
assign (resid  68 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1367 at  1.96e+07
assign (resid  68 and name  HB2) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1365 at  5.53e+06
assign (resid  68 and name  HG1) (resid  70 and name   HN)  3.0  1.2  1.4 ! A.1366 at  7.79e+06
assign (resid  68 and name   HN) (resid  70 and name   HB)  3.0  1.2  1.7 ! A.1333 at -4.42e+06
assign (resid  68 and name  HB1) (resid  70 and name   HB)  3.0  1.2  0.3 ! A.1331 at -5.35e+06
assign (resid  68 and name  HB2) (resid  70 and name   HB)  3.0  1.2  0.3 ! A.1332 at -6.70e+06
assign (resid  68 and name   HA) (resid  70 and name HG2#)  3.0  1.2  1.6 ! A.1345 at -1.17e+07

! R69
assign (resid  69 and name   HN) (resid  69 and name  HB1)  3.0  1.2  1.1 ! A.1322 at  1.58e+07
assign (resid  69 and name   HN) (resid  69 and name  HB2)  3.0  1.2  0.5 ! A.1323 at  2.50e+07
assign (resid  69 and name   HN) (resid  69 and name  HD1)  3.0  1.2  0.5 ! A.1324 at  1.31e+07
assign (resid  69 and name  HD1) (resid  69 and name  HB1)  2.5  0.7  1.1 ! A.1311 at -6.28e+07
assign (resid  69 and name  HD1) (resid  69 and name  HB2)  2.5  0.7  0.2 ! A.1312 at -1.19e+08
assign (resid  69 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1325 at  1.46e+07
assign (resid  69 and name  HD1) (resid  70 and name   HN)  3.0  1.2  1.3 ! A.1314 at -1.02e+07
assign (resid  69 and name   HA) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.1368 at  2.00e+07
assign (resid  69 and name  HB1) (resid  70 and name   HN)  3.0  1.2  1.4 ! A.1369 at  1.22e+07
assign (resid  69 and name  HB2) (resid  70 and name   HN)  3.0  1.2  1.3 ! A.1370 at  1.35e+07
assign (resid  69 and name   HN) (resid  70 and name   HB)  3.0  1.2  1.5 ! A.1334 at -4.42e+06
assign (resid  69 and name   HA) (resid  70 and name HG2#)  3.0  1.2  1.3 ! A.1346 at -1.12e+07

! T70
assign (resid  70 and name   HN) (resid  70 and name   HB)  3.0  1.2  0.5 ! A.1373 at  1.42e+07
assign (resid  70 and name   HN) (resid  70 and name HG2#)  3.0  1.2  1.0 ! A.1374 at  2.30e+07
assign (resid  70 and name HG2#) (resid  70 and name   HA)  2.5  0.7  0.7 ! A.1347 at -4.76e+07
assign (resid  70 and name   HN) (resid  71 and name   HA)  3.0  1.2  1.8 ! A.1375 at  9.92e+06
assign (resid  70 and name   HN) (resid  71 and name   HN)  3.0  1.2  1.0 ! A.1376 at  7.37e+06
assign (resid  70 and name   HA) (resid  71 and name   HN)  3.0  1.2  0.5 ! A.1380 at  1.41e+07
assign (resid  70 and name   HB) (resid  71 and name   HN)  3.0  1.2  0.5 ! A.1338 at -7.67e+06
assign (resid  70 and name HG2#) (resid  71 and name   HN)  2.5  0.7  0.9 ! A.1350 at -3.05e+07
assign (resid  70 and name   HB) (resid  71 and name  HE1)  4.0  2.2  2.1 ! A.1394 at  6.06e+06
assign (resid  70 and name   HN) (resid  72 and name HD1#)  3.0  1.2  1.7 ! A.1377 at  4.22e+06
assign (resid  70 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.7 ! A.1378 at  7.79e+06
assign (resid  70 and name   HB) (resid  72 and name HD2#)  3.0  1.2  1.4 ! A.1339 at -1.20e+07
assign (resid  70 and name HG2#) (resid  72 and name   HA)  3.0  1.2  0.8 ! A.1351 at -1.11e+07
assign (resid  70 and name HG2#) (resid  72 and name   HN)  3.0  1.2  1.0 ! A.1354 at -6.71e+06
assign (resid  70 and name HG2#) (resid  72 and name HD1#)  3.0  1.2  1.3 ! A.1352 at -1.74e+07
assign (resid  70 and name HG2#) (resid  72 and name HD2#)  2.5  0.7  1.2 ! A.1353 at -8.58e+07
assign (resid  70 and name HG2#) (resid  74 and name  HE1)  4.0  2.2  1.4 ! A.1355 at -9.77e+06

! W71
assign (resid  71 and name   HN) (resid  71 and name  HB1)  3.0  1.2  0.5 ! A.1385 at  8.69e+06
assign (resid  71 and name   HN) (resid  71 and name  HB2)  3.0  1.2  0.5 ! A.1386 at  8.71e+06
assign (resid  71 and name   HN) (resid  71 and name  HE1)  4.0  2.2  1.0 ! A.1387 at  2.39e+06
assign (resid  71 and name  HE1) (resid  71 and name   HA)  4.0  2.2  1.9 ! A.1395 at  6.98e+06
assign (resid  71 and name  HE1) (resid  71 and name  HB1)  3.0  1.2  2.0 ! A.1396 at  7.19e+06
assign (resid  71 and name  HE1) (resid  71 and name  HB2)  3.0  1.2  1.8 ! A.1397 at  7.03e+06
assign (resid  71 and name   HN) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1390 at  1.63e+06
assign (resid  71 and name   HN) (resid  72 and name HD1#)  4.0  2.2  1.5 ! A.1388 at  1.38e+06
assign (resid  71 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.5 ! A.1425 at -4.02e+06
assign (resid  71 and name   HA) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1435 at  2.45e+06
assign (resid  71 and name  HB2) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.1436 at  2.36e+06
assign (resid  71 and name   HA) (resid  72 and name HD1#)  3.0  1.2  1.4 ! A.1410 at -7.89e+06
assign (resid  71 and name   HA) (resid  72 and name HD2#)  3.0  1.2  1.9 ! A.1424 at -1.03e+07
assign (resid  71 and name   HN) (resid  73 and name   HG)  3.0  1.2  1.1 ! A.1393 at  3.33e+06
assign (resid  71 and name   HN) (resid  73 and name  HB1)  4.0  2.2  1.2 ! A.1391 at  3.33e+06
assign (resid  71 and name   HN) (resid  73 and name HD2#)  3.0  1.2  1.0 ! A.1392 at  5.72e+06
assign (resid  71 and name  HE1) (resid  73 and name   HG)  3.0  1.2  1.0 ! A.1401 at  5.01e+06
assign (resid  71 and name  HE1) (resid  73 and name HD1#)  3.0  1.2  0.8 ! A.1399 at  6.86e+06
assign (resid  71 and name  HE1) (resid  73 and name HD2#)  3.0  1.2  0.8 ! A.1400 at  6.17e+06
assign (resid  71 and name   HA) (resid  73 and name   HN)  3.0  1.2  1.4 ! A.1449 at  8.17e+06
assign (resid  71 and name  HB2) (resid  73 and name HD2#)  3.0  1.2  0.8 ! A.1445 at -1.87e+07

! L72
assign (resid  72 and name   HN) (resid  72 and name   HG)  3.0  1.2  0.5 ! A.1441 at  4.37e+06
assign (resid  72 and name   HN) (resid  72 and name  HB2)  3.0  1.2  0.5 ! A.1438 at  5.06e+06
assign (resid  72 and name   HN) (resid  72 and name HD1#)  3.0  1.2  1.0 ! A.1439 at  4.65e+06
assign (resid  72 and name   HN) (resid  72 and name HD2#)  3.0  1.2  1.0 ! A.1440 at  3.81e+06
assign (resid  72 and name   HA) (resid  72 and name HD2#)  3.0  1.2  0.8 ! A.1402 at -4.25e+06
assign (resid  72 and name HD1#) (resid  72 and name   HA)  3.0  1.2  0.8 ! A.1411 at -7.26e+06
assign (resid  72 and name HD1#) (resid  72 and name  HB2)  2.5  0.7  0.7 ! A.1412 at -4.35e+07
assign (resid  72 and name HD2#) (resid  72 and name  HB2)  3.0  1.2  0.8 ! A.1427 at -2.08e+07
assign (resid  72 and name HD1#) (resid  73 and name   HN)  4.0  2.2  1.1 ! A.1416 at -7.05e+06
assign (resid  72 and name HD2#) (resid  73 and name   HN)  3.0  1.2  1.5 ! A.1430 at -1.55e+07
assign (resid  72 and name   HA) (resid  73 and name   HN)  3.0  1.2  0.5 ! A.1450 at  9.39e+06
assign (resid  72 and name   HG) (resid  73 and name   HN)  3.0  1.2  1.2 ! A.1454 at  5.17e+06
assign (resid  72 and name   HN) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.1455 at  2.33e+06
assign (resid  72 and name  HB1) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.1451 at  3.20e+06
assign (resid  72 and name HD1#) (resid  84 and name HG12)  4.0  2.2  1.5 ! A.1417 at -2.49e+06
assign (resid  72 and name HD2#) (resid  84 and name HG12)  3.0  1.2  0.8 ! A.1431 at -3.68e+06
assign (resid  72 and name HD2#) (resid  90 and name HD2#)  3.0  1.2  1.3 ! A.1834 at -8.57e+06

! L73
assign (resid  73 and name   HN) (resid  73 and name   HG)  3.0  1.2  0.5 ! A.1460 at  1.89e+07
assign (resid  73 and name   HN) (resid  73 and name  HB1)  3.0  1.2  0.5 ! A.1457 at  2.19e+07
assign (resid  73 and name   HN) (resid  73 and name HD1#)  3.0  1.2  1.0 ! A.1458 at  2.24e+07
assign (resid  73 and name   HN) (resid  73 and name HD2#)  3.0  1.2  1.0 ! A.1459 at  2.21e+07
assign (resid  73 and name  HB1) (resid  73 and name HD1#)  3.0  1.2  0.8 ! A.1442 at -5.45e+06
assign (resid  73 and name HD1#) (resid  73 and name   HA)  2.5  0.7  0.7 ! A.1443 at -4.63e+07
assign (resid  73 and name HD2#) (resid  73 and name   HA)  3.0  1.2  1.1 ! A.1446 at -3.96e+07
assign (resid  73 and name HD2#) (resid  73 and name  HB1)  2.5  0.7  0.7 ! A.1447 at -6.19e+07
assign (resid  73 and name   HN) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.1461 at  5.52e+06
assign (resid  73 and name HD1#) (resid  74 and name  HD2)  3.0  1.2  0.8 ! A.1462 at -5.62e+06
assign (resid  73 and name HD1#) (resid  74 and name  HE1)  3.0  1.2  0.8 ! A.1472 at -7.77e+06
assign (resid  73 and name HD1#) (resid  74 and name  HE2)  3.0  1.2  0.8 ! A.1473 at -1.10e+07

! K74
assign (resid  74 and name   HN) (resid  74 and name  HB1)  3.0  1.2  0.5 ! A.1486 at  6.03e+06
assign (resid  74 and name  HD1) (resid  74 and name   HA)  3.0  1.2  0.3 ! A.1463 at -3.89e+06
assign (resid  74 and name  HD1) (resid  74 and name  HB1)  3.0  1.2  0.8 ! A.1465 at -4.94e+06
assign (resid  74 and name  HD2) (resid  74 and name   HA)  4.0  2.2  1.0 ! A.1464 at -2.06e+06
assign (resid  74 and name  HD2) (resid  74 and name  HB1)  4.0  2.2  1.0 ! A.1466 at -3.11e+06
assign (resid  74 and name  HE1) (resid  74 and name   HA)  3.0  1.2  0.3 ! A.1474 at -4.74e+06
assign (resid  74 and name  HE1) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.1479 at -6.20e+06
assign (resid  74 and name  HE2) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.1480 at -3.67e+06
assign (resid  74 and name  HG2) (resid  74 and name   HN)  4.0  2.2  1.0 ! A.1484 at -2.03e+06
assign (resid  74 and name  HG2) (resid  74 and name  HE1)  3.0  1.2  0.3 ! A.1482 at -3.93e+06

! T75
assign (resid  75 and name HG2#) (resid  75 and name   HA)  3.0  1.2  0.8 ! A.1491 at -5.81e+06
assign (resid  75 and name   HA) (resid  76 and name   HN)  4.0  2.2  1.0 ! A.1493 at  1.52e+06
assign (resid  75 and name   HB) (resid  76 and name   HN)  4.0  2.2  1.0 ! A.1494 at  1.23e+06
assign (resid  75 and name HG2#) (resid  77 and name   HN)  4.0  2.2  1.5 ! A.1496 at  2.04e+06

! H76
assign (resid  76 and name   HN) (resid  77 and name   HN)  4.0  2.2  1.0 ! A.1495 at  2.40e+06
assign (resid  76 and name   HA) (resid  77 and name   HN)  3.0  1.2  0.5 ! A.1497 at  4.15e+06

! W77
assign (resid  77 and name   HN) (resid  77 and name  HB1)  4.0  2.2  1.0 ! A.1499 at  2.06e+06
assign (resid  77 and name   HN) (resid  77 and name  HB2)  4.0  2.2  1.0 ! A.1500 at  1.51e+06
assign (resid  77 and name   HN) (resid  78 and name   HN)  3.0  1.2  1.2 ! A.1522 at  4.40e+06
assign (resid  77 and name  HE1) (resid  78 and name   HN)  4.0  2.2  1.5 ! A.1502 at  1.71e+06
assign (resid  77 and name   HA) (resid  78 and name   HN)  3.0  1.2  0.5 ! A.1518 at  1.65e+07
assign (resid  77 and name  HB1) (resid  78 and name   HN)  3.0  1.2  0.5 ! A.1519 at  4.15e+06
assign (resid  77 and name  HB2) (resid  78 and name   HN)  3.0  1.2  0.5 ! A.1520 at  3.97e+06

! T78
assign (resid  78 and name   HN) (resid  78 and name   HB)  4.0  2.2  1.0 ! A.1524 at  2.16e+06
assign (resid  78 and name   HN) (resid  78 and name HG2#)  3.0  1.2  1.0 ! A.1525 at  1.16e+07
assign (resid  78 and name HG2#) (resid  78 and name   HA)  3.0  1.2  0.8 ! A.1512 at -1.46e+07
assign (resid  78 and name   HN) (resid  79 and name   HN)  3.0  1.2  1.2 ! A.1526 at  3.49e+06
assign (resid  78 and name HG2#) (resid  79 and name   HN)  3.0  1.2  1.0 ! A.1515 at -9.59e+06
assign (resid  78 and name   HN) (resid  80 and name   HN)  3.0  1.2  1.5 ! A.1572 at  4.05e+06
assign (resid  78 and name   HN) (resid  80 and name  HB1)  4.0  2.2  1.0 ! A.1527 at  2.10e+06
assign (resid  78 and name HG2#) (resid  80 and name   HN)  3.0  1.2  1.0 ! A.1517 at -7.54e+06
assign (resid  78 and name HG2#) (resid  80 and name  HB1)  3.0  1.2  0.8 ! A.1516 at -5.43e+06
assign (resid  78 and name   HB) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1570 at  6.91e+06
assign (resid  78 and name   HN) (resid  81 and name   HA)  4.0  2.2  1.0 ! A.1529 at  3.02e+06
assign (resid  78 and name   HN) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1536 at  3.52e+06
assign (resid  78 and name   HN) (resid  81 and name  HB1)  3.0  1.2  0.5 ! A.1530 at  9.49e+06
assign (resid  78 and name   HN) (resid  81 and name  HD1)  3.0  1.2  1.0 ! A.1531 at  3.71e+06
assign (resid  78 and name   HN) (resid  81 and name  HD2)  3.0  1.2  1.0 ! A.1532 at  4.17e+06
assign (resid  78 and name   HN) (resid  81 and name  HE1)  3.0  1.2  0.5 ! A.1533 at  3.97e+06
assign (resid  78 and name   HN) (resid  81 and name  HG1)  3.0  1.2  0.5 ! A.1610 at -5.65e+06
assign (resid  78 and name   HN) (resid  81 and name  HG2)  3.0  1.2  1.1 ! A.1535 at  6.49e+06 !! relaxed
assign (resid  78 and name   HN) (resid  82 and name   HN)  3.0  1.2  1.2 ! A.1633 at  3.34e+06

! L79
assign (resid  79 and name   HN) (resid  79 and name HD1#)  3.0  1.2  1.0 ! A.1555 at  6.87e+06
assign (resid  79 and name   HA) (resid  79 and name   HG)  3.0  1.2  0.3 ! A.1539 at -4.03e+06
assign (resid  79 and name   HA) (resid  79 and name HD1#)  3.0  1.2  0.8 ! A.1538 at -9.57e+06
assign (resid  79 and name HD1#) (resid  79 and name  HB1)  3.0  1.2  0.8 ! A.1542 at -8.33e+06
assign (resid  79 and name HD2#) (resid  79 and name   HA)  3.0  1.2  0.8 ! A.1551 at -5.43e+06
assign (resid  79 and name HD2#) (resid  79 and name   HN)  4.0  2.2  1.5 ! A.1553 at -3.01e+06
assign (resid  79 and name HD2#) (resid  79 and name  HB2)  3.0  1.2  0.8 ! A.1552 at -1.03e+07
assign (resid  79 and name   HA) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1573 at  5.11e+06
assign (resid  79 and name   HN) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1578 at  1.04e+07
assign (resid  79 and name  HB1) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1574 at  5.57e+06
assign (resid  79 and name  HB2) (resid  80 and name   HN)  3.0  1.2  0.5 ! A.1575 at  6.35e+06
assign (resid  79 and name HD1#) (resid  80 and name   HN)  3.0  1.2  1.0 ! A.1576 at  1.21e+07
assign (resid  79 and name HD2#) (resid  80 and name   HN)  3.0  1.2  1.0 ! A.1577 at  1.05e+07
assign (resid  79 and name  HB2) (resid  81 and name   HN)  3.0  1.2  1.8 ! A.1622 at  6.01e+06
assign (resid  79 and name   HN) (resid  82 and name   HN)  3.0  1.2  1.8 ! A.1634 at  9.74e+06
assign (resid  79 and name   HA) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1650 at  1.76e+06
assign (resid  79 and name  HB1) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1651 at  1.40e+06
assign (resid  79 and name   HA) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1540 at -3.84e+06
assign (resid  79 and name HD1#) (resid  84 and name HD1#)  2.5  0.7  1.2 ! A.1544 at -3.16e+07
assign (resid  79 and name   HG) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1678 at -5.01e+06
assign (resid  79 and name   HA) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1693 at -4.42e+06
assign (resid  79 and name   HG) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1695 at -9.25e+06
assign (resid  79 and name  HB1) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1694 at -6.11e+06

! D80
assign (resid  80 and name   HN) (resid  80 and name  HB1)  3.0  1.2  0.5 ! A.1580 at  2.12e+07
assign (resid  80 and name   HN) (resid  80 and name  HB2)  3.0  1.2  0.5 ! A.1581 at  2.12e+07
assign (resid  80 and name   HN) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1582 at  7.08e+06
assign (resid  80 and name   HA) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1559 at -6.94e+06
assign (resid  80 and name  HB2) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1564 at -4.42e+06
assign (resid  80 and name  HB1) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1624 at  1.26e+07
assign (resid  80 and name   HN) (resid  81 and name   HA)  4.0  2.2  1.0 ! A.1587 at -1.88e+06
assign (resid  80 and name  HB1) (resid  81 and name   HA)  3.0  1.2  1.0 ! A.1586 at -3.47e+06
assign (resid  80 and name   HN) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.1583 at  2.96e+06
assign (resid  80 and name  HB1) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.1635 at  2.44e+06
assign (resid  80 and name   HA) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1560 at -6.94e+06
assign (resid  80 and name   HN) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1654 at  2.89e+06
assign (resid  80 and name  HB1) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1652 at  2.41e+06
assign (resid  80 and name  HB2) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.1653 at  3.12e+06
assign (resid  80 and name   HN) (resid  84 and name HD1#)  4.0  2.2  1.5 ! A.1584 at  1.45e+06

! K81
assign (resid  81 and name   HN) (resid  81 and name  HG1)  4.0  2.2  1.0 ! A.1628 at  2.80e+06
assign (resid  81 and name   HN) (resid  81 and name  HG2)  3.0  1.2  1.2 ! A.1629 at  9.94e+06 !! relaxed
assign (resid  81 and name   HA) (resid  81 and name  HG1)  3.0  1.2  0.9 ! A.1589 at -6.80e+06
assign (resid  81 and name   HA) (resid  81 and name  HG2)  3.0  1.2  0.3 ! A.1590 at -9.20e+06
assign (resid  81 and name  HB1) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1595 at -3.79e+06
assign (resid  81 and name  HD1) (resid  81 and name   HA)  3.0  1.2  0.9 ! A.1599 at -1.29e+07
assign (resid  81 and name  HD1) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1608 at -3.45e+06
assign (resid  81 and name  HD1) (resid  81 and name  HB1)  3.0  1.2  0.3 ! A.1601 at -1.12e+07
assign (resid  81 and name  HD2) (resid  81 and name   HA)  3.0  1.2  1.2 ! A.1600 at -6.25e+06
assign (resid  81 and name  HD2) (resid  81 and name   HN)  3.0  1.2  0.5 ! A.1609 at -3.61e+06
assign (resid  81 and name  HD2) (resid  81 and name  HB1)  3.0  1.2  0.3 ! A.1602 at -1.10e+07
assign (resid  81 and name  HG1) (resid  81 and name  HE1)  3.0  1.2  0.3 ! A.1615 at -4.99e+06
assign (resid  81 and name  HG2) (resid  81 and name  HE1)  3.0  1.2  0.3 ! A.1616 at -4.25e+06
assign (resid  81 and name   HN) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1630 at  6.30e+06
assign (resid  81 and name  HB1) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1638 at  6.52e+06
assign (resid  81 and name   HA) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1637 at  5.49e+06
assign (resid  81 and name  HD1) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.1639 at  2.67e+06
assign (resid  81 and name  HG2) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.1640 at  8.27e+06
assign (resid  81 and name   HA) (resid  83 and name   HN)  3.0  1.2  1.1 ! A.1655 at  7.67e+06

! Y82
assign (resid  82 and name   HN) (resid  82 and name  HB1)  3.0  1.2  0.5 ! A.1643 at  7.04e+06
assign (resid  82 and name   HN) (resid  82 and name  HB2)  3.0  1.2  0.5 ! A.1644 at  5.84e+06
assign (resid  82 and name   HN) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1645 at  1.10e+07
assign (resid  82 and name  HB2) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1632 at -3.88e+06
assign (resid  82 and name   HA) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1656 at  4.02e+06
assign (resid  82 and name  HB1) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.1657 at  4.22e+06
assign (resid  82 and name   HN) (resid  84 and name HD1#)  3.0  1.2  1.0 ! A.1646 at  4.34e+06
assign (resid  82 and name   HN) (resid  84 and name HG11)  4.0  2.2  1.0 ! A.1647 at  2.97e+06
assign (resid  82 and name  HB1) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1679 at -1.06e+07
assign (resid  82 and name  HB2) (resid  84 and name HD1#)  3.0  1.2  0.8 ! A.1680 at -5.55e+06

! G83
assign (resid  83 and name   HN) (resid  84 and name   HB)  3.0  1.2  0.5 ! A.1662 at  6.92e+06
assign (resid  83 and name   HN) (resid  84 and name   HN)  3.0  1.2  0.5 ! A.1666 at  1.43e+07
assign (resid  83 and name   HN) (resid  84 and name HD1#)  3.0  1.2  1.0 ! A.1663 at  4.35e+06
assign (resid  83 and name   HN) (resid  84 and name HG11)  3.0  1.2  0.5 ! A.1664 at  4.42e+06
assign (resid  83 and name   HN) (resid  84 and name HG2#)  4.0  2.2  1.1 ! A.1665 at  6.97e+06
assign (resid  83 and name  HA1) (resid  84 and name   HN)  4.0  2.2  1.0 ! A.1706 at  2.39e+06
assign (resid  83 and name  HA2) (resid  84 and name   HN)  4.0  2.2  1.0 ! A.1707 at  2.44e+06
assign (resid  83 and name  HA2) (resid  84 and name   HA)  4.0  2.2  1.0 ! A.1667 at -1.85e+06

! I84
assign (resid  84 and name   HN) (resid  84 and name   HB)  3.0  1.2  0.5 ! A.1709 at  3.43e+06
assign (resid  84 and name   HN) (resid  84 and name HD1#)  3.0  1.2  1.0 ! A.1710 at  3.58e+06
assign (resid  84 and name   HN) (resid  84 and name HG12)  4.0  2.2  1.0 ! A.1711 at  1.42e+06
assign (resid  84 and name   HN) (resid  84 and name HG2#)  3.0  1.2  1.0 ! A.1712 at  6.04e+06
assign (resid  84 and name   HA) (resid  84 and name HD1#)  4.0  2.2  1.5 ! A.1668 at -2.93e+06
assign (resid  84 and name   HA) (resid  84 and name HG11)  4.0  2.2  1.0 ! A.1669 at -1.90e+06
assign (resid  84 and name   HA) (resid  84 and name HG12)  4.0  2.2  1.0 ! A.1670 at -1.62e+06
assign (resid  84 and name   HA) (resid  84 and name HG2#)  3.0  1.2  0.8 ! A.1671 at -6.15e+06
assign (resid  84 and name   HB) (resid  84 and name HD1#)  4.0  2.2  1.5 ! A.1674 at -2.01e+06
assign (resid  84 and name   HA) (resid  85 and name   HA)  4.0  2.2  1.0 ! A.1673 at -1.85e+06
assign (resid  84 and name HG2#) (resid  85 and name   HA)  3.0  1.2  0.8 ! A.1703 at -8.69e+06
assign (resid  84 and name   HA) (resid  85 and name   HN)  3.0  1.2  0.5 ! A.1719 at  1.41e+07
assign (resid  84 and name   HB) (resid  85 and name   HN)  4.0  2.2  1.0 ! A.1720 at  3.02e+06
assign (resid  84 and name HD1#) (resid  85 and name   HN)  3.0  1.2  1.6 ! A.1721 at  4.95e+06
assign (resid  84 and name HG11) (resid  85 and name   HN)  3.0  1.2  1.3 ! A.1722 at  5.45e+06
assign (resid  84 and name HG12) (resid  85 and name   HN)  3.0  1.2  1.1 ! A.1723 at  3.62e+06
assign (resid  84 and name HG2#) (resid  85 and name   HN)  3.0  1.2  1.0 ! A.1724 at  1.64e+07
assign (resid  84 and name HD1#) (resid  88 and name  HB#)  3.0  1.2  1.3 ! A.1688 at -1.23e+07
assign (resid  84 and name HG2#) (resid  88 and name   HA)  3.0  1.2  1.4 ! A.1704 at -8.15e+06
assign (resid  84 and name HG2#) (resid  88 and name  HB#)  2.5  0.7  1.2 ! A.1705 at -3.69e+07
assign (resid  84 and name HG2#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1785 at  1.41e+07
assign (resid  84 and name HG11) (resid  88 and name  HB#)  2.5  0.7  1.3 ! A.1775 at -2.84e+07
assign (resid  84 and name HD1#) (resid  90 and name HD1#)  3.0  1.2  1.3 ! A.1822 at -6.47e+06
assign (resid  84 and name HD1#) (resid  90 and name HD2#)  3.0  1.2  1.3 ! A.1835 at -8.57e+06

! Q85
assign (resid  85 and name   HN) (resid  85 and name  HB1)  3.0  1.2  0.5 ! A.1726 at  1.30e+07
assign (resid  85 and name   HN) (resid  85 and name  HG1)  3.0  1.2  1.5 ! A.1728 at  1.15e+07
assign (resid  85 and name   HN) (resid  85 and name HE21)  4.0  2.2  1.0 ! A.1727 at  2.64e+06
assign (resid  85 and name   HA) (resid  85 and name  HG1)  3.0  1.2  0.3 ! A.1715 at -7.46e+06
assign (resid  85 and name HE21) (resid  85 and name   HA)  3.0  1.2  0.3 ! A.1732 at  6.65e+06
assign (resid  85 and name HE21) (resid  85 and name  HB1)  3.0  1.2  0.3 ! A.1734 at  1.25e+07
assign (resid  85 and name HE21) (resid  85 and name  HG1)  2.5  0.7  0.2 ! A.1737 at  4.44e+07
assign (resid  85 and name HE22) (resid  85 and name   HA)  3.0  1.2  0.3 ! A.1733 at  6.86e+06
assign (resid  85 and name HE22) (resid  85 and name  HB1)  3.0  1.2  1.5 ! A.1735 at  1.12e+07
assign (resid  85 and name HE22) (resid  85 and name  HG1)  2.5  0.7  1.2 ! A.1738 at  4.15e+07
assign (resid  85 and name   HN) (resid  86 and name   HN)  3.0  1.2  1.3 ! A.1729 at  4.38e+06
assign (resid  85 and name   HA) (resid  86 and name   HN)  3.0  1.2  0.5 ! A.1759 at  1.95e+07
assign (resid  85 and name  HB1) (resid  86 and name   HN)  3.0  1.2  0.5 ! A.1760 at  1.86e+07
assign (resid  85 and name  HG1) (resid  86 and name   HN)  3.0  1.2  0.5 ! A.1761 at  1.06e+07
assign (resid  85 and name   HN) (resid  86 and name  HB#)  4.0  2.2  1.3 ! A.1750 at -4.67e+06
assign (resid  85 and name  HB1) (resid  86 and name  HB#)  3.0  1.2  0.8 ! A.1749 at -1.56e+07
assign (resid  85 and name   HN) (resid  88 and name   HN)  4.0  2.2  1.0 ! A.1731 at  3.04e+06
assign (resid  85 and name   HN) (resid  88 and name  HB#)  3.0  1.2  1.0 ! A.1730 at  9.88e+06
assign (resid  85 and name  HB1) (resid  88 and name  HB#)  3.0  1.2  0.8 ! A.1777 at -2.14e+07

! A86
assign (resid  86 and name   HN) (resid  86 and name  HB#)  3.0  1.2  1.0 ! A.1764 at  2.11e+07
assign (resid  86 and name   HN) (resid  87 and name   HN)  4.0  2.2  1.0 ! A.1765 at  2.81e+06
assign (resid  86 and name  HB#) (resid  87 and name   HA)  3.0  1.2  0.8 ! A.1753 at -9.25e+06
assign (resid  86 and name  HB#) (resid  87 and name   HN)  3.0  1.2  1.0 ! A.1755 at -1.60e+07
assign (resid  86 and name  HB#) (resid  87 and name  HB1)  3.0  1.2  0.8 ! A.1754 at -9.50e+06
assign (resid  86 and name  HB#) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1756 at -8.13e+06
assign (resid  86 and name   HA) (resid  88 and name   HN)  3.0  1.2  0.5 ! A.1786 at  1.11e+07

! D87
assign (resid  87 and name   HA) (resid  88 and name   HN)  2.5  0.7  0.9 ! A.1787 at  8.18e+07
assign (resid  87 and name  HB1) (resid  88 and name   HN)  4.0  2.2  1.0 ! A.1788 at  2.63e+06
assign (resid  87 and name  HB2) (resid  88 and name   HN)  3.0  1.2  1.0 ! A.1789 at  5.97e+07
assign (resid  87 and name   HN) (resid  88 and name  HB#)  2.5  0.7  0.9 ! A.1779 at -2.91e+07

! A88
assign (resid  88 and name   HN) (resid  88 and name  HB#)  2.5  0.7  0.9 ! A.1791 at  3.60e+07
assign (resid  88 and name   HA) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1771 at -1.30e+07
assign (resid  88 and name  HB#) (resid  89 and name   HN)  2.5  0.7  0.9 ! A.1782 at -2.91e+07
assign (resid  88 and name   HN) (resid  89 and name   HN)  4.0  2.2  1.0 ! A.1817 at  2.82e+06
assign (resid  88 and name   HA) (resid  89 and name  HG1)  4.0  2.2  1.8 ! A.1803 at -1.02e+07
assign (resid  88 and name   HN) (resid  90 and name HD2#)  3.0  1.2  2.0 ! A.1792 at  7.89e+06

! K89
assign (resid  89 and name   HN) (resid  89 and name  HB2)  3.0  1.2  0.5 ! A.1819 at  7.89e+06
assign (resid  89 and name   HN) (resid  89 and name  HG2)  3.0  1.2  0.5 ! A.1820 at  7.18e+06
assign (resid  89 and name  HB1) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1794 at -6.10e+06
assign (resid  89 and name  HD1) (resid  89 and name   HA)  3.0  1.2  1.5 ! A.1796 at -2.83e+07
assign (resid  89 and name  HD1) (resid  89 and name   HN)  3.0  1.2  1.2 ! A.1798 at -1.18e+07
assign (resid  89 and name  HE1) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1800 at -1.48e+07
assign (resid  89 and name  HG1) (resid  89 and name   HA)  3.0  1.2  0.8 ! A.1804 at -1.11e+07
assign (resid  89 and name  HG1) (resid  89 and name   HN)  3.0  1.2  0.5 ! A.1812 at -5.89e+06
assign (resid  89 and name  HG1) (resid  89 and name  HE1)  3.0  1.2  0.3 ! A.1810 at -9.51e+06
assign (resid  89 and name  HG2) (resid  89 and name   HA)  3.0  1.2  0.3 ! A.1805 at -9.79e+06
assign (resid  89 and name  HG2) (resid  89 and name  HE1)  3.0  1.2  0.3 ! A.1811 at -1.37e+07
assign (resid  89 and name  HD1) (resid  90 and name   HN)  3.0  1.2  1.1 ! A.1799 at -1.01e+07
assign (resid  89 and name  HG1) (resid  90 and name   HN)  3.0  1.2  1.8 ! A.1814 at -5.77e+06
assign (resid  89 and name   HA) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.1847 at  1.27e+07
assign (resid  89 and name  HB1) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.1848 at  8.35e+06

! L90
assign (resid  90 and name   HN) (resid  90 and name   HG)  3.0  1.2  0.5 ! A.1855 at  1.07e+07
assign (resid  90 and name   HN) (resid  90 and name  HB1)  3.0  1.2  1.0 ! A.1851 at  5.81e+06
assign (resid  90 and name   HN) (resid  90 and name  HB2)  3.0  1.2  0.5 ! A.1852 at  5.15e+06
assign (resid  90 and name   HN) (resid  90 and name HD1#)  3.0  1.2  1.0 ! A.1853 at  1.31e+07
assign (resid  90 and name   HN) (resid  90 and name HD2#)  3.0  1.2  1.0 ! A.1854 at  5.79e+06
assign (resid  90 and name HD1#) (resid  90 and name  HB1)  3.0  1.2  0.8 ! A.1823 at -9.36e+06
assign (resid  90 and name HD1#) (resid  90 and name  HB2)  3.0  1.2  0.8 ! A.1824 at -1.75e+07
assign (resid  90 and name HD2#) (resid  90 and name   HA)  3.0  1.2  0.8 ! A.1836 at -7.37e+06
assign (resid  90 and name HD2#) (resid  90 and name  HB1)  3.0  1.2  0.8 ! A.1837 at -5.38e+06
assign (resid  90 and name HD2#) (resid  90 and name  HB2)  3.0  1.2  0.8 ! A.1838 at -1.30e+07
assign (resid  90 and name HD1#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1828 at -4.28e+06
assign (resid  90 and name HD2#) (resid  91 and name   HN)  3.0  1.2  1.0 ! A.1842 at -4.29e+06
assign (resid  90 and name   HA) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1883 at  1.07e+07
assign (resid  90 and name   HG) (resid  91 and name   HN)  3.0  1.2  1.7 ! A.1888 at  9.00e+06
assign (resid  90 and name   HN) (resid  91 and name   HN)  3.0  1.2  1.2 ! A.1889 at  6.13e+06
assign (resid  90 and name  HB1) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1884 at  7.91e+06
assign (resid  90 and name  HB2) (resid  91 and name   HN)  3.0  1.2  0.5 ! A.1885 at  1.10e+07

! Q91
assign (resid  91 and name   HN) (resid  91 and name  HB1)  3.0  1.2  1.0 ! A.1891 at  1.07e+07
assign (resid  91 and name   HN) (resid  91 and name  HB2)  3.0  1.2  0.5 ! A.1892 at  1.00e+07
assign (resid  91 and name   HN) (resid  91 and name  HG1)  3.0  1.2  0.5 ! A.1893 at  4.88e+06
assign (resid  91 and name   HN) (resid  91 and name  HG2)  3.0  1.2  1.1 ! A.1894 at  5.65e+06
assign (resid  91 and name  HG1) (resid  91 and name   HA)  3.0  1.2  0.3 ! A.1867 at -3.84e+06
assign (resid  91 and name  HG1) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1870 at -2.64e+06
assign (resid  91 and name  HG1) (resid  91 and name HE22)  3.0  1.2  0.3 ! A.1872 at -4.22e+06
assign (resid  91 and name  HG2) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.1868 at -3.16e+06
assign (resid  91 and name  HG2) (resid  91 and name HE21)  4.0  2.2  1.0 ! A.1871 at -2.25e+06
assign (resid  91 and name  HG2) (resid  91 and name HE22)  3.0  1.2  1.0 ! A.1873 at -4.54e+06
assign (resid  91 and name HE21) (resid  91 and name   HA)  4.0  2.2  1.0 ! A.1900 at  1.96e+06
assign (resid  91 and name HE21) (resid  91 and name  HB2)  3.0  1.2  0.3 ! A.1901 at  7.58e+06
assign (resid  91 and name HE22) (resid  91 and name   HN)  4.0  2.2  1.0 ! A.1909 at  2.27e+06
assign (resid  91 and name HE22) (resid  91 and name  HB2)  3.0  1.2  0.3 ! A.1902 at  9.41e+06
assign (resid  91 and name   HA) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.1860 at -1.97e+06
assign (resid  91 and name  HB2) (resid  92 and name   HN)  3.0  1.2  0.5 ! A.1919 at  3.85e+06
assign (resid  91 and name  HG2) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.1920 at  3.05e+06
assign (resid  91 and name  HB2) (resid  93 and name   HB)  4.0  2.2  1.0 ! A.1926 at -3.20e+06

! F92
assign (resid  92 and name   HN) (resid  92 and name  HB1)  4.0  2.2  1.0 ! A.1922 at  2.52e+06
assign (resid  92 and name   HN) (resid  92 and name  HB2)  3.0  1.2  0.5 ! A.1923 at  3.89e+06
assign (resid  92 and name   HA) (resid  93 and name   HN)  3.0  1.2  0.5 ! A.1934 at  7.04e+06
assign (resid  92 and name  HB1) (resid  93 and name   HN)  3.0  1.2  1.1 ! A.1935 at  3.22e+06
assign (resid  92 and name  HB2) (resid  93 and name   HN)  3.0  1.2  1.0 ! A.1936 at  3.89e+06

! T93
assign (resid  93 and name   HN) (resid  93 and name HG2#)  3.0  1.2  1.0 ! A.1937 at  8.86e+06
assign (resid  93 and name   HB) (resid  93 and name   HN)  4.0  2.2  1.0 ! A.1929 at -2.22e+06
assign (resid  93 and name HG2#) (resid  94 and name  HD1)  4.0  2.2  1.5 ! A.1939 at -2.76e+06
assign (resid  93 and name   HA) (resid  94 and name  HG1)  4.0  2.2  1.0 ! A.1940 at -3.02e+06

! P94

! added from free form
assign (resid  49 and name HG2#) (resid  58 and name   HN)  4.0  2.2  1.2 ! A.1973 at -8.12e+05
assign (resid  49 and name HG2#) (resid  58 and name  HB1)  4.0  2.2  1.5 ! A.1961 at  6.14e+05
assign (resid  49 and name HG2#) (resid  58 and name  HB2)  4.0  2.2  2.5 ! A.1962 at  4.54e+05
assign (resid  49 and name   HA) (resid  58 and name  HE1)  4.0  2.2  1.0 ! A.1985 at -5.57e+05
assign (resid  49 and name   HB) (resid  58 and name  HE1)  4.0  2.2  1.0 ! A.1986 at -6.02e+05
assign (resid  49 and name HG1#) (resid  58 and name  HE1)  2.5  0.7  0.7 ! A.1987 at -3.94e+06
assign (resid  49 and name HG2#) (resid  58 and name  HE1)  2.5  0.7  0.7 ! A.1988 at -3.15e+06

assign (resid  52 and name   HN) (resid  52 and name   HG)  3.0  1.2  1.2 ! A.1839 at -1.89e+06
assign (resid  52 and name   HN) (resid  52 and name  HB1)  2.5  0.7  0.4 ! A.1837 at -1.14e+06
assign (resid  52 and name   HN) (resid  52 and name HD1#)  2.5  0.7  1.4 ! A.1838 at -1.10e+06
assign (resid  52 and name   HA) (resid  52 and name HD1#)  2.5  0.7  0.7 ! A.1810 at  1.83e+06
assign (resid  52 and name  HB1) (resid  52 and name HD1#)  4.0  2.2  2.5 ! A.1814 at  2.29e+05
assign (resid  52 and name   HN) (resid  53 and name   HA)  4.0  2.2  2.0 ! A.1840 at -1.72e+05
assign (resid  52 and name   HN) (resid  53 and name   HN)  2.5  0.7  0.4 ! A.1857 at -1.51e+06
assign (resid  52 and name   HA) (resid  53 and name   HN)  2.5  0.7  0.9 ! A.1853 at -1.96e+06
assign (resid  52 and name   HG) (resid  53 and name   HN)  3.0  1.2  1.4 ! A.1856 at -8.09e+05
assign (resid  52 and name  HB1) (resid  53 and name   HN)  2.5  0.7  0.4 ! A.1854 at -1.87e+06
assign (resid  52 and name HD1#) (resid  53 and name   HN)  3.0  1.2  1.3 ! A.1855 at -1.71e+06
assign (resid  52 and name   HN) (resid  54 and name HG1#)  4.0  2.2  1.5 ! A.1833 at -5.78e+05
assign (resid  52 and name HD1#) (resid  54 and name   HB)  4.0  2.2  2.1 ! A.1810 at  7.37e+05
assign (resid  52 and name HD1#) (resid  54 and name HG1#)  3.0  1.2  1.5 ! A.1811 at  3.28e+06
assign (resid  52 and name   HA) (resid  54 and name HG1#)  4.0  2.2  1.5 ! A.1868 at  5.67e+05
assign (resid  52 and name   HG) (resid  54 and name HG1#)  2.5  0.7  0.7 ! A.1869 at  1.40e+06
assign (resid  52 and name   HG) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1991 at -3.96e+05
assign (resid  52 and name  HB1) (resid  58 and name  HE1)  2.5  0.7  1.4 ! A.1989 at -1.29e+06
assign (resid  52 and name HD1#) (resid  58 and name  HE1)  4.0  2.2  2.5 ! A.1990 at -4.00e+05

assign (resid  53 and name   HN) (resid  53 and name  HB1)  2.5  0.7  1.1 ! A.1859 at -2.85e+06
assign (resid  53 and name   HN) (resid  53 and name  HB2)  2.5  0.7  0.4 ! A.1860 at -2.51e+06
assign (resid  53 and name   HN) (resid  54 and name   HB)  4.0  2.2  2.0 ! A.1861 at -3.14e+05
assign (resid  53 and name   HN) (resid  54 and name   HN)  2.5  0.7  0.4 ! A.1862 at -1.40e+06
assign (resid  53 and name   HN) (resid  54 and name HG1#)  3.0  1.2  1.4 ! A.1852 at -1.47e+06
assign (resid  53 and name   HA) (resid  54 and name   HN)  3.0  1.2  0.5 ! A.1876 at -9.86e+05
assign (resid  53 and name  HB2) (resid  54 and name   HN)  4.0  2.2  2.0 ! A.1877 at -2.63e+05
assign (resid  53 and name  HB2) (resid  54 and name   HB)  4.0  2.2  1.6 ! A.1860 at  6.73e+05
assign (resid  53 and name   HA) (resid  54 and name HG1#)  2.5  0.7  1.2 ! A.1865 at  1.27e+06
assign (resid  53 and name  HB1) (resid  54 and name HG1#)  3.0  1.2  1.2 ! A.1866 at  1.15e+06
assign (resid  53 and name  HB2) (resid  54 and name HG1#)  4.0  2.2  2.5 ! A.1867 at  2.97e+05
assign (resid  53 and name   HN) (resid  56 and name   HN)  4.0  2.2  2.2 ! A.1854 at -7.05e+05

assign (resid  54 and name   HN) (resid  54 and name   HB)  4.0  2.2  2.0 ! A.1878 at -1.70e+05
assign (resid  54 and name   HA) (resid  54 and name HG1#)  2.5  0.7  0.7 ! A.1864 at  5.31e+06
assign (resid  54 and name HG1#) (resid  54 and name   HN)  2.5  0.7  0.9 ! A.1874 at  1.66e+06
assign (resid  54 and name   HA) (resid  55 and name   HN)  4.0  2.2  1.0 ! A.1858 at  6.62e+05
assign (resid  54 and name HG1#) (resid  55 and name   HN)  3.0  1.2  1.0 ! A.1872 at  8.84e+05
assign (resid  54 and name   HA) (resid  56 and name   HN)  2.5  0.7  1.3 ! A.1928 at -1.75e+06
assign (resid  54 and name HG1#) (resid  56 and name   HN)  3.0  1.2  1.1 ! A.1875 at  1.16e+06
assign (resid  54 and name   HA) (resid  56 and name  HB1)  4.0  2.2  2.0 ! A.1890 at  1.38e+05
assign (resid  54 and name   HA) (resid  56 and name  HB2)  4.0  2.2  2.0 ! A.1891 at  2.72e+05
assign (resid  54 and name   HA) (resid  58 and name  HE1)  3.0  1.2  1.8 ! A.1992 at -9.15e+05
assign (resid  54 and name   HB) (resid  58 and name  HE1)  4.0  2.2  1.0 ! A.1993 at -5.15e+05

assign (resid  55 and name   HN) (resid  56 and name   HN)  4.0  2.2  2.0 ! A.1927 at -2.65e+05
assign (resid  55 and name   HN) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1993 at -1.78e+05

assign (resid  56 and name   HN) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1939 at -3.01e+05
assign (resid  56 and name   HA) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1889 at  1.97e+05
assign (resid  56 and name  HB2) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1910 at  2.95e+05
assign (resid  56 and name  HB1) (resid  58 and name  HE1)  2.5  0.7  0.2 ! A.1996 at -2.43e+06

assign (resid  57 and name   HN) (resid  58 and name   HN)  4.0  2.2  2.0 ! A.1956 at -1.70e+05
assign (resid  57 and name   HN) (resid  58 and name  HB2)  4.0  2.2  2.0 ! A.1955 at -2.48e+05
assign (resid  57 and name   HA) (resid  58 and name   HN)  2.5  0.7  0.4 ! A.1974 at -5.69e+06
assign (resid  57 and name  HB1) (resid  58 and name   HN)  3.0  1.2  1.2 ! A.1975 at -8.91e+05
assign (resid  57 and name  HB2) (resid  58 and name   HN)  3.0  1.2  1.4 ! A.1976 at -8.95e+05
assign (resid  57 and name  HB2) (resid  58 and name   HA)  4.0  2.2  1.6 ! A.1957 at  6.02e+05
assign (resid  57 and name   HN) (resid  58 and name  HE1)  4.0  2.2  2.0 ! A.1997 at -4.56e+05
assign (resid  57 and name   HA) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2025 at -2.58e+05 

assign (resid  58 and name   HN) (resid  58 and name  HB1)  2.5  0.7  1.0 ! A.1979 at -1.13e+06
assign (resid  58 and name   HN) (resid  58 and name  HB2)  2.5  0.7  0.4 ! A.1980 at -1.51e+06
assign (resid  58 and name  HE1) (resid  58 and name   HA)  4.0  2.2  1.5 ! A.1998 at -5.47e+05
assign (resid  58 and name  HE1) (resid  58 and name   HN)  4.0  2.2  2.0 ! A.2001 at -3.96e+05
assign (resid  58 and name  HE1) (resid  58 and name  HB1)  4.0  2.2  2.0 ! A.1999 at -3.36e+05
assign (resid  58 and name  HE1) (resid  58 and name  HB2)  4.0  2.2  1.2 ! A.2000 at -1.21e+06
assign (resid  58 and name   HN) (resid  59 and name   HA)  4.0  2.2  2.0 ! A.1981 at -2.75e+05
assign (resid  58 and name   HN) (resid  59 and name   HN)  2.5  0.7  0.4 ! A.1983 at -1.33e+06
assign (resid  58 and name   HN) (resid  59 and name  HB2)  4.0  2.2  2.0 ! A.1982 at -3.11e+05
assign (resid  58 and name  HB1) (resid  59 and name   HN)  3.0  1.2  0.5 ! A.2012 at -8.26e+05
assign (resid  58 and name  HB2) (resid  59 and name   HN)  2.5  0.7  0.4 ! A.2013 at -1.53e+06
assign (resid  58 and name   HA) (resid  59 and name   HN)  2.5  0.7  1.0 ! A.2011 at -3.97e+06
assign (resid  58 and name  HB1) (resid  61 and name  HB1)  4.0  2.2  2.0 ! A.1971 at  2.11e+05
assign (resid  58 and name  HB2) (resid  61 and name  HB1)  4.0  2.2  2.6 ! A.1972 at  1.60e+05
assign (resid  58 and name  HB1) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2044 at -2.90e+05
assign (resid  58 and name  HB2) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2045 at -3.14e+05
assign (resid  58 and name   HA) (resid  61 and name   HA)  4.0  2.2  2.0 ! A.2033 at  3.49e+05

assign (resid  59 and name   HN) (resid  60 and name   HN)  3.0  1.2  0.5 ! A.2019 at -9.75e+05
assign (resid  59 and name   HN) (resid  60 and name  HB1)  4.0  2.2  1.0 ! A.2018 at -7.19e+05
assign (resid  59 and name   HA) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2026 at -1.93e+05
assign (resid  59 and name  HB1) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2027 at -1.44e+05
assign (resid  59 and name  HB2) (resid  60 and name   HN)  4.0  2.2  2.0 ! A.2028 at -1.45e+05
assign (resid  59 and name   HN) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2020 at -4.01e+05
assign (resid  59 and name   HA) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2046 at -3.53e+05
assign (resid  59 and name  HB2) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.2047 at -3.35e+05

assign (resid  60 and name   HN) (resid  61 and name   HN)  2.5  0.7  0.4 ! A.2050 at -1.02e+06
assign (resid  60 and name   HA) (resid  61 and name   HN)  2.5  0.7  1.0 ! A.2048 at -1.04e+06
assign (resid  60 and name  HB1) (resid  61 and name   HN)  2.5  0.7  0.9 ! A.2049 at -1.20e+06


!@ END_XPLR_NOE_FILE
# Restraints file 5: D_1000242893_mr_P1.xplor-nih.V1
!@ BEGIN_XPLR_PCK_SUM
! LBL   File-Name                             All  Intra   Seq.  Short   Long
! A   c-noesyf0.PCK                            35     0      0      0     35
!    Total                                     35     0      0      0     35

!@ END_XPLR_PCK_SUM
!@ BEGIN_XPLR_NOE_FILE
! G-6

! A-5

! M-4

! D-3

! P-2

! E-1

! F0

! M1

! A2

! L3

! D4

! G5

! I6

! R7

! M8

! P9

! D10

! G11

! C12

! Y13

! A14

! D15

! G16

! T17

! W18

! E19

! L20

! S21

! V22

! H23

! V24

! T25

! D26

! L27

! N28

! R29

! D30

! V31

! T32

! L33

! R34

! V35

! T36

! G37

! E38

! V39

! H40

! I41
assign (resid  41 and name HD1#) (resid 602 and name  HE2)  4.0  2.2  1.5 ! A.1    at -2.03e+06
assign (resid  41 and name HG2#) (resid 602 and name  HE2)  4.0  2.2  1.5 ! A.2    at -2.53e+06

! G42

! G43

! V44

! M45
assign (resid  45 and name  HE#) (resid 577 and name  HD1)  3.0  1.2  0.8 ! A.3    at -2.61e+07
assign (resid  45 and name  HE#) (resid 602 and name   HA)  3.0  1.2  0.8 ! A.4    at -4.26e+06
assign (resid  45 and name  HE#) (resid 602 and name  HB2)  3.0  1.2  0.8 ! A.5    at -8.86e+06
assign (resid  45 and name  HE#) (resid 602 and name  HE1)  3.0  1.2  0.8 ! A.6    at -1.26e+07
assign (resid  45 and name  HE#) (resid 602 and name  HG2)  3.0  1.2  0.8 ! A.7    at -8.21e+06
assign (resid  45 and name  HE#) (resid 603 and name   HA)  3.0  1.2  0.8 ! A.8    at -4.96e+06
assign (resid  45 and name  HE#) (resid 603 and name   HG)  4.0  2.2  1.5 ! A.10   at -2.29e+06
assign (resid  45 and name  HE#) (resid 603 and name HD1#)  3.0  1.2  1.3 ! A.9    at -2.11e+07

!assign (resid  45 and name  HE#) (resid 602 and name  HE1)  3.0  1.2  0.8 ! A.8    at -1.58e+06
!assign (resid  45 and name  HE#) (resid 603 and name HD1#)  3.0  1.2  1.3 ! A.11   at -4.88e+06

! L46
assign (resid  46 and name HD1#) (resid 577 and name  HB2)  4.0  2.2  1.5 ! A.12   at -1.50e+06
assign (resid  46 and name HD1#) (resid 577 and name  HD1)  4.0  2.2  1.5 ! A.13   at -1.64e+06
assign (resid  46 and name HD1#) (resid 593 and name  HE1)  4.0  2.2  2.5 ! A.14   at -1.05e+06
assign (resid  46 and name  HB2) (resid 603 and name HD1#)  4.0  2.2  2.5 ! A.11   at -9.51e+05
assign (resid  46 and name HD1#) (resid 603 and name   HA)  4.0  2.2  1.5 ! A.15   at -1.25e+06
!assign (resid  46 and name HD1#) (resid 603 and name HD1#)  4.0  2.2  2.0 ! A.16   at -2.79e+06
assign (resid  46 and name HD1#) (resid 604 and name  HD1)  3.0  1.2  0.8 ! A.17   at -4.88e+06
assign (resid  46 and name HD1#) (resid 604 and name  HE1)  3.0  1.2  0.8 ! A.18   at -5.02e+06

assign (resid  46 and name   HA) (resid 603 and name HD1#)  3.0  1.2  0.8 ! A.12   at -1.96e+06
assign (resid  46 and name HD1#) (resid 603 and name HD1#)  3.0  1.2  1.3 ! A.13   at -3.93e+06
assign (resid  46 and name HD1#) (resid 603 and name HD2#)  4.0  2.2  2.0 ! A.14   at -1.22e+06
assign (resid  46 and name HD2#) (resid 593 and name  HE1)  4.0  2.2  1.5 ! A.9    at -1.13e+06

! K47

! L48

! V49

! E50
!assign (resid  50 and name  HG2) (resid 577 and name  HB2)  4.0  2.2  1.0 ! A.19   at -1.49e+06
assign (resid  50 and name  HG2) (resid 593 and name  HE1)  4.0  2.2  1.0 ! A.20   at -1.49e+06
!assign (resid  50 and name  HG2) (resid 593 and name  HE1)  3.0  1.2  0.3 ! A.10   at -1.48e+06

! K51

! L52

! D53

! V54

! K55
assign (resid  55 and name  HD1) (resid 574 and name HG2#)  4.0  2.2  1.5 ! A.22   at -1.29e+06
assign (resid  55 and name  HE1) (resid 574 and name HG2#)  3.0  1.2  0.8 ! A.25   at -4.61e+06
!assign (resid  55 and name  HB1) (resid 579 and name HD1#)  4.0  2.2  1.5 ! A.21   at -1.44e+06
assign (resid  55 and name  HD1) (resid 579 and name   HA)  4.0  2.2  2.0 ! A.23   at -8.76e+05
assign (resid  55 and name  HD1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.24   at -5.98e+06
assign (resid  55 and name  HE1) (resid 579 and name   HA)  4.0  2.2  1.0 ! A.26   at -2.10e+06
assign (resid  55 and name  HE1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.27   at -9.95e+06
assign (resid  55 and name  HG1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.28   at -5.70e+06
assign (resid  55 and name  HG2) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.29   at -4.65e+06

!assign (resid  55 and name  HE1) (resid 574 and name HG2#)  3.0  1.2  0.8 ! A.1    at -2.09e+06
assign (resid  55 and name   HA) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.2    at -1.66e+06
assign (resid  55 and name  HB1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.3    at -3.99e+06
!assign (resid  55 and name  HD1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.4    at -5.60e+06
!assign (resid  55 and name  HE1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.5    at -3.43e+06
!assign (resid  55 and name  HG1) (resid 579 and name HD1#)  3.0  1.2  0.8 ! A.6    at -3.13e+06
assign (resid  55 and name  HG1) (resid 579 and name HD2#)  3.0  1.2  0.8 ! A.8    at -2.84e+06

! K56
assign (resid  56 and name   HA) (resid 579 and name HD1#)  4.0  2.2  1.5 ! A.7    at -1.31e+06

! D57

! W58

! S59
assign (resid  59 and name   HA) (resid 577 and name  HD1)  4.0  2.2  1.0 ! A.30   at -1.47e+06

! D60

! H61

! A62

! L63

! W64

! W65

! E66

! K67

! K68

! R69

! T70

! W71

! L72

! L73

! K74

! T75
assign (resid  75 and name HG2#) (resid 602 and name   HA)  4.0  2.2  1.5 ! A.31   at -2.18e+06
assign (resid  75 and name HG2#) (resid 602 and name  HE1)  4.0  2.2  1.5 ! A.32   at -1.72e+06
assign (resid  75 and name HG2#) (resid 602 and name  HG2)  4.0  2.2  1.5 ! A.33   at -2.48e+06
assign (resid  75 and name HG2#) (resid 603 and name   HA)  4.0  2.2  1.5 ! A.34   at -1.26e+06
assign (resid  75 and name HG2#) (resid 603 and name HD1#)  4.0  2.2  2.0 ! A.35   at -1.43e+06

!assign (resid  75 and name HG2#) (resid 602 and name  HE1)  4.0  2.2  1.5 ! A.9    at -1.16e+06
assign (resid  75 and name HG2#) (resid 602 and name  HE2)  4.0  2.2  1.5 ! A.10   at -6.73e+05

! H76

! W77

! T78

! L79

! D80

! K81

! Y82

! G83

! I84

! Q85

! A86

! D87

! A88

! K89

! L90

! Q91

! F92

! T93

! P94


! Y541

! H542

! E543

! R544

! R545

! G546

! S547

! L548

! C549

! S550

! G551

! C552

! Q553

! K554

! P555

! I556

! T557

! G558

! R559

! C560

! I561

! T562

! A563

! M564

! A565

! K566

! K567

! F568

! H569

! P570

! E571

! H572

! F573

! V574

! C575

! A576

! F577

! C578

! L579

! K580

! Q581

! L582

! N583

! K584

! G585

! T586

! F587

! K588

! E589

! Q590

! N591

! D592

! K593

! P594

! Y595

! C596

! Q597

! N598

! C599

! F600

! L601

! K602

! L603

! F604

! C605


!@ END_XPLR_NOE_FILE
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           HT1      MET   1  86.561 -23.217  14.178
    2    HA   MET   1           HA       MET   1  87.854 -23.884  15.990
    3    HB2  MET   1           HB2      MET   1  89.095 -25.027  13.470
    4    HB3  MET   1           HB1      MET   1  89.203 -25.750  15.078
    5    HG2  MET   1           HG2      MET   1  86.616 -25.119  13.721
    6    HG3  MET   1           HG1      MET   1  87.426 -26.669  13.547
    7    HE1  MET   1           HE1      MET   1  84.946 -28.116  15.916
    8    HE2  MET   1           HE2      MET   1  86.177 -28.475  14.709
    9    HE3  MET   1           HE3      MET   1  84.904 -27.315  14.339
   10    H    ALA   2           HN       ALA   2  90.563 -24.527  14.166
   11    HA   ALA   2           HA       ALA   2  92.098 -22.101  14.840
   12    HB1  ALA   2           HB1      ALA   2  92.936 -24.730  16.075
   13    HB2  ALA   2           HB2      ALA   2  92.011 -23.516  16.960
   14    HB3  ALA   2           HB3      ALA   2  93.628 -23.134  16.367
   15    H    LEU   3           HN       LEU   3  92.378 -25.541  14.001
   16    HA   LEU   3           HA       LEU   3  94.760 -25.675  12.634
   17    HB2  LEU   3           HB2      LEU   3  92.055 -26.837  11.963
   18    HB3  LEU   3           HB1      LEU   3  93.489 -27.249  11.027
   19    HG   LEU   3           HG       LEU   3  93.284 -27.557  14.037
   20   HD11  LEU   3          HD11      LEU   3  91.702 -29.084  13.119
   21   HD12  LEU   3          HD12      LEU   3  93.154 -30.038  13.421
   22   HD13  LEU   3          HD13      LEU   3  92.773 -29.505  11.783
   23   HD21  LEU   3          HD21      LEU   3  95.564 -27.568  13.643
   24   HD22  LEU   3          HD22      LEU   3  95.395 -28.120  11.978
   25   HD23  LEU   3          HD23      LEU   3  95.230 -29.263  13.309
   26    H    ASP   4           HN       ASP   4  91.850 -25.414  10.758
   27    HA   ASP   4           HA       ASP   4  91.311 -24.290   8.834
   28    HB2  ASP   4           HB2      ASP   4  91.392 -22.270  10.080
   29    HB3  ASP   4           HB1      ASP   4  93.148 -22.281  10.117
   30    H    GLY   5           HN       GLY   5  94.347 -25.474   9.432
   31    HA2  GLY   5           HA2      GLY   5  95.397 -26.662   7.497
   32    HA3  GLY   5           HA1      GLY   5  95.126 -25.191   6.566
   33    H    ILE   6           HN       ILE   6  95.732 -23.863   9.277
   34    HA   ILE   6           HA       ILE   6  98.714 -23.823   8.938
   35    HB   ILE   6           HB       ILE   6  98.067 -21.438  10.208
   36   HG12  ILE   6          HG12      ILE   6  95.609 -22.140   9.786
   37   HG13  ILE   6          HG11      ILE   6  96.084 -20.525   9.309
   38   HG21  ILE   6          HG21      ILE   6  98.226 -20.446   7.866
   39   HG22  ILE   6          HG22      ILE   6  98.390 -22.107   7.294
   40   HG23  ILE   6          HG23      ILE   6  99.582 -21.435   8.407
   41   HD11  ILE   6          HD11      ILE   6  95.747 -20.941   7.098
   42   HD12  ILE   6          HD12      ILE   6  94.771 -22.286   7.680
   43   HD13  ILE   6          HD13      ILE   6  96.436 -22.561   7.183
   44    H    ARG   7           HN       ARG   7  97.368 -22.128  11.649
   45    HA   ARG   7           HA       ARG   7  97.592 -24.409  13.463
   46    HB2  ARG   7           HB2      ARG   7  99.377 -23.207  14.821
   47    HB3  ARG   7           HB1      ARG   7  99.907 -23.947  13.317
   48    HG2  ARG   7           HG2      ARG   7  99.014 -21.125  13.022
   49    HG3  ARG   7           HG1      ARG   7 100.443 -21.340  14.025
   50    HD2  ARG   7           HD2      ARG   7 101.660 -22.367  12.269
   51    HD3  ARG   7           HD1      ARG   7 100.207 -22.621  11.311
   52    HE   ARG   7           HE       ARG   7 100.363 -20.385  10.558
   53   HH11  ARG   7          HH11      ARG   7 101.417 -18.392  10.433
   54   HH12  ARG   7          HH12      ARG   7 102.643 -18.001  11.592
   55   HH21  ARG   7          HH21      ARG   7 102.364 -21.008  13.295
   56   HH22  ARG   7          HH22      ARG   7 103.180 -19.483  13.213
   57    H    MET   8           HN       MET   8  98.398 -21.252  14.686
   58    HA   MET   8           HA       MET   8  95.559 -20.660  15.282
   59    HB2  MET   8           HB2      MET   8  96.882 -20.325  17.795
   60    HB3  MET   8           HB1      MET   8  95.611 -21.458  17.388
   61    HG2  MET   8           HG2      MET   8  97.187 -23.132  16.685
   62    HG3  MET   8           HG1      MET   8  98.541 -22.033  16.824
   63    HE1  MET   8           HE1      MET   8  96.748 -24.815  18.308
   64    HE2  MET   8           HE2      MET   8  95.544 -23.618  18.776
   65    HE3  MET   8           HE3      MET   8  96.458 -24.469  20.018
   66    HA   PRO   9           HA       PRO   9  98.237 -16.680  16.597
   67    HB2  PRO   9           HB2      PRO   9 100.568 -17.557  14.894
   68    HB3  PRO   9           HB1      PRO   9 100.553 -16.434  16.274
   69    HG2  PRO   9           HG2      PRO   9 101.375 -18.910  16.606
   70    HG3  PRO   9           HG1      PRO   9 100.325 -18.142  17.811
   71    HD2  PRO   9           HD2      PRO   9  99.635 -20.251  15.817
   72    HD3  PRO   9           HD1      PRO   9  98.977 -19.954  17.421
   73    H    ASP  10           HN       ASP  10  98.441 -18.535  13.688
   74    HA   ASP  10           HA       ASP  10  97.489 -16.209  12.036
   75    HB2  ASP  10           HB2      ASP  10  99.806 -17.244  11.522
   76    HB3  ASP  10           HB1      ASP  10  98.910 -18.647  10.946
   77    H    GLY  11           HN       GLY  11  97.052 -19.473  13.062
   78    HA2  GLY  11           HA2      GLY  11  94.850 -19.976  11.150
   79    HA3  GLY  11           HA1      GLY  11  95.491 -21.120  12.323
   80    H    CYS  12           HN       CYS  12  94.992 -18.040  13.616
   81    HA   CYS  12           HA       CYS  12  92.186 -18.351  14.323
   82    HB2  CYS  12           HB2      CYS  12  93.009 -20.006  15.857
   83    HB3  CYS  12           HB1      CYS  12  94.344 -18.965  16.350
   84    HG   CYS  12           HG       CYS  12  91.714 -17.594  16.921
   85    H    TYR  13           HN       TYR  13  95.034 -17.011  16.004
   86    HA   TYR  13           HA       TYR  13  95.682 -14.778  16.332
   87    HB2  TYR  13           HB2      TYR  13  94.396 -14.465  14.001
   88    HB3  TYR  13           HB1      TYR  13  93.183 -13.704  15.028
   89    HD1  TYR  13           HD1      TYR  13  93.922 -11.822  16.597
   90    HD2  TYR  13           HD2      TYR  13  96.370 -13.301  13.391
   91    HE1  TYR  13           HE1      TYR  13  95.273  -9.743  16.669
   92    HE2  TYR  13           HE2      TYR  13  97.721 -11.224  13.465
   93    HH   TYR  13           HH       TYR  13  97.934  -9.203  14.358
   94    H    ALA  14           HN       ALA  14  92.223 -15.468  16.524
   95    HA   ALA  14           HA       ALA  14  91.776 -15.566  19.199
   96    HB1  ALA  14           HB1      ALA  14  91.023 -13.009  19.549
   97    HB2  ALA  14           HB2      ALA  14  92.308 -12.739  18.370
   98    HB3  ALA  14           HB3      ALA  14  92.670 -13.536  19.898
   99    H    ASP  15           HN       ASP  15  90.742 -13.949  16.265
  100    HA   ASP  15           HA       ASP  15  88.201 -15.327  16.338
  101    HB2  ASP  15           HB2      ASP  15  87.929 -13.383  17.976
  102    HB3  ASP  15           HB1      ASP  15  88.050 -12.322  16.572
  103    H    GLY  16           HN       GLY  16  90.660 -13.929  14.682
  104    HA2  GLY  16           HA2      GLY  16  90.943 -13.768  12.337
  105    HA3  GLY  16           HA1      GLY  16  89.217 -14.075  12.143
  106    H    THR  17           HN       THR  17  90.436 -11.580  14.289
  107    HA   THR  17           HA       THR  17  89.012  -9.567  12.628
  108    HB   THR  17           HB       THR  17  88.375  -9.261  14.867
  109    HG1  THR  17           HG1      THR  17  89.321  -7.359  15.425
  110   HG21  THR  17          HG21      THR  17  90.125  -9.253  16.708
  111   HG22  THR  17          HG22      THR  17  91.251  -9.901  15.515
  112   HG23  THR  17          HG23      THR  17  89.816 -10.821  15.965
  113    H    TRP  18           HN       TRP  18  90.111  -8.266  11.366
  114    HA   TRP  18           HA       TRP  18  92.961  -7.598  11.962
  115    HB2  TRP  18           HB2      TRP  18  92.829  -7.414   9.214
  116    HB3  TRP  18           HB1      TRP  18  93.482  -8.793  10.082
  117    HD1  TRP  18           HD1      TRP  18  89.902  -7.661   9.094
  118    HE1  TRP  18           HE1      TRP  18  88.662  -9.719   8.162
  119    HE3  TRP  18           HE3      TRP  18  93.569 -11.182   9.549
  120    HZ2  TRP  18           HZ2      TRP  18  89.159 -12.494   7.675
  121    HZ3  TRP  18           HZ3      TRP  18  93.162 -13.521   8.843
  122    HH2  TRP  18           HH2      TRP  18  90.963 -14.182   7.908
  123    H    GLU  19           HN       GLU  19  93.097  -5.436  12.266
  124    HA   GLU  19           HA       GLU  19  90.859  -3.727  11.556
  125    HB2  GLU  19           HB2      GLU  19  92.963  -1.985  12.210
  126    HB3  GLU  19           HB1      GLU  19  91.735  -2.583  13.319
  127    HG2  GLU  19           HG2      GLU  19  94.035  -2.963  14.145
  128    HG3  GLU  19           HG1      GLU  19  93.133  -4.462  13.920
  129    H    LEU  20           HN       LEU  20  90.569  -2.642   9.704
  130    HA   LEU  20           HA       LEU  20  92.634  -2.843   7.625
  131    HB2  LEU  20           HB2      LEU  20  89.794  -2.632   7.665
  132    HB3  LEU  20           HB1      LEU  20  90.357  -1.148   6.912
  133    HG   LEU  20           HG       LEU  20  90.005  -2.790   5.182
  134   HD11  LEU  20          HD11      LEU  20  92.247  -1.333   5.351
  135   HD12  LEU  20          HD12      LEU  20  91.947  -2.459   4.028
  136   HD13  LEU  20          HD13      LEU  20  92.983  -2.939   5.367
  137   HD21  LEU  20          HD21      LEU  20  90.408  -4.739   6.925
  138   HD22  LEU  20          HD22      LEU  20  92.069  -4.650   6.345
  139   HD23  LEU  20          HD23      LEU  20  90.762  -5.000   5.221
  140    H    SER  21           HN       SER  21  93.968  -1.172   7.040
  141    HA   SER  21           HA       SER  21  94.061   1.146   8.813
  142    HB2  SER  21           HB2      SER  21  96.009  -0.147   7.531
  143    HB3  SER  21           HB1      SER  21  95.643   1.032   6.273
  144    HG   SER  21           HG       SER  21  96.233   2.639   7.595
  145    H    VAL  22           HN       VAL  22  93.595   3.265   8.263
  146    HA   VAL  22           HA       VAL  22  92.398   3.739   5.583
  147    HB   VAL  22           HB       VAL  22  91.057   4.233   8.240
  148   HG11  VAL  22          HG11      VAL  22  89.333   5.485   6.850
  149   HG12  VAL  22          HG12      VAL  22  90.542   5.571   5.567
  150   HG13  VAL  22          HG13      VAL  22  90.842   6.351   7.121
  151   HG21  VAL  22          HG21      VAL  22  90.176   3.020   5.604
  152   HG22  VAL  22          HG22      VAL  22  89.186   3.126   7.064
  153   HG23  VAL  22          HG23      VAL  22  90.630   2.110   7.049
  154    H    HIS  23           HN       HIS  23  93.849   5.111   4.795
  155    HA   HIS  23           HA       HIS  23  95.104   7.202   6.416
  156    HB2  HIS  23           HB2      HIS  23  95.187   6.288   3.561
  157    HB3  HIS  23           HB1      HIS  23  95.829   7.882   3.958
  158    HD1  HIS  23           HD1      HIS  23  98.300   7.711   4.217
  159    HD2  HIS  23           HD2      HIS  23  96.373   4.364   5.787
  160    HE1  HIS  23           HE1      HIS  23 100.109   6.243   5.211
  161    H    VAL  24           HN       VAL  24  93.615   8.802   7.066
  162    HA   VAL  24           HA       VAL  24  91.462   9.544   5.254
  163    HB   VAL  24           HB       VAL  24  92.404  11.222   7.584
  164   HG11  VAL  24          HG11      VAL  24  90.670  12.239   6.274
  165   HG12  VAL  24          HG12      VAL  24  89.879  11.575   7.706
  166   HG13  VAL  24          HG13      VAL  24  89.778  10.733   6.166
  167   HG21  VAL  24          HG21      VAL  24  90.688   9.797   8.886
  168   HG22  VAL  24          HG22      VAL  24  92.263   9.068   8.575
  169   HG23  VAL  24          HG23      VAL  24  90.875   8.617   7.592
  170    H    THR  25           HN       THR  25  91.738  10.784   3.504
  171    HA   THR  25           HA       THR  25  94.188  12.395   3.235
  172    HB   THR  25           HB       THR  25  93.708  12.450   0.960
  173    HG1  THR  25           HG1      THR  25  91.073  12.608   1.866
  174   HG21  THR  25          HG21      THR  25  91.999  10.107   1.835
  175   HG22  THR  25          HG22      THR  25  93.759  10.076   1.781
  176   HG23  THR  25          HG23      THR  25  92.836  10.286   0.294
  177    H    ASP  26           HN       ASP  26  90.810  12.882   3.974
  178    HA   ASP  26           HA       ASP  26  90.868  15.760   3.460
  179    HB2  ASP  26           HB2      ASP  26  88.778  14.290   3.444
  180    HB3  ASP  26           HB1      ASP  26  88.901  14.253   5.204
  181    H    LEU  27           HN       LEU  27  92.143  13.749   5.808
  182    HA   LEU  27           HA       LEU  27  92.416  16.021   7.753
  183    HB2  LEU  27           HB2      LEU  27  91.431  13.255   8.160
  184    HB3  LEU  27           HB1      LEU  27  92.604  13.766   9.347
  185    HG   LEU  27           HG       LEU  27  90.272  15.551   8.647
  186   HD11  LEU  27          HD11      LEU  27  90.295  13.154  10.492
  187   HD12  LEU  27          HD12      LEU  27  89.151  13.515   9.200
  188   HD13  LEU  27          HD13      LEU  27  89.142  14.477  10.679
  189   HD21  LEU  27          HD21      LEU  27  91.724  15.111  11.265
  190   HD22  LEU  27          HD22      LEU  27  90.678  16.462  10.827
  191   HD23  LEU  27          HD23      LEU  27  92.260  16.285  10.063
  192    H    ASN  28           HN       ASN  28  93.789  13.373   6.020
  193    HA   ASN  28           HA       ASN  28  96.026  12.865   5.549
  194    HB2  ASN  28           HB2      ASN  28  96.364  15.408   5.948
  195    HB3  ASN  28           HB1      ASN  28  96.948  14.944   7.540
  196   HD21  ASN  28          HD21      ASN  28  97.873  12.316   6.202
  197   HD22  ASN  28          HD22      ASN  28  99.359  12.734   5.504
  198    H    ARG  29           HN       ARG  29  94.352  12.174   8.144
  199    HA   ARG  29           HA       ARG  29  96.568  11.223   9.848
  200    HB2  ARG  29           HB2      ARG  29  93.565  11.119  10.160
  201    HB3  ARG  29           HB1      ARG  29  94.717  10.504  11.347
  202    HG2  ARG  29           HG2      ARG  29  95.679  12.718  11.623
  203    HG3  ARG  29           HG1      ARG  29  94.638  13.362  10.362
  204    HD2  ARG  29           HD2      ARG  29  93.481  13.939  12.329
  205    HD3  ARG  29           HD1      ARG  29  92.684  12.447  11.823
  206    HE   ARG  29           HE       ARG  29  94.896  11.890  13.599
  207   HH11  ARG  29          HH11      ARG  29  94.362  11.195  15.683
  208   HH12  ARG  29          HH12      ARG  29  92.761  11.465  16.287
  209   HH21  ARG  29          HH21      ARG  29  91.650  13.035  13.402
  210   HH22  ARG  29          HH22      ARG  29  91.226  12.507  14.996
  211    H    ASP  30           HN       ASP  30  95.884   8.965  10.800
  212    HA   ASP  30           HA       ASP  30  95.027   7.114   8.650
  213    HB2  ASP  30           HB2      ASP  30  97.536   6.844  10.324
  214    HB3  ASP  30           HB1      ASP  30  96.843   5.547   9.350
  215    H    VAL  31           HN       VAL  31  93.311   6.148   9.453
  216    HA   VAL  31           HA       VAL  31  93.276   5.461  12.386
  217    HB   VAL  31           HB       VAL  31  90.920   5.773  10.525
  218   HG11  VAL  31          HG11      VAL  31  90.463   4.407  12.479
  219   HG12  VAL  31          HG12      VAL  31  89.717   5.989  12.719
  220   HG13  VAL  31          HG13      VAL  31  91.233   5.594  13.532
  221   HG21  VAL  31          HG21      VAL  31  92.085   7.768  12.503
  222   HG22  VAL  31          HG22      VAL  31  90.603   7.991  11.575
  223   HG23  VAL  31          HG23      VAL  31  92.159   7.919  10.747
  224    H    THR  32           HN       THR  32  92.285   3.434  12.938
  225    HA   THR  32           HA       THR  32  92.251   1.411  10.731
  226    HB   THR  32           HB       THR  32  93.073   0.144  13.184
  227    HG1  THR  32           HG1      THR  32  95.159   1.675  12.904
  228   HG21  THR  32          HG21      THR  32  94.934  -0.588  11.934
  229   HG22  THR  32          HG22      THR  32  94.945   0.864  10.932
  230   HG23  THR  32          HG23      THR  32  93.688  -0.353  10.710
  231    H    LEU  33           HN       LEU  33  90.516   0.051  10.792
  232    HA   LEU  33           HA       LEU  33  88.607   0.316  13.084
  233    HB2  LEU  33           HB2      LEU  33  88.285   0.121  10.111
  234    HB3  LEU  33           HB1      LEU  33  87.020  -0.549  11.119
  235    HG   LEU  33           HG       LEU  33  86.723   1.877  10.365
  236   HD11  LEU  33          HD11      LEU  33  85.598   0.725  12.376
  237   HD12  LEU  33          HD12      LEU  33  85.606   2.486  12.344
  238   HD13  LEU  33          HD13      LEU  33  86.744   1.622  13.369
  239   HD21  LEU  33          HD21      LEU  33  88.657   2.525  12.588
  240   HD22  LEU  33          HD22      LEU  33  87.988   3.586  11.366
  241   HD23  LEU  33          HD23      LEU  33  89.195   2.390  10.915
  242    H    ARG  34           HN       ARG  34  88.706  -1.460  14.302
  243    HA   ARG  34           HA       ARG  34  89.753  -3.997  13.552
  244    HB2  ARG  34           HB2      ARG  34  89.338  -3.128  15.917
  245    HB3  ARG  34           HB1      ARG  34  87.636  -3.487  15.658
  246    HG2  ARG  34           HG2      ARG  34  88.429  -5.440  16.707
  247    HG3  ARG  34           HG1      ARG  34  88.429  -5.863  14.998
  248    HD2  ARG  34           HD2      ARG  34  90.770  -5.683  14.826
  249    HD3  ARG  34           HD1      ARG  34  90.899  -4.720  16.282
  250    HE   ARG  34           HE       ARG  34  90.705  -7.636  16.183
  251   HH11  ARG  34          HH11      ARG  34  90.967  -8.670  18.176
  252   HH12  ARG  34          HH12      ARG  34  90.915  -7.737  19.634
  253   HH21  ARG  34          HH21      ARG  34  90.388  -4.723  18.007
  254   HH22  ARG  34          HH22      ARG  34  90.589  -5.507  19.538
  255    H    VAL  35           HN       VAL  35  88.856  -5.001  11.788
  256    HA   VAL  35           HA       VAL  35  85.905  -5.527  11.834
  257    HB   VAL  35           HB       VAL  35  85.982  -5.333   9.337
  258   HG11  VAL  35          HG11      VAL  35  85.053  -3.481  10.527
  259   HG12  VAL  35          HG12      VAL  35  86.193  -2.781   9.377
  260   HG13  VAL  35          HG13      VAL  35  86.645  -2.949  11.076
  261   HG21  VAL  35          HG21      VAL  35  88.369  -5.635   8.988
  262   HG22  VAL  35          HG22      VAL  35  88.726  -4.195   9.937
  263   HG23  VAL  35          HG23      VAL  35  87.903  -4.045   8.386
  264    H    THR  36           HN       THR  36  85.669  -7.095   9.680
  265    HA   THR  36           HA       THR  36  87.711  -9.249   9.863
  266    HB   THR  36           HB       THR  36  85.779 -10.903   9.937
  267    HG1  THR  36           HG1      THR  36  83.894  -9.902  10.999
  268   HG21  THR  36          HG21      THR  36  86.398  -9.089  12.262
  269   HG22  THR  36          HG22      THR  36  87.081 -10.674  11.904
  270   HG23  THR  36          HG23      THR  36  85.405 -10.534  12.431
  271    H    GLY  37           HN       GLY  37  87.115 -10.914   8.041
  272    HA2  GLY  37           HA2      GLY  37  86.726  -9.352   5.619
  273    HA3  GLY  37           HA1      GLY  37  87.092 -11.069   5.677
  274    H    GLU  38           HN       GLU  38  84.462  -9.191   7.119
  275    HA   GLU  38           HA       GLU  38  82.500 -10.462   5.321
  276    HB2  GLU  38           HB2      GLU  38  81.119 -11.160   7.328
  277    HB3  GLU  38           HB1      GLU  38  82.578 -12.112   7.059
  278    HG2  GLU  38           HG2      GLU  38  83.743 -11.053   8.814
  279    HG3  GLU  38           HG1      GLU  38  82.598  -9.713   8.884
  280    H    VAL  39           HN       VAL  39  83.661  -7.756   6.776
  281    HA   VAL  39           HA       VAL  39  81.061  -6.579   7.490
  282    HB   VAL  39           HB       VAL  39  82.275  -4.705   8.249
  283   HG11  VAL  39          HG11      VAL  39  83.770  -5.679   9.798
  284   HG12  VAL  39          HG12      VAL  39  84.225  -6.958   8.669
  285   HG13  VAL  39          HG13      VAL  39  82.628  -6.964   9.415
  286   HG21  VAL  39          HG21      VAL  39  84.573  -5.722   6.552
  287   HG22  VAL  39          HG22      VAL  39  84.713  -4.400   7.708
  288   HG23  VAL  39          HG23      VAL  39  83.667  -4.225   6.311
  289    H    HIS  40           HN       HIS  40  79.909  -5.188   6.206
  290    HA   HIS  40           HA       HIS  40  80.665  -5.038   3.376
  291    HB2  HIS  40           HB2      HIS  40  78.387  -3.453   4.543
  292    HB3  HIS  40           HB1      HIS  40  78.497  -4.280   2.988
  293    HD1  HIS  40           HD1      HIS  40  77.442  -4.759   6.495
  294    HD2  HIS  40           HD2      HIS  40  78.211  -7.182   3.191
  295    HE1  HIS  40           HE1      HIS  40  76.441  -7.025   7.021
  296    H    ILE  41           HN       ILE  41  81.218  -3.095   2.266
  297    HA   ILE  41           HA       ILE  41  82.957  -1.291   3.497
  298    HB   ILE  41           HB       ILE  41  81.066  -0.671   1.217
  299   HG12  ILE  41          HG12      ILE  41  83.943  -1.593   0.994
  300   HG13  ILE  41          HG11      ILE  41  82.604  -2.741   1.049
  301   HG21  ILE  41          HG21      ILE  41  83.634   0.601   2.185
  302   HG22  ILE  41          HG22      ILE  41  82.050   1.363   2.020
  303   HG23  ILE  41          HG23      ILE  41  82.960   0.889   0.582
  304   HD11  ILE  41          HD11      ILE  41  81.709  -2.013  -0.969
  305   HD12  ILE  41          HD12      ILE  41  83.436  -1.864  -1.279
  306   HD13  ILE  41          HD13      ILE  41  82.483  -0.434  -0.874
  307    H    GLY  42           HN       GLY  42  79.505  -0.750   2.805
  308    HA2  GLY  42           HA2      GLY  42  79.244   1.769   4.016
  309    HA3  GLY  42           HA1      GLY  42  77.936   0.595   3.916
  310    H    GLY  43           HN       GLY  43  79.956  -1.242   5.348
  311    HA2  GLY  43           HA2      GLY  43  78.943  -0.692   8.040
  312    HA3  GLY  43           HA1      GLY  43  79.948  -2.061   7.557
  313    H    VAL  44           HN       VAL  44  81.908  -0.264   6.230
  314    HA   VAL  44           HA       VAL  44  83.530   0.291   8.610
  315    HB   VAL  44           HB       VAL  44  83.945   0.251   5.631
  316   HG11  VAL  44          HG11      VAL  44  85.658   1.837   7.563
  317   HG12  VAL  44          HG12      VAL  44  84.946   2.388   6.047
  318   HG13  VAL  44          HG13      VAL  44  86.276   1.231   6.026
  319   HG21  VAL  44          HG21      VAL  44  85.739  -1.219   6.187
  320   HG22  VAL  44          HG22      VAL  44  84.410  -1.658   7.261
  321   HG23  VAL  44          HG23      VAL  44  85.750  -0.683   7.868
  322    H    MET  45           HN       MET  45  82.348   2.356   5.863
  323    HA   MET  45           HA       MET  45  83.217   4.804   6.919
  324    HB2  MET  45           HB2      MET  45  81.020   5.728   5.813
  325    HB3  MET  45           HB1      MET  45  82.276   5.035   4.801
  326    HG2  MET  45           HG2      MET  45  80.844   3.466   4.028
  327    HG3  MET  45           HG1      MET  45  80.497   2.900   5.645
  328    HE1  MET  45           HE1      MET  45  77.940   4.966   2.779
  329    HE2  MET  45           HE2      MET  45  77.664   3.294   3.253
  330    HE3  MET  45           HE3      MET  45  79.249   3.786   2.667
  331    H    LEU  46           HN       LEU  46  80.371   2.893   7.810
  332    HA   LEU  46           HA       LEU  46  79.106   4.793   9.509
  333    HB2  LEU  46           HB2      LEU  46  78.214   2.498   8.871
  334    HB3  LEU  46           HB1      LEU  46  79.323   1.821  10.061
  335    HG   LEU  46           HG       LEU  46  78.167   3.675  11.647
  336   HD11  LEU  46          HD11      LEU  46  76.736   4.564   9.845
  337   HD12  LEU  46          HD12      LEU  46  75.770   3.861  11.142
  338   HD13  LEU  46          HD13      LEU  46  76.008   2.967   9.639
  339   HD21  LEU  46          HD21      LEU  46  76.961   0.989  10.920
  340   HD22  LEU  46          HD22      LEU  46  76.544   1.917  12.362
  341   HD23  LEU  46          HD23      LEU  46  78.181   1.295  12.156
  342    H    LYS  47           HN       LYS  47  81.185   2.094  10.616
  343    HA   LYS  47           HA       LYS  47  81.583   2.941  13.245
  344    HB2  LYS  47           HB2      LYS  47  83.640   1.593  11.484
  345    HB3  LYS  47           HB1      LYS  47  83.608   1.576  13.249
  346    HG2  LYS  47           HG2      LYS  47  81.378   0.461  13.149
  347    HG3  LYS  47           HG1      LYS  47  81.535   0.405  11.395
  348    HD2  LYS  47           HD2      LYS  47  83.735  -0.826  11.746
  349    HD3  LYS  47           HD1      LYS  47  83.275  -0.980  13.442
  350    HE2  LYS  47           HE2      LYS  47  81.539  -1.923  11.143
  351    HE3  LYS  47           HE1      LYS  47  82.653  -2.970  12.022
  352    HZ1  LYS  47           HZ1      LYS  47  80.498  -1.391  13.312
  353    HZ2  LYS  47           HZ2      LYS  47  81.478  -2.574  14.037
  354    HZ3  LYS  47           HZ3      LYS  47  80.336  -3.018  12.861
  355    H    LEU  48           HN       LEU  48  83.942   3.523  10.602
  356    HA   LEU  48           HA       LEU  48  85.728   5.104  11.987
  357    HB2  LEU  48           HB2      LEU  48  86.046   4.444   9.634
  358    HB3  LEU  48           HB1      LEU  48  84.768   5.546   9.141
  359    HG   LEU  48           HG       LEU  48  86.203   7.428  10.162
  360   HD11  LEU  48          HD11      LEU  48  88.578   6.999  10.407
  361   HD12  LEU  48          HD12      LEU  48  88.363   5.320   9.931
  362   HD13  LEU  48          HD13      LEU  48  87.709   5.894  11.461
  363   HD21  LEU  48          HD21      LEU  48  87.940   7.047   8.099
  364   HD22  LEU  48          HD22      LEU  48  86.281   7.579   7.875
  365   HD23  LEU  48          HD23      LEU  48  86.693   5.878   7.655
  366    H    VAL  49           HN       VAL  49  82.722   6.268  10.462
  367    HA   VAL  49           HA       VAL  49  83.077   9.001  11.314
  368    HB   VAL  49           HB       VAL  49  80.694   7.380  10.416
  369   HG11  VAL  49          HG11      VAL  49  79.653   8.845  11.966
  370   HG12  VAL  49          HG12      VAL  49  79.480   9.657  10.411
  371   HG13  VAL  49          HG13      VAL  49  80.727  10.178  11.546
  372   HG21  VAL  49          HG21      VAL  49  80.734   9.111   8.577
  373   HG22  VAL  49          HG22      VAL  49  82.189   8.116   8.652
  374   HG23  VAL  49          HG23      VAL  49  82.210   9.761   9.292
  375    H    GLU  50           HN       GLU  50  81.187   6.279  12.674
  376    HA   GLU  50           HA       GLU  50  80.001   7.486  14.868
  377    HB2  GLU  50           HB2      GLU  50  81.338   4.780  14.668
  378    HB3  GLU  50           HB1      GLU  50  80.435   5.285  16.092
  379    HG2  GLU  50           HG2      GLU  50  79.271   5.322  13.298
  380    HG3  GLU  50           HG1      GLU  50  79.090   3.962  14.405
  381    H    LYS  51           HN       LYS  51  83.388   6.474  14.582
  382    HA   LYS  51           HA       LYS  51  84.108   7.146  17.284
  383    HB2  LYS  51           HB2      LYS  51  85.794   7.043  14.763
  384    HB3  LYS  51           HB1      LYS  51  86.426   7.105  16.407
  385    HG2  LYS  51           HG2      LYS  51  85.413   4.981  16.953
  386    HG3  LYS  51           HG1      LYS  51  84.560   4.939  15.410
  387    HD2  LYS  51           HD2      LYS  51  86.542   4.579  14.181
  388    HD3  LYS  51           HD1      LYS  51  87.569   5.106  15.512
  389    HE2  LYS  51           HE2      LYS  51  86.810   3.116  16.827
  390    HE3  LYS  51           HE1      LYS  51  85.914   2.569  15.410
  391    HZ1  LYS  51           HZ1      LYS  51  88.276   2.974  14.314
  392    HZ2  LYS  51           HZ2      LYS  51  87.847   1.494  15.029
  393    HZ3  LYS  51           HZ3      LYS  51  88.787   2.617  15.891
  394    H    LEU  52           HN       LEU  52  83.844   8.958  14.298
  395    HA   LEU  52           HA       LEU  52  85.202  11.317  15.172
  396    HB2  LEU  52           HB2      LEU  52  84.229  10.394  12.800
  397    HB3  LEU  52           HB1      LEU  52  82.957  11.531  13.214
  398    HG   LEU  52           HG       LEU  52  84.826  13.232  13.628
  399   HD11  LEU  52          HD11      LEU  52  86.820  11.975  13.717
  400   HD12  LEU  52          HD12      LEU  52  86.868  12.670  12.102
  401   HD13  LEU  52          HD13      LEU  52  86.374  10.994  12.325
  402   HD21  LEU  52          HD21      LEU  52  85.050  13.655  11.142
  403   HD22  LEU  52          HD22      LEU  52  83.395  13.403  11.692
  404   HD23  LEU  52          HD23      LEU  52  84.259  12.103  10.876
  405    H    ASP  53           HN       ASP  53  81.732  10.869  14.634
  406    HA   ASP  53           HA       ASP  53  79.867  11.655  15.777
  407    HB2  ASP  53           HB2      ASP  53  81.268  10.564  17.647
  408    HB3  ASP  53           HB1      ASP  53  81.645  12.206  18.135
  409    H    VAL  54           HN       VAL  54  80.111  13.448  14.251
  410    HA   VAL  54           HA       VAL  54  79.913  15.993  15.580
  411    HB   VAL  54           HB       VAL  54  82.300  15.858  15.716
  412   HG11  VAL  54          HG11      VAL  54  83.639  15.446  13.618
  413   HG12  VAL  54          HG12      VAL  54  82.124  15.010  12.824
  414   HG13  VAL  54          HG13      VAL  54  82.707  14.059  14.192
  415   HG21  VAL  54          HG21      VAL  54  82.967  17.792  14.455
  416   HG22  VAL  54          HG22      VAL  54  81.257  18.015  14.821
  417   HG23  VAL  54          HG23      VAL  54  81.752  17.482  13.215
  418    H    LYS  55           HN       LYS  55  79.185  17.652  14.112
  419    HA   LYS  55           HA       LYS  55  77.837  16.634  11.752
  420    HB2  LYS  55           HB2      LYS  55  78.143  19.312  13.085
  421    HB3  LYS  55           HB1      LYS  55  77.617  19.296  11.407
  422    HG2  LYS  55           HG2      LYS  55  75.887  17.456  12.359
  423    HG3  LYS  55           HG1      LYS  55  76.177  18.319  13.857
  424    HD2  LYS  55           HD2      LYS  55  75.532  20.429  12.804
  425    HD3  LYS  55           HD1      LYS  55  75.318  19.605  11.258
  426    HE2  LYS  55           HE2      LYS  55  73.133  19.778  12.210
  427    HE3  LYS  55           HE1      LYS  55  73.637  18.104  12.436
  428    HZ1  LYS  55           HZ1      LYS  55  72.661  19.459  14.412
  429    HZ2  LYS  55           HZ2      LYS  55  74.243  20.065  14.531
  430    HZ3  LYS  55           HZ3      LYS  55  73.958  18.396  14.665
  431    H    LYS  56           HN       LYS  56  80.664  16.172  11.694
  432    HA   LYS  56           HA       LYS  56  81.884  18.131   9.914
  433    HB2  LYS  56           HB2      LYS  56  83.145  16.656  11.534
  434    HB3  LYS  56           HB1      LYS  56  82.777  15.288  10.486
  435    HG2  LYS  56           HG2      LYS  56  84.306  15.937   8.878
  436    HG3  LYS  56           HG1      LYS  56  83.999  17.654   9.120
  437    HD2  LYS  56           HD2      LYS  56  85.347  17.670  11.143
  438    HD3  LYS  56           HD1      LYS  56  85.555  15.923  11.066
  439    HE2  LYS  56           HE2      LYS  56  87.475  17.415  10.163
  440    HE3  LYS  56           HE1      LYS  56  86.958  16.052   9.172
  441    HZ1  LYS  56           HZ1      LYS  56  87.154  18.532   8.253
  442    HZ2  LYS  56           HZ2      LYS  56  85.533  18.550   8.760
  443    HZ3  LYS  56           HZ3      LYS  56  86.058  17.398   7.627
  444    H    ASP  57           HN       ASP  57  82.942  16.997   7.808
  445    HA   ASP  57           HA       ASP  57  80.800  16.567   5.998
  446    HB2  ASP  57           HB2      ASP  57  83.525  15.467   5.369
  447    HB3  ASP  57           HB1      ASP  57  82.435  16.413   4.356
  448    H    TRP  58           HN       TRP  58  79.450  14.872   6.745
  449    HA   TRP  58           HA       TRP  58  80.599  12.176   7.108
  450    HB2  TRP  58           HB2      TRP  58  77.893  13.436   7.540
  451    HB3  TRP  58           HB1      TRP  58  78.059  11.683   7.494
  452    HD1  TRP  58           HD1      TRP  58  80.898  13.729   8.940
  453    HE1  TRP  58           HE1      TRP  58  81.022  13.313  11.484
  454    HE3  TRP  58           HE3      TRP  58  76.575  11.099   9.596
  455    HZ2  TRP  58           HZ2      TRP  58  79.471  12.014  13.518
  456    HZ3  TRP  58           HZ3      TRP  58  75.920  10.286  11.843
  457    HH2  TRP  58           HH2      TRP  58  77.363  10.743  13.806
  458    H    SER  59           HN       SER  59  78.522  13.958   4.844
  459    HA   SER  59           HA       SER  59  77.885  11.610   3.244
  460    HB2  SER  59           HB2      SER  59  76.651  13.915   3.354
  461    HB3  SER  59           HB1      SER  59  77.843  14.433   2.172
  462    HG   SER  59           HG       SER  59  76.539  13.510   0.805
  463    H    ASP  60           HN       ASP  60  80.344  14.097   3.223
  464    HA   ASP  60           HA       ASP  60  81.525  13.425   0.665
  465    HB2  ASP  60           HB2      ASP  60  81.718  15.555   2.220
  466    HB3  ASP  60           HB1      ASP  60  83.028  14.644   2.964
  467    H    HIS  61           HN       HIS  61  81.085  11.365   2.907
  468    HA   HIS  61           HA       HIS  61  83.850  10.339   3.262
  469    HB2  HIS  61           HB2      HIS  61  82.411  10.700   5.274
  470    HB3  HIS  61           HB1      HIS  61  81.283   9.512   4.630
  471    HD1  HIS  61           HD1      HIS  61  83.168   7.323   3.672
  472    HD2  HIS  61           HD2      HIS  61  83.654   9.309   7.301
  473    HE1  HIS  61           HE1      HIS  61  84.481   5.767   5.180
  474    H    ALA  62           HN       ALA  62  84.529   8.593   2.269
  475    HA   ALA  62           HA       ALA  62  82.892   6.328   1.612
  476    HB1  ALA  62           HB1      ALA  62  82.626   6.529  -0.703
  477    HB2  ALA  62           HB2      ALA  62  83.917   7.726  -0.852
  478    HB3  ALA  62           HB3      ALA  62  82.357   8.188  -0.171
  479    H    LEU  63           HN       LEU  63  84.298   4.544   1.084
  480    HA   LEU  63           HA       LEU  63  87.175   5.170   1.479
  481    HB2  LEU  63           HB2      LEU  63  85.874   2.444   1.337
  482    HB3  LEU  63           HB1      LEU  63  87.479   2.829   1.932
  483    HG   LEU  63           HG       LEU  63  86.096   2.518   3.841
  484   HD11  LEU  63          HD11      LEU  63  87.642   4.576   3.697
  485   HD12  LEU  63          HD12      LEU  63  86.453   4.536   4.996
  486   HD13  LEU  63          HD13      LEU  63  86.155   5.515   3.560
  487   HD21  LEU  63          HD21      LEU  63  83.918   3.220   4.105
  488   HD22  LEU  63          HD22      LEU  63  83.939   3.143   2.348
  489   HD23  LEU  63          HD23      LEU  63  84.147   4.689   3.164
  490    H    TRP  64           HN       TRP  64  88.748   4.690   0.035
  491    HA   TRP  64           HA       TRP  64  87.929   3.615  -2.658
  492    HB2  TRP  64           HB2      TRP  64  88.480   5.615  -3.602
  493    HB3  TRP  64           HB1      TRP  64  88.732   6.272  -2.009
  494    HD1  TRP  64           HD1      TRP  64  91.439   5.221  -1.096
  495    HE1  TRP  64           HE1      TRP  64  93.610   5.697  -2.390
  496    HE3  TRP  64           HE3      TRP  64  89.499   6.388  -5.674
  497    HZ2  TRP  64           HZ2      TRP  64  94.422   6.515  -5.005
  498    HZ3  TRP  64           HZ3      TRP  64  90.994   7.037  -7.541
  499    HH2  TRP  64           HH2      TRP  64  93.452   7.103  -7.213
  500    H    TRP  65           HN       TRP  65  89.582   2.352  -3.696
  501    HA   TRP  65           HA       TRP  65  91.701   1.390  -1.807
  502    HB2  TRP  65           HB2      TRP  65  89.908  -0.219  -2.710
  503    HB3  TRP  65           HB1      TRP  65  90.715  -0.062  -4.267
  504    HD1  TRP  65           HD1      TRP  65  93.542   0.209  -2.156
  505    HE1  TRP  65           HE1      TRP  65  94.663  -2.048  -1.671
  506    HE3  TRP  65           HE3      TRP  65  89.773  -2.957  -3.530
  507    HZ2  TRP  65           HZ2      TRP  65  94.054  -4.838  -1.849
  508    HZ3  TRP  65           HZ3      TRP  65  90.078  -5.410  -3.361
  509    HH2  TRP  65           HH2      TRP  65  92.210  -6.354  -2.522
  510    H    GLU  66           HN       GLU  66  93.336   2.903  -2.372
  511    HA   GLU  66           HA       GLU  66  93.989   3.778  -4.966
  512    HB2  GLU  66           HB2      GLU  66  96.310   4.131  -4.037
  513    HB3  GLU  66           HB1      GLU  66  95.004   4.852  -3.106
  514    HG2  GLU  66           HG2      GLU  66  95.001   2.875  -1.607
  515    HG3  GLU  66           HG1      GLU  66  96.344   2.209  -2.526
  516    H    LYS  67           HN       LYS  67  94.632   0.647  -3.525
  517    HA   LYS  67           HA       LYS  67  96.773  -0.026  -5.364
  518    HB2  LYS  67           HB2      LYS  67  94.819  -1.989  -4.138
  519    HB3  LYS  67           HB1      LYS  67  96.458  -2.316  -4.688
  520    HG2  LYS  67           HG2      LYS  67  95.704  -0.543  -2.351
  521    HG3  LYS  67           HG1      LYS  67  96.361  -2.171  -2.234
  522    HD2  LYS  67           HD2      LYS  67  98.336  -1.267  -3.628
  523    HD3  LYS  67           HD1      LYS  67  97.712   0.333  -3.227
  524    HE2  LYS  67           HE2      LYS  67  99.155   0.026  -1.432
  525    HE3  LYS  67           HE1      LYS  67  97.693  -0.693  -0.751
  526    HZ1  LYS  67           HZ1      LYS  67  98.650  -2.803  -1.969
  527    HZ2  LYS  67           HZ2      LYS  67  99.156  -2.375  -0.404
  528    HZ3  LYS  67           HZ3      LYS  67 100.121  -1.987  -1.748
  529    H    LYS  68           HN       LYS  68  93.548   0.636  -5.645
  530    HA   LYS  68           HA       LYS  68  93.339  -0.628  -8.337
  531    HB2  LYS  68           HB2      LYS  68  90.903  -0.288  -6.595
  532    HB3  LYS  68           HB1      LYS  68  91.179  -1.426  -7.910
  533    HG2  LYS  68           HG2      LYS  68  92.705  -1.604  -5.291
  534    HG3  LYS  68           HG1      LYS  68  91.157  -2.384  -5.535
  535    HD2  LYS  68           HD2      LYS  68  91.983  -3.765  -7.278
  536    HD3  LYS  68           HD1      LYS  68  93.439  -2.788  -7.460
  537    HE2  LYS  68           HE2      LYS  68  94.462  -3.725  -5.607
  538    HE3  LYS  68           HE1      LYS  68  92.940  -4.053  -4.784
  539    HZ1  LYS  68           HZ1      LYS  68  92.872  -6.075  -5.652
  540    HZ2  LYS  68           HZ2      LYS  68  94.457  -5.837  -6.216
  541    HZ3  LYS  68           HZ3      LYS  68  93.133  -5.497  -7.225
  542    H    ARG  69           HN       ARG  69  93.120   2.140  -6.349
  543    HA   ARG  69           HA       ARG  69  92.331   4.312  -6.746
  544    HB2  ARG  69           HB2      ARG  69  92.905   3.359  -9.572
  545    HB3  ARG  69           HB1      ARG  69  92.366   4.994  -9.218
  546    HG2  ARG  69           HG2      ARG  69  94.678   5.293  -9.211
  547    HG3  ARG  69           HG1      ARG  69  94.389   4.981  -7.503
  548    HD2  ARG  69           HD2      ARG  69  96.216   3.578  -8.109
  549    HD3  ARG  69           HD1      ARG  69  94.810   2.522  -8.032
  550    HE   ARG  69           HE       ARG  69  94.902   3.321 -10.686
  551   HH11  ARG  69          HH11      ARG  69  96.025   2.145 -12.258
  552   HH12  ARG  69          HH12      ARG  69  97.340   1.123 -11.781
  553   HH21  ARG  69          HH21      ARG  69  97.048   1.871  -8.409
  554   HH22  ARG  69          HH22      ARG  69  97.917   0.966  -9.603
  555    H    THR  70           HN       THR  70  90.396   2.468  -6.189
  556    HA   THR  70           HA       THR  70  88.198   3.018  -8.163
  557    HB   THR  70           HB       THR  70  88.930   0.626  -7.571
  558    HG1  THR  70           HG1      THR  70  86.515   1.741  -7.871
  559   HG21  THR  70          HG21      THR  70  87.251   0.972  -5.114
  560   HG22  THR  70          HG22      THR  70  88.984   1.293  -5.046
  561   HG23  THR  70          HG23      THR  70  88.401  -0.308  -5.503
  562    H    TRP  71           HN       TRP  71  86.034   2.640  -6.725
  563    HA   TRP  71           HA       TRP  71  86.203   4.360  -4.298
  564    HB2  TRP  71           HB2      TRP  71  83.834   5.150  -5.057
  565    HB3  TRP  71           HB1      TRP  71  85.244   5.910  -5.770
  566    HD1  TRP  71           HD1      TRP  71  84.395   2.430  -7.028
  567    HE1  TRP  71           HE1      TRP  71  83.420   2.602  -9.365
  568    HE3  TRP  71           HE3      TRP  71  83.833   7.494  -7.386
  569    HZ2  TRP  71           HZ2      TRP  71  82.531   4.603 -11.211
  570    HZ3  TRP  71           HZ3      TRP  71  82.922   8.505  -9.458
  571    HH2  TRP  71           HH2      TRP  71  82.270   7.066 -11.370
  572    H    LEU  72           HN       LEU  72  86.009   2.718  -2.897
  573    HA   LEU  72           HA       LEU  72  84.476   0.388  -3.304
  574    HB2  LEU  72           HB2      LEU  72  85.198   1.697  -0.687
  575    HB3  LEU  72           HB1      LEU  72  84.773   0.006  -0.908
  576    HG   LEU  72           HG       LEU  72  87.068   1.319  -2.375
  577   HD11  LEU  72          HD11      LEU  72  88.545   0.232  -0.695
  578   HD12  LEU  72          HD12      LEU  72  87.113  -0.171   0.254
  579   HD13  LEU  72          HD13      LEU  72  87.550   1.517  -0.012
  580   HD21  LEU  72          HD21      LEU  72  86.543  -0.685  -3.480
  581   HD22  LEU  72          HD22      LEU  72  86.113  -1.514  -1.984
  582   HD23  LEU  72          HD23      LEU  72  87.804  -1.188  -2.356
  583    H    LEU  73           HN       LEU  73  82.517   0.929  -4.087
  584    HA   LEU  73           HA       LEU  73  80.536   2.060  -2.145
  585    HB2  LEU  73           HB2      LEU  73  79.231   2.815  -4.174
  586    HB3  LEU  73           HB1      LEU  73  80.744   3.673  -3.910
  587    HG   LEU  73           HG       LEU  73  81.643   1.681  -5.557
  588   HD11  LEU  73          HD11      LEU  73  79.146   0.938  -5.733
  589   HD12  LEU  73          HD12      LEU  73  80.100   1.060  -7.210
  590   HD13  LEU  73          HD13      LEU  73  78.966   2.341  -6.780
  591   HD21  LEU  73          HD21      LEU  73  80.300   4.237  -6.493
  592   HD22  LEU  73          HD22      LEU  73  81.520   3.324  -7.379
  593   HD23  LEU  73          HD23      LEU  73  81.941   4.124  -5.868
  594    H    LYS  74           HN       LYS  74  81.569  -0.738  -3.109
  595    HA   LYS  74           HA       LYS  74  79.046  -1.933  -4.091
  596    HB2  LYS  74           HB2      LYS  74  81.869  -2.905  -3.701
  597    HB3  LYS  74           HB1      LYS  74  80.569  -4.081  -3.799
  598    HG2  LYS  74           HG2      LYS  74  81.536  -3.701  -6.021
  599    HG3  LYS  74           HG1      LYS  74  79.867  -3.151  -5.971
  600    HD2  LYS  74           HD2      LYS  74  81.311  -1.519  -7.128
  601    HD3  LYS  74           HD1      LYS  74  80.625  -0.834  -5.661
  602    HE2  LYS  74           HE2      LYS  74  83.185  -0.517  -6.155
  603    HE3  LYS  74           HE1      LYS  74  82.661  -0.898  -4.518
  604    HZ1  LYS  74           HZ1      LYS  74  84.555  -2.254  -5.574
  605    HZ2  LYS  74           HZ2      LYS  74  83.313  -3.059  -6.408
  606    HZ3  LYS  74           HZ3      LYS  74  83.349  -3.075  -4.710
  607    H    THR  75           HN       THR  75  78.006  -1.216  -1.936
  608    HA   THR  75           HA       THR  75  78.791  -2.401   0.539
  609    HB   THR  75           HB       THR  75  75.911  -1.811  -0.156
  610    HG1  THR  75           HG1      THR  75  76.955  -0.055  -0.931
  611   HG21  THR  75          HG21      THR  75  75.686  -1.335   2.128
  612   HG22  THR  75          HG22      THR  75  77.412  -1.044   2.335
  613   HG23  THR  75          HG23      THR  75  76.813  -2.692   2.137
  614    H    HIS  76           HN       HIS  76  77.418  -3.823  -2.246
  615    HA   HIS  76           HA       HIS  76  75.942  -5.936  -0.909
  616    HB2  HIS  76           HB2      HIS  76  75.605  -5.150  -3.312
  617    HB3  HIS  76           HB1      HIS  76  77.083  -6.026  -3.708
  618    HD1  HIS  76           HD1      HIS  76  75.965  -8.120  -1.238
  619    HD2  HIS  76           HD2      HIS  76  74.415  -7.302  -5.020
  620    HE1  HIS  76           HE1      HIS  76  74.501 -10.093  -1.854
  621    H    TRP  77           HN       TRP  77  79.103  -5.833  -2.566
  622    HA   TRP  77           HA       TRP  77  79.805  -8.521  -1.726
  623    HB2  TRP  77           HB2      TRP  77  81.025  -6.310  -3.289
  624    HB3  TRP  77           HB1      TRP  77  82.190  -7.301  -2.431
  625    HD1  TRP  77           HD1      TRP  77  83.166  -8.503  -4.491
  626    HE1  TRP  77           HE1      TRP  77  82.254 -10.251  -6.146
  627    HE3  TRP  77           HE3      TRP  77  78.173  -8.293  -3.375
  628    HZ2  TRP  77           HZ2      TRP  77  79.758 -11.403  -6.902
  629    HZ3  TRP  77           HZ3      TRP  77  76.562  -9.724  -4.582
  630    HH2  TRP  77           HH2      TRP  77  77.345 -11.279  -6.345
  631    H    THR  78           HN       THR  78  82.283  -8.391  -0.684
  632    HA   THR  78           HA       THR  78  82.195  -6.560   1.663
  633    HB   THR  78           HB       THR  78  83.153  -9.286   2.332
  634    HG1  THR  78           HG1      THR  78  80.736  -8.923   1.049
  635   HG21  THR  78          HG21      THR  78  81.226  -7.290   3.523
  636   HG22  THR  78          HG22      THR  78  82.711  -7.965   4.205
  637   HG23  THR  78          HG23      THR  78  81.257  -8.955   4.087
  638    H    LEU  79           HN       LEU  79  84.457  -7.556   2.909
  639    HA   LEU  79           HA       LEU  79  86.579  -6.468   1.279
  640    HB2  LEU  79           HB2      LEU  79  86.529  -8.021   3.859
  641    HB3  LEU  79           HB1      LEU  79  88.033  -7.472   3.142
  642    HG   LEU  79           HG       LEU  79  87.359  -5.156   3.361
  643   HD11  LEU  79          HD11      LEU  79  85.153  -4.673   4.555
  644   HD12  LEU  79          HD12      LEU  79  84.716  -6.345   4.212
  645   HD13  LEU  79          HD13      LEU  79  85.018  -5.220   2.885
  646   HD21  LEU  79          HD21      LEU  79  86.896  -5.115   5.903
  647   HD22  LEU  79          HD22      LEU  79  88.351  -5.960   5.372
  648   HD23  LEU  79          HD23      LEU  79  86.912  -6.879   5.817
  649    H    ASP  80           HN       ASP  80  86.042  -9.668   2.681
  650    HA   ASP  80           HA       ASP  80  87.954 -11.192   1.375
  651    HB2  ASP  80           HB2      ASP  80  86.325 -11.979   3.083
  652    HB3  ASP  80           HB1      ASP  80  85.070 -11.976   1.843
  653    H    LYS  81           HN       LYS  81  84.649 -10.574   0.233
  654    HA   LYS  81           HA       LYS  81  84.642 -11.955  -2.139
  655    HB2  LYS  81           HB2      LYS  81  83.613  -9.129  -2.153
  656    HB3  LYS  81           HB1      LYS  81  82.917 -10.566  -2.887
  657    HG2  LYS  81           HG2      LYS  81  83.029  -9.909   0.056
  658    HG3  LYS  81           HG1      LYS  81  81.593  -9.981  -0.961
  659    HD2  LYS  81           HD2      LYS  81  82.095 -12.403  -1.380
  660    HD3  LYS  81           HD1      LYS  81  83.383 -12.294  -0.185
  661    HE2  LYS  81           HE2      LYS  81  81.889 -11.939   1.590
  662    HE3  LYS  81           HE1      LYS  81  80.589 -11.413   0.522
  663    HZ1  LYS  81           HZ1      LYS  81  79.863 -13.485   0.431
  664    HZ2  LYS  81           HZ2      LYS  81  81.104 -13.986   1.478
  665    HZ3  LYS  81           HZ3      LYS  81  81.346 -14.011  -0.204
  666    H    TYR  82           HN       TYR  82  85.749  -8.588  -1.808
  667    HA   TYR  82           HA       TYR  82  86.869  -8.613  -4.498
  668    HB2  TYR  82           HB2      TYR  82  86.199  -6.628  -2.615
  669    HB3  TYR  82           HB1      TYR  82  87.948  -6.511  -2.750
  670    HD1  TYR  82           HD1      TYR  82  88.952  -6.421  -5.147
  671    HD2  TYR  82           HD2      TYR  82  84.813  -5.673  -4.268
  672    HE1  TYR  82           HE1      TYR  82  88.705  -5.236  -7.312
  673    HE2  TYR  82           HE2      TYR  82  84.569  -4.491  -6.433
  674    HH   TYR  82           HH       TYR  82  86.749  -4.725  -8.915
  675    H    GLY  83           HN       GLY  83  88.194  -8.949  -1.212
  676    HA2  GLY  83           HA2      GLY  83  90.094 -10.613  -1.048
  677    HA3  GLY  83           HA1      GLY  83  90.808  -9.804  -2.443
  678    H    ILE  84           HN       ILE  84  89.249  -7.570  -0.502
  679    HA   ILE  84           HA       ILE  84  91.650  -6.212   0.213
  680    HB   ILE  84           HB       ILE  84  88.870  -6.007   1.404
  681   HG12  ILE  84          HG12      ILE  84  90.121  -4.103  -0.582
  682   HG13  ILE  84          HG11      ILE  84  89.335  -5.576  -1.140
  683   HG21  ILE  84          HG21      ILE  84  91.315  -4.227   1.592
  684   HG22  ILE  84          HG22      ILE  84  90.426  -4.976   2.918
  685   HG23  ILE  84          HG23      ILE  84  89.690  -3.674   1.991
  686   HD11  ILE  84          HD11      ILE  84  87.905  -3.403  -0.947
  687   HD12  ILE  84          HD12      ILE  84  87.919  -3.738   0.785
  688   HD13  ILE  84          HD13      ILE  84  87.227  -4.912  -0.337
  689    H    GLN  85           HN       GLN  85  92.416  -5.831   2.434
  690    HA   GLN  85           HA       GLN  85  91.669  -7.527   4.623
  691    HB2  GLN  85           HB2      GLN  85  93.032  -8.993   2.811
  692    HB3  GLN  85           HB1      GLN  85  94.406  -8.278   3.645
  693    HG2  GLN  85           HG2      GLN  85  94.095 -10.167   4.969
  694    HG3  GLN  85           HG1      GLN  85  93.046  -9.035   5.820
  695   HE21  GLN  85          HE21      GLN  85  90.854  -8.971   4.037
  696   HE22  GLN  85          HE22      GLN  85  90.119 -10.493   4.020
  697    H    ALA  86           HN       ALA  86  94.142  -7.616   5.955
  698    HA   ALA  86           HA       ALA  86  94.406  -4.862   6.792
  699    HB1  ALA  86           HB1      ALA  86  95.810  -7.441   7.446
  700    HB2  ALA  86           HB2      ALA  86  94.798  -6.444   8.491
  701    HB3  ALA  86           HB3      ALA  86  96.426  -5.912   8.075
  702    H    ASP  87           HN       ASP  87  96.094  -6.899   4.517
  703    HA   ASP  87           HA       ASP  87  98.477  -5.241   4.384
  704    HB2  ASP  87           HB2      ASP  87  98.867  -6.548   2.248
  705    HB3  ASP  87           HB1      ASP  87  98.660  -7.543   3.692
  706    H    ALA  88           HN       ALA  88  95.308  -4.896   3.356
  707    HA   ALA  88           HA       ALA  88  95.982  -3.150   1.040
  708    HB1  ALA  88           HB1      ALA  88  93.338  -3.149   1.004
  709    HB2  ALA  88           HB2      ALA  88  93.542  -4.539   2.073
  710    HB3  ALA  88           HB3      ALA  88  94.223  -4.574   0.454
  711    H    LYS  89           HN       LYS  89  96.382  -1.036   1.648
  712    HA   LYS  89           HA       LYS  89  95.019   0.043   4.060
  713    HB2  LYS  89           HB2      LYS  89  96.977   1.606   2.390
  714    HB3  LYS  89           HB1      LYS  89  96.620   1.750   4.109
  715    HG2  LYS  89           HG2      LYS  89  97.953  -0.676   2.879
  716    HG3  LYS  89           HG1      LYS  89  98.827   0.676   3.567
  717    HD2  LYS  89           HD2      LYS  89  98.125   0.222   5.754
  718    HD3  LYS  89           HD1      LYS  89  96.733  -0.710   5.216
  719    HE2  LYS  89           HE2      LYS  89  98.506  -2.177   6.108
  720    HE3  LYS  89           HE1      LYS  89  98.186  -2.483   4.401
  721    HZ1  LYS  89           HZ1      LYS  89 100.219  -1.814   3.827
  722    HZ2  LYS  89           HZ2      LYS  89 100.619  -1.976   5.471
  723    HZ3  LYS  89           HZ3      LYS  89 100.174  -0.460   4.847
  724    H    LEU  90           HN       LEU  90  93.161   0.968   3.806
  725    HA   LEU  90           HA       LEU  90  92.387   2.145   1.193
  726    HB2  LEU  90           HB2      LEU  90  90.599   1.948   3.605
  727    HB3  LEU  90           HB1      LEU  90  90.154   1.975   1.900
  728    HG   LEU  90           HG       LEU  90  91.574  -0.256   3.360
  729   HD11  LEU  90          HD11      LEU  90  89.095  -0.019   3.714
  730   HD12  LEU  90          HD12      LEU  90  89.558  -1.529   2.931
  731   HD13  LEU  90          HD13      LEU  90  88.882  -0.211   1.974
  732   HD21  LEU  90          HD21      LEU  90  91.246  -1.441   1.119
  733   HD22  LEU  90          HD22      LEU  90  92.491  -0.193   1.150
  734   HD23  LEU  90          HD23      LEU  90  90.914   0.151   0.433
  735    H    GLN  91           HN       GLN  91  90.928   4.181   1.550
  736    HA   GLN  91           HA       GLN  91  92.202   6.053   3.503
  737    HB2  GLN  91           HB2      GLN  91  91.429   6.798   0.672
  738    HB3  GLN  91           HB1      GLN  91  92.313   7.784   1.827
  739    HG2  GLN  91           HG2      GLN  91  94.295   6.569   1.550
  740    HG3  GLN  91           HG1      GLN  91  93.469   5.141   0.965
  741   HE21  GLN  91          HE21      GLN  91  92.248   7.985  -0.406
  742   HE22  GLN  91          HE22      GLN  91  93.049   7.880  -1.892
  743    H    PHE  92           HN       PHE  92  90.759   7.900   3.989
  744    HA   PHE  92           HA       PHE  92  87.872   7.259   3.471
  745    HB2  PHE  92           HB2      PHE  92  87.935   6.969   5.755
  746    HB3  PHE  92           HB1      PHE  92  89.352   7.980   5.941
  747    HD1  PHE  92           HD1      PHE  92  86.132   9.070   4.309
  748    HD2  PHE  92           HD2      PHE  92  88.647   9.260   7.796
  749    HE1  PHE  92           HE1      PHE  92  84.748  10.909   5.243
  750    HE2  PHE  92           HE2      PHE  92  87.251  11.084   8.706
  751    HZ   PHE  92           HZ       PHE  92  85.302  11.908   7.427
  752    H    THR  93           HN       THR  93  87.653   8.460   1.702
  753    HA   THR  93           HA       THR  93  87.601  11.405   2.036
  754    HB   THR  93           HB       THR  93  89.617  11.485   0.893
  755    HG1  THR  93           HG1      THR  93  88.374  10.646  -1.440
  756   HG21  THR  93          HG21      THR  93  90.421   9.639  -0.582
  757   HG22  THR  93          HG22      THR  93  88.921   8.770  -0.261
  758   HG23  THR  93          HG23      THR  93  90.052   9.091   1.052
  759    HA   PRO  94           HA       PRO  94  83.750  11.291  -0.148
  760    HB2  PRO  94           HB2      PRO  94  84.466  12.808  -2.492
  761    HB3  PRO  94           HB1      PRO  94  83.675  13.406  -1.024
  762    HG2  PRO  94           HG2      PRO  94  86.547  13.486  -1.785
  763    HG3  PRO  94           HG1      PRO  94  85.607  14.624  -0.805
  764    HD2  PRO  94           HD2      PRO  94  87.357  12.969   0.355
  765    HD3  PRO  94           HD1      PRO  94  85.798  13.306   1.136
  766    H    TYR 541           HT1      TYR 541  57.083  44.330  10.945
  767    HA   TYR 541           HA       TYR 541  55.895  42.874  13.244
  768    HB2  TYR 541           HB2      TYR 541  54.153  44.789  12.926
  769    HB3  TYR 541           HB1      TYR 541  55.652  45.157  13.780
  770    HD1  TYR 541           HD1      TYR 541  53.877  45.456  10.539
  771    HD2  TYR 541           HD2      TYR 541  57.310  46.624  12.842
  772    HE1  TYR 541           HE1      TYR 541  54.422  47.186   8.848
  773    HE2  TYR 541           HE2      TYR 541  57.856  48.354  11.150
  774    HH   TYR 541           HH       TYR 541  57.298  49.268   9.211
  775    H    HIS 542           HN       HIS 542  56.448  42.073  10.385
  776    HA   HIS 542           HA       HIS 542  54.127  42.279   8.786
  777    HB2  HIS 542           HB2      HIS 542  55.816  39.780   8.879
  778    HB3  HIS 542           HB1      HIS 542  55.059  40.553   7.489
  779    HD1  HIS 542           HD1      HIS 542  56.212  43.436   8.795
  780    HD2  HIS 542           HD2      HIS 542  58.317  40.136   7.359
  781    HE1  HIS 542           HE1      HIS 542  58.527  44.270   8.191
  782    H    GLU 543           HN       GLU 543  53.306  39.621   8.310
  783    HA   GLU 543           HA       GLU 543  52.164  38.690  10.910
  784    HB2  GLU 543           HB2      GLU 543  49.949  38.409   9.618
  785    HB3  GLU 543           HB1      GLU 543  50.391  40.047  10.102
  786    HG2  GLU 543           HG2      GLU 543  51.235  40.546   7.891
  787    HG3  GLU 543           HG1      GLU 543  51.029  38.869   7.385
  788    H    ARG 544           HN       ARG 544  53.717  37.955   8.031
  789    HA   ARG 544           HA       ARG 544  52.535  35.430   7.363
  790    HB2  ARG 544           HB2      ARG 544  55.453  36.140   7.003
  791    HB3  ARG 544           HB1      ARG 544  54.462  35.071   6.010
  792    HG2  ARG 544           HG2      ARG 544  54.093  38.064   6.291
  793    HG3  ARG 544           HG1      ARG 544  54.777  37.244   4.896
  794    HD2  ARG 544           HD2      ARG 544  52.450  35.886   5.063
  795    HD3  ARG 544           HD1      ARG 544  51.929  37.406   5.781
  796    HE   ARG 544           HE       ARG 544  52.267  36.943   3.012
  797   HH11  ARG 544          HH11      ARG 544  52.781  38.527   1.507
  798   HH12  ARG 544          HH12      ARG 544  53.389  40.056   2.046
  799   HH21  ARG 544          HH21      ARG 544  53.254  39.232   5.403
  800   HH22  ARG 544          HH22      ARG 544  53.665  40.449   4.247
  801    H    ARG 545           HN       ARG 545  52.287  33.977   9.033
  802    HA   ARG 545           HA       ARG 545  54.553  33.502  10.895
  803    HB2  ARG 545           HB2      ARG 545  52.635  31.830  11.820
  804    HB3  ARG 545           HB1      ARG 545  52.655  33.534  12.219
  805    HG2  ARG 545           HG2      ARG 545  50.422  32.830  11.500
  806    HG3  ARG 545           HG1      ARG 545  51.107  33.991  10.380
  807    HD2  ARG 545           HD2      ARG 545  50.019  32.126   9.186
  808    HD3  ARG 545           HD1      ARG 545  51.747  32.170   8.852
  809    HE   ARG 545           HE       ARG 545  51.534  30.446  11.012
  810   HH11  ARG 545          HH11      ARG 545  51.207  28.217  10.772
  811   HH12  ARG 545          HH12      ARG 545  50.479  27.614   9.322
  812   HH21  ARG 545          HH21      ARG 545  50.106  30.750   7.889
  813   HH22  ARG 545          HH22      ARG 545  49.856  29.047   7.689
  814    H    GLY 546           HN       GLY 546  53.772  30.681  11.317
  815    HA2  GLY 546           HA2      GLY 546  54.013  29.257   8.818
  816    HA3  GLY 546           HA1      GLY 546  55.575  29.375   9.628
  817    H    SER 547           HN       SER 547  55.965  28.094  11.431
  818    HA   SER 547           HA       SER 547  53.849  26.779  12.916
  819    HB2  SER 547           HB2      SER 547  55.228  25.363  10.669
  820    HB3  SER 547           HB1      SER 547  54.914  24.446  12.140
  821    HG   SER 547           HG       SER 547  53.087  24.225  10.985
  822    H    LEU 548           HN       LEU 548  54.784  26.785  14.928
  823    HA   LEU 548           HA       LEU 548  57.550  27.202  15.344
  824    HB2  LEU 548           HB2      LEU 548  55.202  26.562  17.025
  825    HB3  LEU 548           HB1      LEU 548  56.732  26.034  17.710
  826    HG   LEU 548           HG       LEU 548  57.609  28.389  17.268
  827   HD11  LEU 548          HD11      LEU 548  56.123  29.269  15.672
  828   HD12  LEU 548          HD12      LEU 548  55.688  30.106  17.154
  829   HD13  LEU 548          HD13      LEU 548  54.701  28.766  16.577
  830   HD21  LEU 548          HD21      LEU 548  56.670  27.496  19.489
  831   HD22  LEU 548          HD22      LEU 548  55.214  28.407  19.093
  832   HD23  LEU 548          HD23      LEU 548  56.756  29.245  19.288
  833    H    CYS 549           HN       CYS 549  59.284  25.857  15.555
  834    HA   CYS 549           HA       CYS 549  58.874  23.027  14.844
  835    HB2  CYS 549           HB2      CYS 549  60.811  23.925  13.836
  836    HB3  CYS 549           HB1      CYS 549  61.234  24.860  15.257
  837    H    SER 550           HN       SER 550  58.003  21.967  16.552
  838    HA   SER 550           HA       SER 550  58.214  22.594  19.253
  839    HB2  SER 550           HB2      SER 550  56.591  21.004  18.653
  840    HB3  SER 550           HB1      SER 550  57.772  19.920  17.927
  841    HG   SER 550           HG       SER 550  57.869  20.672  20.652
  842    H    GLY 551           HN       GLY 551  59.744  22.555  20.663
  843    HA2  GLY 551           HA2      GLY 551  61.652  21.416  21.778
  844    HA3  GLY 551           HA1      GLY 551  62.214  20.925  20.174
  845    H    CYS 552           HN       CYS 552  61.499  23.364  18.901
  846    HA   CYS 552           HA       CYS 552  63.676  25.161  19.884
  847    HB2  CYS 552           HB2      CYS 552  62.409  24.562  17.222
  848    HB3  CYS 552           HB1      CYS 552  63.193  26.112  17.476
  849    H    GLN 553           HN       GLN 553  60.331  24.889  18.872
  850    HA   GLN 553           HA       GLN 553  58.547  26.308  19.015
  851    HB2  GLN 553           HB2      GLN 553  60.064  27.263  21.427
  852    HB3  GLN 553           HB1      GLN 553  58.402  27.722  21.049
  853    HG2  GLN 553           HG2      GLN 553  59.336  24.862  21.295
  854    HG3  GLN 553           HG1      GLN 553  58.582  25.750  22.603
  855   HE21  GLN 553          HE21      GLN 553  58.020  24.430  19.366
  856   HE22  GLN 553          HE22      GLN 553  56.326  24.392  19.478
  857    H    LYS 554           HN       LYS 554  59.906  27.007  17.098
  858    HA   LYS 554           HA       LYS 554  59.852  29.967  17.065
  859    HB2  LYS 554           HB2      LYS 554  62.090  28.280  15.920
  860    HB3  LYS 554           HB1      LYS 554  61.895  30.000  15.619
  861    HG2  LYS 554           HG2      LYS 554  62.229  28.769  18.367
  862    HG3  LYS 554           HG1      LYS 554  63.538  29.492  17.438
  863    HD2  LYS 554           HD2      LYS 554  61.917  31.580  17.330
  864    HD3  LYS 554           HD1      LYS 554  61.172  30.822  18.736
  865    HE2  LYS 554           HE2      LYS 554  62.793  32.252  19.674
  866    HE3  LYS 554           HE1      LYS 554  63.581  30.674  19.682
  867    HZ1  LYS 554           HZ1      LYS 554  65.123  31.392  18.276
  868    HZ2  LYS 554           HZ2      LYS 554  64.533  32.966  18.524
  869    HZ3  LYS 554           HZ3      LYS 554  63.973  32.042  17.213
  870    HA   PRO 555           HA       PRO 555  57.087  28.723  13.686
  871    HB2  PRO 555           HB2      PRO 555  57.979  31.259  12.438
  872    HB3  PRO 555           HB1      PRO 555  56.342  30.670  12.741
  873    HG2  PRO 555           HG2      PRO 555  57.559  32.612  14.261
  874    HG3  PRO 555           HG1      PRO 555  56.283  31.555  14.873
  875    HD2  PRO 555           HD2      PRO 555  59.147  31.577  15.582
  876    HD3  PRO 555           HD1      PRO 555  57.802  30.750  16.406
  877    H    ILE 556           HN       ILE 556  57.394  27.512  11.971
  878    HA   ILE 556           HA       ILE 556  60.063  27.354  10.698
  879    HB   ILE 556           HB       ILE 556  57.558  25.638  10.582
  880   HG12  ILE 556          HG12      ILE 556  60.271  24.772  11.581
  881   HG13  ILE 556          HG11      ILE 556  59.234  25.699  12.644
  882   HG21  ILE 556          HG21      ILE 556  59.119  24.037   9.383
  883   HG22  ILE 556          HG22      ILE 556  60.205  25.402   9.145
  884   HG23  ILE 556          HG23      ILE 556  58.587  25.428   8.444
  885   HD11  ILE 556          HD11      ILE 556  57.713  23.979  12.886
  886   HD12  ILE 556          HD12      ILE 556  59.129  23.006  12.514
  887   HD13  ILE 556          HD13      ILE 556  57.964  23.376  11.248
  888    H    THR 557           HN       THR 557  60.094  29.107   9.246
  889    HA   THR 557           HA       THR 557  57.761  29.490   7.437
  890    HB   THR 557           HB       THR 557  58.569  31.663   7.076
  891    HG1  THR 557           HG1      THR 557  61.039  31.010   8.265
  892   HG21  THR 557          HG21      THR 557  58.832  32.537   9.282
  893   HG22  THR 557          HG22      THR 557  59.590  31.050   9.851
  894   HG23  THR 557          HG23      THR 557  57.870  31.068   9.467
  895    H    GLY 558           HN       GLY 558  58.051  27.777   6.016
  896    HA2  GLY 558           HA2      GLY 558  59.217  28.095   3.586
  897    HA3  GLY 558           HA1      GLY 558  60.555  27.426   4.533
  898    H    ARG 559           HN       ARG 559  60.463  25.304   5.197
  899    HA   ARG 559           HA       ARG 559  58.175  23.645   4.208
  900    HB2  ARG 559           HB2      ARG 559  61.156  23.202   4.308
  901    HB3  ARG 559           HB1      ARG 559  60.084  21.806   4.419
  902    HG2  ARG 559           HG2      ARG 559  59.649  23.842   2.242
  903    HG3  ARG 559           HG1      ARG 559  60.923  22.641   2.057
  904    HD2  ARG 559           HD2      ARG 559  59.416  20.850   2.013
  905    HD3  ARG 559           HD1      ARG 559  58.154  21.759   2.847
  906    HE   ARG 559           HE       ARG 559  58.477  23.128   0.464
  907   HH11  ARG 559          HH11      ARG 559  57.290  22.632  -1.395
  908   HH12  ARG 559          HH12      ARG 559  56.653  21.034  -1.599
  909   HH21  ARG 559          HH21      ARG 559  57.925  19.858   1.405
  910   HH22  ARG 559          HH22      ARG 559  57.014  19.464  -0.014
  911    H    CYS 560           HN       CYS 560  57.497  21.959   5.705
  912    HA   CYS 560           HA       CYS 560  58.710  22.076   8.407
  913    HB2  CYS 560           HB2      CYS 560  56.508  22.342   9.488
  914    HB3  CYS 560           HB1      CYS 560  56.956  23.755   8.526
  915    HG   CYS 560           HG       CYS 560  55.129  23.245   6.876
  916    H    ILE 561           HN       ILE 561  58.970  20.180   9.213
  917    HA   ILE 561           HA       ILE 561  57.590  17.855   8.031
  918    HB   ILE 561           HB       ILE 561  59.796  18.106  10.095
  919   HG12  ILE 561          HG12      ILE 561  59.735  17.351   7.180
  920   HG13  ILE 561          HG11      ILE 561  60.408  18.830   7.843
  921   HG21  ILE 561          HG21      ILE 561  58.427  16.012  10.359
  922   HG22  ILE 561          HG22      ILE 561  60.082  15.692   9.847
  923   HG23  ILE 561          HG23      ILE 561  58.771  15.633   8.668
  924   HD11  ILE 561          HD11      ILE 561  62.267  17.369   7.492
  925   HD12  ILE 561          HD12      ILE 561  61.415  16.005   8.228
  926   HD13  ILE 561          HD13      ILE 561  61.949  17.359   9.227
  927    H    THR 562           HN       THR 562  56.300  16.541   9.256
  928    HA   THR 562           HA       THR 562  55.401  17.625  11.898
  929    HB   THR 562           HB       THR 562  53.641  16.008  10.068
  930    HG1  THR 562           HG1      THR 562  53.088  17.780   9.054
  931   HG21  THR 562          HG21      THR 562  52.980  17.968  12.274
  932   HG22  THR 562          HG22      THR 562  53.159  16.232  12.543
  933   HG23  THR 562          HG23      THR 562  51.880  16.836  11.485
  934    H    ALA 563           HN       ALA 563  54.995  16.184  13.507
  935    HA   ALA 563           HA       ALA 563  55.929  13.380  13.057
  936    HB1  ALA 563           HB1      ALA 563  56.301  15.086  15.522
  937    HB2  ALA 563           HB2      ALA 563  57.536  14.857  14.280
  938    HB3  ALA 563           HB3      ALA 563  56.974  13.478  15.238
  939    H    MET 564           HN       MET 564  55.257  13.482  16.136
  940    HA   MET 564           HA       MET 564  52.770  12.075  15.971
  941    HB2  MET 564           HB2      MET 564  53.740  13.460  18.461
  942    HB3  MET 564           HB1      MET 564  52.951  11.889  18.301
  943    HG2  MET 564           HG2      MET 564  55.053  11.174  16.985
  944    HG3  MET 564           HG1      MET 564  55.793  12.637  17.631
  945    HE1  MET 564           HE1      MET 564  56.830   9.618  18.115
  946    HE2  MET 564           HE2      MET 564  55.166   9.040  18.059
  947    HE3  MET 564           HE3      MET 564  56.135   8.773  19.505
  948    H    ALA 565           HN       ALA 565  52.933  14.797  14.885
  949    HA   ALA 565           HA       ALA 565  51.015  16.223  14.463
  950    HB1  ALA 565           HB1      ALA 565  49.573  16.970  16.226
  951    HB2  ALA 565           HB2      ALA 565  50.628  16.305  17.468
  952    HB3  ALA 565           HB3      ALA 565  49.708  15.224  16.413
  953    H    LYS 566           HN       LYS 566  53.796  16.134  16.282
  954    HA   LYS 566           HA       LYS 566  53.952  19.014  16.864
  955    HB2  LYS 566           HB2      LYS 566  55.681  16.602  17.233
  956    HB3  LYS 566           HB1      LYS 566  56.520  18.143  17.101
  957    HG2  LYS 566           HG2      LYS 566  55.425  19.035  18.998
  958    HG3  LYS 566           HG1      LYS 566  54.194  17.775  18.989
  959    HD2  LYS 566           HD2      LYS 566  57.078  16.960  19.284
  960    HD3  LYS 566           HD1      LYS 566  56.252  17.653  20.673
  961    HE2  LYS 566           HE2      LYS 566  54.713  15.888  20.808
  962    HE3  LYS 566           HE1      LYS 566  54.911  15.451  19.106
  963    HZ1  LYS 566           HZ1      LYS 566  56.838  14.325  19.527
  964    HZ2  LYS 566           HZ2      LYS 566  56.016  14.041  20.986
  965    HZ3  LYS 566           HZ3      LYS 566  57.222  15.235  20.906
  966    H    LYS 567           HN       LYS 567  55.665  20.343  15.834
  967    HA   LYS 567           HA       LYS 567  56.005  19.625  12.949
  968    HB2  LYS 567           HB2      LYS 567  56.521  22.354  14.076
  969    HB3  LYS 567           HB1      LYS 567  55.985  21.914  12.466
  970    HG2  LYS 567           HG2      LYS 567  54.326  21.725  15.007
  971    HG3  LYS 567           HG1      LYS 567  54.149  22.937  13.751
  972    HD2  LYS 567           HD2      LYS 567  53.764  19.946  13.316
  973    HD3  LYS 567           HD1      LYS 567  52.465  21.117  13.537
  974    HE2  LYS 567           HE2      LYS 567  53.563  22.388  11.550
  975    HE3  LYS 567           HE1      LYS 567  54.383  20.860  11.238
  976    HZ1  LYS 567           HZ1      LYS 567  51.473  21.389  11.276
  977    HZ2  LYS 567           HZ2      LYS 567  52.114  19.816  11.332
  978    HZ3  LYS 567           HZ3      LYS 567  52.413  20.811   9.988
  979    H    PHE 568           HN       PHE 568  58.224  20.662  12.103
  980    HA   PHE 568           HA       PHE 568  60.321  20.670  14.163
  981    HB2  PHE 568           HB2      PHE 568  59.601  18.198  12.817
  982    HB3  PHE 568           HB1      PHE 568  61.236  18.625  12.357
  983    HD1  PHE 568           HD1      PHE 568  62.949  19.061  14.178
  984    HD2  PHE 568           HD2      PHE 568  59.084  17.372  14.996
  985    HE1  PHE 568           HE1      PHE 568  63.771  18.238  16.369
  986    HE2  PHE 568           HE2      PHE 568  59.907  16.550  17.186
  987    HZ   PHE 568           HZ       PHE 568  62.250  16.983  17.872
  988    H    HIS 569           HN       HIS 569  62.068  21.799  13.451
  989    HA   HIS 569           HA       HIS 569  62.003  23.262  11.024
  990    HB2  HIS 569           HB2      HIS 569  64.155  22.481  12.949
  991    HB3  HIS 569           HB1      HIS 569  64.632  23.219  11.433
  992    HD2  HIS 569           HD2      HIS 569  62.954  25.804  11.093
  993    HE1  HIS 569           HE1      HIS 569  63.374  26.515  15.227
  994    HA   PRO 570           HA       PRO 570  62.521  19.495   8.476
  995    HB2  PRO 570           HB2      PRO 570  63.530  21.501   6.499
  996    HB3  PRO 570           HB1      PRO 570  62.302  20.240   6.295
  997    HG2  PRO 570           HG2      PRO 570  61.657  22.874   6.567
  998    HG3  PRO 570           HG1      PRO 570  60.604  21.571   7.126
  999    HD2  PRO 570           HD2      PRO 570  62.208  23.478   8.730
 1000    HD3  PRO 570           HD1      PRO 570  60.807  22.494   9.216
 1001    H    GLU 571           HN       GLU 571  64.862  21.778   9.494
 1002    HA   GLU 571           HA       GLU 571  67.149  20.246   8.408
 1003    HB2  GLU 571           HB2      GLU 571  67.385  22.657  10.197
 1004    HB3  GLU 571           HB1      GLU 571  68.463  22.114   8.912
 1005    HG2  GLU 571           HG2      GLU 571  66.582  22.573   7.284
 1006    HG3  GLU 571           HG1      GLU 571  65.726  23.345   8.623
 1007    H    HIS 572           HN       HIS 572  66.039  21.493  11.561
 1008    HA   HIS 572           HA       HIS 572  67.951  20.095  13.129
 1009    HB2  HIS 572           HB2      HIS 572  65.118  20.752  13.994
 1010    HB3  HIS 572           HB1      HIS 572  66.520  20.537  15.040
 1011    HD2  HIS 572           HD2      HIS 572  68.408  22.346  12.730
 1012    HE1  HIS 572           HE1      HIS 572  66.130  25.535  14.275
 1013    H    PHE 573           HN       PHE 573  65.642  18.767  11.161
 1014    HA   PHE 573           HA       PHE 573  65.747  16.176  12.684
 1015    HB2  PHE 573           HB2      PHE 573  63.446  17.426  12.535
 1016    HB3  PHE 573           HB1      PHE 573  63.465  16.898  10.859
 1017    HD1  PHE 573           HD1      PHE 573  63.080  14.606  10.258
 1018    HD2  PHE 573           HD2      PHE 573  63.529  15.731  14.379
 1019    HE1  PHE 573           HE1      PHE 573  62.302  12.358  10.956
 1020    HE2  PHE 573           HE2      PHE 573  62.751  13.483  15.077
 1021    HZ   PHE 573           HZ       PHE 573  62.137  11.796  13.366
 1022    H    VAL 574           HN       VAL 574  67.740  16.662  11.024
 1023    HA   VAL 574           HA       VAL 574  67.101  15.759   8.298
 1024    HB   VAL 574           HB       VAL 574  69.545  16.112   7.914
 1025   HG11  VAL 574          HG11      VAL 574  68.739  18.115   7.245
 1026   HG12  VAL 574          HG12      VAL 574  69.077  18.752   8.834
 1027   HG13  VAL 574          HG13      VAL 574  67.484  18.084   8.469
 1028   HG21  VAL 574          HG21      VAL 574  70.248  15.690  10.262
 1029   HG22  VAL 574          HG22      VAL 574  69.440  17.186  10.761
 1030   HG23  VAL 574          HG23      VAL 574  70.832  17.248   9.677
 1031    H    CYS 575           HN       CYS 575  68.902  14.203   7.395
 1032    HA   CYS 575           HA       CYS 575  68.801  11.706   8.958
 1033    HB2  CYS 575           HB2      CYS 575  68.637  10.937   6.827
 1034    HB3  CYS 575           HB1      CYS 575  69.161  12.485   6.176
 1035    H    ALA 576           HN       ALA 576  70.683  10.669   9.903
 1036    HA   ALA 576           HA       ALA 576  72.993  12.567  10.131
 1037    HB1  ALA 576           HB1      ALA 576  71.864  11.172  12.072
 1038    HB2  ALA 576           HB2      ALA 576  73.621  11.342  12.033
 1039    HB3  ALA 576           HB3      ALA 576  72.868   9.854  11.460
 1040    H    PHE 577           HN       PHE 577  73.413  12.173   7.826
 1041    HA   PHE 577           HA       PHE 577  75.663  10.350   7.462
 1042    HB2  PHE 577           HB2      PHE 577  73.865   8.902   6.540
 1043    HB3  PHE 577           HB1      PHE 577  73.300  10.229   5.541
 1044    HD1  PHE 577           HD1      PHE 577  76.122   7.865   6.088
 1045    HD2  PHE 577           HD2      PHE 577  74.403  10.850   3.520
 1046    HE1  PHE 577           HE1      PHE 577  77.732   7.263   4.307
 1047    HE2  PHE 577           HE2      PHE 577  76.017  10.245   1.739
 1048    HZ   PHE 577           HZ       PHE 577  77.681   8.451   2.132
 1049    H    CYS 578           HN       CYS 578  73.273  12.304   5.950
 1050    HA   CYS 578           HA       CYS 578  75.229  14.381   5.110
 1051    HB2  CYS 578           HB2      CYS 578  73.779  14.751   3.115
 1052    HB3  CYS 578           HB1      CYS 578  74.462  13.132   3.099
 1053    H    LEU 579           HN       LEU 579  74.610  15.145   7.209
 1054    HA   LEU 579           HA       LEU 579  72.090  15.583   8.262
 1055    HB2  LEU 579           HB2      LEU 579  74.503  17.378   8.509
 1056    HB3  LEU 579           HB1      LEU 579  73.164  17.285   9.648
 1057    HG   LEU 579           HG       LEU 579  74.368  14.629   9.069
 1058   HD11  LEU 579          HD11      LEU 579  76.340  15.195  10.667
 1059   HD12  LEU 579          HD12      LEU 579  76.082  16.857  10.135
 1060   HD13  LEU 579          HD13      LEU 579  76.484  15.610   8.960
 1061   HD21  LEU 579          HD21      LEU 579  72.724  15.393  10.949
 1062   HD22  LEU 579          HD22      LEU 579  74.177  15.970  11.761
 1063   HD23  LEU 579          HD23      LEU 579  74.015  14.265  11.360
 1064    H    LYS 580           HN       LYS 580  72.508  16.715   5.226
 1065    HA   LYS 580           HA       LYS 580  71.685  19.503   5.785
 1066    HB2  LYS 580           HB2      LYS 580  72.136  19.970   3.573
 1067    HB3  LYS 580           HB1      LYS 580  73.148  18.552   3.775
 1068    HG2  LYS 580           HG2      LYS 580  70.323  18.444   2.629
 1069    HG3  LYS 580           HG1      LYS 580  71.780  18.575   1.659
 1070    HD2  LYS 580           HD2      LYS 580  72.525  16.443   2.212
 1071    HD3  LYS 580           HD1      LYS 580  71.579  16.383   3.694
 1072    HE2  LYS 580           HE2      LYS 580  70.776  14.995   1.632
 1073    HE3  LYS 580           HE1      LYS 580  69.594  15.905   2.572
 1074    HZ1  LYS 580           HZ1      LYS 580  69.279  16.308   0.232
 1075    HZ2  LYS 580           HZ2      LYS 580  70.897  16.796   0.057
 1076    HZ3  LYS 580           HZ3      LYS 580  69.820  17.731   0.980
 1077    H    GLN 581           HN       GLN 581  69.998  16.532   4.567
 1078    HA   GLN 581           HA       GLN 581  67.537  17.805   5.440
 1079    HB2  GLN 581           HB2      GLN 581  67.954  18.819   3.203
 1080    HB3  GLN 581           HB1      GLN 581  67.673  17.229   2.499
 1081    HG2  GLN 581           HG2      GLN 581  65.562  18.327   2.434
 1082    HG3  GLN 581           HG1      GLN 581  65.454  17.242   3.807
 1083   HE21  GLN 581          HE21      GLN 581  65.912  18.263   5.998
 1084   HE22  GLN 581          HE22      GLN 581  65.508  19.889   6.206
 1085    H    LEU 582           HN       LEU 582  65.893  16.520   5.851
 1086    HA   LEU 582           HA       LEU 582  65.901  13.727   4.835
 1087    HB2  LEU 582           HB2      LEU 582  66.874  13.919   7.161
 1088    HB3  LEU 582           HB1      LEU 582  65.299  14.467   7.701
 1089    HG   LEU 582           HG       LEU 582  64.310  12.331   6.983
 1090   HD11  LEU 582          HD11      LEU 582  66.347  10.546   6.532
 1091   HD12  LEU 582          HD12      LEU 582  66.979  11.984   5.732
 1092   HD13  LEU 582          HD13      LEU 582  65.422  11.327   5.252
 1093   HD21  LEU 582          HD21      LEU 582  66.643  12.363   8.881
 1094   HD22  LEU 582          HD22      LEU 582  65.798  10.852   8.579
 1095   HD23  LEU 582          HD23      LEU 582  64.925  12.239   9.228
 1096    H    ASN 583           HN       ASN 583  63.673  12.712   5.360
 1097    HA   ASN 583           HA       ASN 583  61.482  14.724   5.510
 1098    HB2  ASN 583           HB2      ASN 583  62.088  12.922   3.161
 1099    HB3  ASN 583           HB1      ASN 583  60.434  13.430   3.489
 1100   HD21  ASN 583          HD21      ASN 583  61.498  14.296   1.123
 1101   HD22  ASN 583          HD22      ASN 583  61.885  15.941   1.204
 1102    H    LYS 584           HN       LYS 584  59.893  13.938   6.793
 1103    HA   LYS 584           HA       LYS 584  60.015  11.511   8.182
 1104    HB2  LYS 584           HB2      LYS 584  57.613  11.868   8.648
 1105    HB3  LYS 584           HB1      LYS 584  58.545  13.348   8.844
 1106    HG2  LYS 584           HG2      LYS 584  57.268  14.407   7.270
 1107    HG3  LYS 584           HG1      LYS 584  57.704  13.193   6.065
 1108    HD2  LYS 584           HD2      LYS 584  55.329  13.141   6.221
 1109    HD3  LYS 584           HD1      LYS 584  55.899  11.721   7.093
 1110    HE2  LYS 584           HE2      LYS 584  54.285  12.665   8.543
 1111    HE3  LYS 584           HE1      LYS 584  55.821  13.225   9.200
 1112    HZ1  LYS 584           HZ1      LYS 584  54.979  15.257   9.003
 1113    HZ2  LYS 584           HZ2      LYS 584  53.682  14.728   8.040
 1114    HZ3  LYS 584           HZ3      LYS 584  55.180  15.094   7.327
 1115    H    GLY 585           HN       GLY 585  59.159  12.080   4.924
 1116    HA2  GLY 585           HA2      GLY 585  57.524   9.651   4.651
 1117    HA3  GLY 585           HA1      GLY 585  57.952  10.777   3.364
 1118    H    THR 586           HN       THR 586  60.781  10.644   4.393
 1119    HA   THR 586           HA       THR 586  61.547   7.920   3.421
 1120    HB   THR 586           HB       THR 586  63.032   8.768   1.833
 1121    HG1  THR 586           HG1      THR 586  64.263  10.342   2.421
 1122   HG21  THR 586          HG21      THR 586  60.958  10.980   1.946
 1123   HG22  THR 586          HG22      THR 586  60.640   9.372   1.296
 1124   HG23  THR 586          HG23      THR 586  61.833  10.415   0.520
 1125    H    PHE 587           HN       PHE 587  61.371   9.215   6.097
 1126    HA   PHE 587           HA       PHE 587  64.227   9.544   6.823
 1127    HB2  PHE 587           HB2      PHE 587  63.531  10.422   8.857
 1128    HB3  PHE 587           HB1      PHE 587  62.252  10.936   7.780
 1129    HD1  PHE 587           HD1      PHE 587  60.441   8.760   7.479
 1130    HD2  PHE 587           HD2      PHE 587  62.715   9.834  10.964
 1131    HE1  PHE 587           HE1      PHE 587  58.783   7.613   8.915
 1132    HE2  PHE 587           HE2      PHE 587  61.053   8.684  12.398
 1133    HZ   PHE 587           HZ       PHE 587  59.088   7.573  11.374
 1134    H    LYS 588           HN       LYS 588  65.331   7.755   7.004
 1135    HA   LYS 588           HA       LYS 588  64.137   5.316   8.217
 1136    HB2  LYS 588           HB2      LYS 588  65.778   5.756   5.959
 1137    HB3  LYS 588           HB1      LYS 588  66.857   5.105   7.150
 1138    HG2  LYS 588           HG2      LYS 588  65.807   3.393   5.639
 1139    HG3  LYS 588           HG1      LYS 588  65.628   3.084   7.352
 1140    HD2  LYS 588           HD2      LYS 588  63.592   2.735   5.740
 1141    HD3  LYS 588           HD1      LYS 588  63.327   3.455   7.307
 1142    HE2  LYS 588           HE2      LYS 588  62.888   5.559   6.398
 1143    HE3  LYS 588           HE1      LYS 588  63.889   5.266   4.994
 1144    HZ1  LYS 588           HZ1      LYS 588  61.830   3.385   5.014
 1145    HZ2  LYS 588           HZ2      LYS 588  62.117   4.622   3.885
 1146    HZ3  LYS 588           HZ3      LYS 588  61.142   4.918   5.244
 1147    H    GLU 589           HN       GLU 589  65.500   4.194   9.834
 1148    HA   GLU 589           HA       GLU 589  67.583   5.823  11.134
 1149    HB2  GLU 589           HB2      GLU 589  65.824   6.887  12.234
 1150    HB3  GLU 589           HB1      GLU 589  64.833   5.437  12.292
 1151    HG2  GLU 589           HG2      GLU 589  66.166   4.501  14.050
 1152    HG3  GLU 589           HG1      GLU 589  67.426   5.721  13.840
 1153    H    GLN 590           HN       GLN 590  68.656   4.754  12.791
 1154    HA   GLN 590           HA       GLN 590  68.086   1.996  13.468
 1155    HB2  GLN 590           HB2      GLN 590  70.159   1.045  12.615
 1156    HB3  GLN 590           HB1      GLN 590  69.283   1.773  11.280
 1157    HG2  GLN 590           HG2      GLN 590  70.669   3.815  11.525
 1158    HG3  GLN 590           HG1      GLN 590  71.594   2.997  12.766
 1159   HE21  GLN 590          HE21      GLN 590  70.707   0.602  10.641
 1160   HE22  GLN 590          HE22      GLN 590  72.064   0.606   9.621
 1161    H    ASN 591           HN       ASN 591  69.213   1.474  15.369
 1162    HA   ASN 591           HA       ASN 591  70.053   2.048  17.467
 1163    HB2  ASN 591           HB2      ASN 591  72.328   3.636  16.739
 1164    HB3  ASN 591           HB1      ASN 591  72.300   1.942  17.184
 1165   HD21  ASN 591          HD21      ASN 591  70.931   0.858  14.991
 1166   HD22  ASN 591          HD22      ASN 591  71.836   1.094  13.575
 1167    H    ASP 592           HN       ASP 592  68.186   3.986  16.084
 1168    HA   ASP 592           HA       ASP 592  67.089   5.904  16.914
 1169    HB2  ASP 592           HB2      ASP 592  69.498   6.671  18.541
 1170    HB3  ASP 592           HB1      ASP 592  67.796   7.003  18.851
 1171    H    LYS 593           HN       LYS 593  70.005   5.816  15.263
 1172    HA   LYS 593           HA       LYS 593  70.365   8.700  14.977
 1173    HB2  LYS 593           HB2      LYS 593  71.575   6.369  13.526
 1174    HB3  LYS 593           HB1      LYS 593  72.140   8.032  13.453
 1175    HG2  LYS 593           HG2      LYS 593  72.227   7.785  16.088
 1176    HG3  LYS 593           HG1      LYS 593  72.295   6.065  15.716
 1177    HD2  LYS 593           HD2      LYS 593  74.255   6.421  14.285
 1178    HD3  LYS 593           HD1      LYS 593  74.179   8.159  14.586
 1179    HE2  LYS 593           HE2      LYS 593  74.348   6.266  16.925
 1180    HE3  LYS 593           HE1      LYS 593  75.805   6.653  16.015
 1181    HZ1  LYS 593           HZ1      LYS 593  75.795   8.315  17.562
 1182    HZ2  LYS 593           HZ2      LYS 593  74.099   8.414  17.625
 1183    HZ3  LYS 593           HZ3      LYS 593  74.944   9.074  16.306
 1184    HA   PRO 594           HA       PRO 594  67.170   8.717  11.660
 1185    HB2  PRO 594           HB2      PRO 594  68.457  11.338  11.080
 1186    HB3  PRO 594           HB1      PRO 594  66.751  10.963  11.327
 1187    HG2  PRO 594           HG2      PRO 594  68.255  12.258  13.173
 1188    HG3  PRO 594           HG1      PRO 594  66.921  11.185  13.624
 1189    HD2  PRO 594           HD2      PRO 594  69.859  10.723  13.870
 1190    HD3  PRO 594           HD1      PRO 594  68.519  10.005  14.794
 1191    H    TYR 595           HN       TYR 595  67.277   8.809   9.260
 1192    HA   TYR 595           HA       TYR 595  69.818   9.066   7.883
 1193    HB2  TYR 595           HB2      TYR 595  68.819   6.333   8.640
 1194    HB3  TYR 595           HB1      TYR 595  69.668   6.551   7.120
 1195    HD1  TYR 595           HD1      TYR 595  71.940   7.924   7.313
 1196    HD2  TYR 595           HD2      TYR 595  70.087   5.753  10.503
 1197    HE1  TYR 595           HE1      TYR 595  74.151   7.661   8.426
 1198    HE2  TYR 595           HE2      TYR 595  72.293   5.494  11.606
 1199    HH   TYR 595           HH       TYR 595  74.490   5.769  11.404
 1200    H    CYS 596           HN       CYS 596  69.461   9.132   5.613
 1201    HA   CYS 596           HA       CYS 596  66.657   9.003   4.712
 1202    HB2  CYS 596           HB2      CYS 596  69.087   9.051   2.901
 1203    HB3  CYS 596           HB1      CYS 596  67.463   9.624   2.556
 1204    H    GLN 597           HN       GLN 597  65.975   7.231   3.221
 1205    HA   GLN 597           HA       GLN 597  66.950   4.719   4.094
 1206    HB2  GLN 597           HB2      GLN 597  64.847   4.540   3.094
 1207    HB3  GLN 597           HB1      GLN 597  65.253   5.647   1.814
 1208    HG2  GLN 597           HG2      GLN 597  65.178   3.626   0.653
 1209    HG3  GLN 597           HG1      GLN 597  66.880   3.707   1.057
 1210   HE21  GLN 597          HE21      GLN 597  66.375   3.123   3.942
 1211   HE22  GLN 597          HE22      GLN 597  65.994   1.490   4.018
 1212    H    ASN 598           HN       ASN 598  67.555   6.393   1.009
 1213    HA   ASN 598           HA       ASN 598  69.504   4.744  -0.075
 1214    HB2  ASN 598           HB2      ASN 598  69.960   7.713  -0.137
 1215    HB3  ASN 598           HB1      ASN 598  70.075   6.541  -1.443
 1216   HD21  ASN 598          HD21      ASN 598  67.698   5.285  -1.479
 1217   HD22  ASN 598          HD22      ASN 598  66.421   6.373  -1.704
 1218    H    CYS 599           HN       CYS 599  69.796   6.885   2.682
 1219    HA   CYS 599           HA       CYS 599  72.710   6.639   2.781
 1220    HB2  CYS 599           HB2      CYS 599  70.662   7.825   4.672
 1221    HB3  CYS 599           HB1      CYS 599  72.386   7.783   5.019
 1222    H    PHE 600           HN       PHE 600  70.077   5.679   5.035
 1223    HA   PHE 600           HA       PHE 600  71.639   3.954   6.637
 1224    HB2  PHE 600           HB2      PHE 600  69.549   4.344   7.578
 1225    HB3  PHE 600           HB1      PHE 600  68.714   4.217   6.035
 1226    HD1  PHE 600           HD1      PHE 600  70.073   2.389   8.919
 1227    HD2  PHE 600           HD2      PHE 600  68.079   2.020   5.133
 1228    HE1  PHE 600           HE1      PHE 600  69.465   0.047   9.467
 1229    HE2  PHE 600           HE2      PHE 600  67.472  -0.321   5.680
 1230    HZ   PHE 600           HZ       PHE 600  68.165  -1.307   7.848
 1231    H    LEU 601           HN       LEU 601  69.519   3.032   3.894
 1232    HA   LEU 601           HA       LEU 601  70.110   0.323   3.841
 1233    HB2  LEU 601           HB2      LEU 601  68.825   0.401   1.966
 1234    HB3  LEU 601           HB1      LEU 601  68.790   2.142   2.170
 1235    HG   LEU 601           HG       LEU 601  70.874   2.277   0.750
 1236   HD11  LEU 601          HD11      LEU 601  70.688  -0.158  -0.699
 1237   HD12  LEU 601          HD12      LEU 601  70.715  -0.626   0.998
 1238   HD13  LEU 601          HD13      LEU 601  72.012   0.363   0.337
 1239   HD21  LEU 601          HD21      LEU 601  68.505   0.918  -0.562
 1240   HD22  LEU 601          HD22      LEU 601  69.655   2.004  -1.338
 1241   HD23  LEU 601          HD23      LEU 601  68.551   2.621  -0.112
 1242    H    LYS 602           HN       LYS 602  72.020   2.964   2.438
 1243    HA   LYS 602           HA       LYS 602  73.991   1.402   1.164
 1244    HB2  LYS 602           HB2      LYS 602  73.743   3.938   1.115
 1245    HB3  LYS 602           HB1      LYS 602  74.534   3.965   2.681
 1246    HG2  LYS 602           HG2      LYS 602  76.342   4.274   1.267
 1247    HG3  LYS 602           HG1      LYS 602  76.376   2.526   1.435
 1248    HD2  LYS 602           HD2      LYS 602  74.971   2.404  -0.675
 1249    HD3  LYS 602           HD1      LYS 602  75.231   4.136  -0.860
 1250    HE2  LYS 602           HE2      LYS 602  77.766   3.547  -0.627
 1251    HE3  LYS 602           HE1      LYS 602  77.246   1.909  -0.992
 1252    HZ1  LYS 602           HZ1      LYS 602  77.665   4.001  -2.775
 1253    HZ2  LYS 602           HZ2      LYS 602  75.999   3.671  -2.780
 1254    HZ3  LYS 602           HZ3      LYS 602  77.114   2.435  -3.119
 1255    H    LEU 603           HN       LEU 603  73.434   1.941   4.562
 1256    HA   LEU 603           HA       LEU 603  76.132   1.024   5.315
 1257    HB2  LEU 603           HB2      LEU 603  73.880   1.407   7.269
 1258    HB3  LEU 603           HB1      LEU 603  75.607   1.697   7.487
 1259    HG   LEU 603           HG       LEU 603  73.700   3.320   5.793
 1260   HD11  LEU 603          HD11      LEU 603  75.368   4.470   7.991
 1261   HD12  LEU 603          HD12      LEU 603  73.940   3.537   8.440
 1262   HD13  LEU 603          HD13      LEU 603  73.777   4.957   7.410
 1263   HD21  LEU 603          HD21      LEU 603  75.805   4.810   5.576
 1264   HD22  LEU 603          HD22      LEU 603  75.744   3.353   4.590
 1265   HD23  LEU 603          HD23      LEU 603  76.705   3.376   6.066
 1266    H    PHE 604           HN       PHE 604  72.804  -0.136   6.053
 1267    HA   PHE 604           HA       PHE 604  73.978  -2.866   6.488
 1268    HB2  PHE 604           HB2      PHE 604  71.681  -1.358   7.703
 1269    HB3  PHE 604           HB1      PHE 604  71.571  -3.117   7.622
 1270    HD1  PHE 604           HD1      PHE 604  73.667  -0.287   8.873
 1271    HD2  PHE 604           HD2      PHE 604  72.840  -4.503   9.083
 1272    HE1  PHE 604           HE1      PHE 604  75.141  -0.483  10.855
 1273    HE2  PHE 604           HE2      PHE 604  74.318  -4.692  11.064
 1274    HZ   PHE 604           HZ       PHE 604  75.469  -2.682  11.950
 1275    H    CYS 605           HN       CYS 605  71.643  -1.068   4.581
 1276    HA   CYS 605           HA       CYS 605  70.115  -1.799   2.936
 1277    HB2  CYS 605           HB2      CYS 605  71.160  -2.940   1.175
 1278    HB3  CYS 605           HB1      CYS 605  72.523  -2.213   2.018
 1279    HG   CYS 605           HG       CYS 605  73.401  -4.508   2.269
  Start of MODEL    2
    1    H    MET   1           HT1      MET   1  92.812 -29.376  16.175
    2    HA   MET   1           HA       MET   1  90.998 -28.861  14.584
    3    HB2  MET   1           HB2      MET   1  91.823 -26.488  14.243
    4    HB3  MET   1           HB1      MET   1  93.129 -27.153  13.264
    5    HG2  MET   1           HG2      MET   1  91.234 -28.351  11.941
    6    HG3  MET   1           HG1      MET   1  90.161 -27.190  12.722
    7    HE1  MET   1           HE1      MET   1  90.746 -26.074   8.974
    8    HE2  MET   1           HE2      MET   1  89.492 -26.324  10.185
    9    HE3  MET   1           HE3      MET   1  90.547 -27.660   9.733
   10    H    ALA   2           HN       ALA   2  93.324 -28.521  12.181
   11    HA   ALA   2           HA       ALA   2  94.310 -31.305  12.309
   12    HB1  ALA   2           HB1      ALA   2  92.727 -30.328   9.922
   13    HB2  ALA   2           HB2      ALA   2  92.022 -31.330  11.192
   14    HB3  ALA   2           HB3      ALA   2  93.343 -31.956  10.204
   15    H    LEU   3           HN       LEU   3  93.898 -28.552  10.101
   16    HA   LEU   3           HA       LEU   3  96.155 -28.782   8.512
   17    HB2  LEU   3           HB2      LEU   3  94.887 -26.343   9.762
   18    HB3  LEU   3           HB1      LEU   3  96.170 -26.222   8.559
   19    HG   LEU   3           HG       LEU   3  93.586 -27.743   8.123
   20   HD11  LEU   3          HD11      LEU   3  94.364 -24.894   7.480
   21   HD12  LEU   3          HD12      LEU   3  92.938 -25.465   8.347
   22   HD13  LEU   3          HD13      LEU   3  93.078 -25.732   6.609
   23   HD21  LEU   3          HD21      LEU   3  94.437 -27.188   5.650
   24   HD22  LEU   3          HD22      LEU   3  95.036 -28.593   6.520
   25   HD23  LEU   3          HD23      LEU   3  96.007 -27.125   6.451
   26    H    ASP   4           HN       ASP   4  96.276 -26.294  10.930
   27    HA   ASP   4           HA       ASP   4  98.081 -25.515  12.209
   28    HB2  ASP   4           HB2      ASP   4  97.220 -27.310  13.636
   29    HB3  ASP   4           HB1      ASP   4  98.175 -28.486  12.736
   30    H    GLY   5           HN       GLY   5  98.588 -26.538   9.403
   31    HA2  GLY   5           HA2      GLY   5 101.183 -27.761   9.292
   32    HA3  GLY   5           HA1      GLY   5 100.428 -26.829   7.993
   33    H    ILE   6           HN       ILE   6 100.072 -24.725  10.168
   34    HA   ILE   6           HA       ILE   6 102.745 -23.439   9.794
   35    HB   ILE   6           HB       ILE   6 100.968 -21.423  10.534
   36   HG12  ILE   6          HG12      ILE   6  99.137 -23.201  10.316
   37   HG13  ILE   6          HG11      ILE   6  98.899 -21.707   9.419
   38   HG21  ILE   6          HG21      ILE   6 100.910 -20.893   8.074
   39   HG22  ILE   6          HG22      ILE   6 101.764 -22.413   7.804
   40   HG23  ILE   6          HG23      ILE   6 102.519 -21.132   8.753
   41   HD11  ILE   6          HD11      ILE   6  98.724 -24.251   8.358
   42   HD12  ILE   6          HD12      ILE   6 100.345 -23.765   7.868
   43   HD13  ILE   6          HD13      ILE   6  98.955 -22.778   7.421
   44    H    ARG   7           HN       ARG   7 100.481 -22.116  12.088
   45    HA   ARG   7           HA       ARG   7 101.718 -23.497  14.364
   46    HB2  ARG   7           HB2      ARG   7 102.346 -21.240  15.376
   47    HB3  ARG   7           HB1      ARG   7 103.374 -21.838  14.081
   48    HG2  ARG   7           HG2      ARG   7 101.097 -20.156  13.158
   49    HG3  ARG   7           HG1      ARG   7 102.294 -19.312  14.132
   50    HD2  ARG   7           HD2      ARG   7 104.067 -19.920  12.625
   51    HD3  ARG   7           HD1      ARG   7 103.010 -21.015  11.742
   52    HE   ARG   7           HE       ARG   7 101.832 -18.442  11.635
   53   HH11  ARG   7          HH11      ARG   7 102.120 -17.172   9.789
   54   HH12  ARG   7          HH12      ARG   7 103.454 -17.493   8.732
   55   HH21  ARG   7          HH21      ARG   7 104.660 -20.136  10.624
   56   HH22  ARG   7          HH22      ARG   7 104.891 -19.171   9.205
   57    H    MET   8           HN       MET   8 100.462 -20.280  14.809
   58    HA   MET   8           HA       MET   8  97.740 -21.317  15.336
   59    HB2  MET   8           HB2      MET   8  98.363 -19.777  17.663
   60    HB3  MET   8           HB1      MET   8  98.009 -21.488  17.567
   61    HG2  MET   8           HG2      MET   8 100.315 -22.060  17.230
   62    HG3  MET   8           HG1      MET   8 100.794 -20.385  17.049
   63    HE1  MET   8           HE1      MET   8 102.502 -21.236  20.333
   64    HE2  MET   8           HE2      MET   8 102.549 -20.044  19.036
   65    HE3  MET   8           HE3      MET   8 102.478 -21.760  18.644
   66    HA   PRO   9           HA       PRO   9  97.533 -16.369  15.597
   67    HB2  PRO   9           HB2      PRO   9 100.155 -16.048  14.138
   68    HB3  PRO   9           HB1      PRO   9  99.327 -14.897  15.213
   69    HG2  PRO   9           HG2      PRO   9 101.345 -16.302  16.125
   70    HG3  PRO   9           HG1      PRO   9  99.884 -16.091  17.111
   71    HD2  PRO   9           HD2      PRO   9 100.801 -18.525  15.640
   72    HD3  PRO   9           HD1      PRO   9  99.911 -18.381  17.151
   73    H    ASP  10           HN       ASP  10  99.189 -18.243  13.192
   74    HA   ASP  10           HA       ASP  10  97.349 -17.253  11.034
   75    HB2  ASP  10           HB2      ASP  10  99.886 -16.926  10.778
   76    HB3  ASP  10           HB1      ASP  10  99.986 -18.678  10.625
   77    H    GLY  11           HN       GLY  11  98.568 -19.946  12.814
   78    HA2  GLY  11           HA2      GLY  11  97.281 -21.940  11.059
   79    HA3  GLY  11           HA1      GLY  11  98.208 -22.277  12.515
   80    H    CYS  12           HN       CYS  12  96.038 -19.781  13.097
   81    HA   CYS  12           HA       CYS  12  93.689 -21.406  13.662
   82    HB2  CYS  12           HB2      CYS  12  94.984 -22.182  15.524
   83    HB3  CYS  12           HB1      CYS  12  95.530 -20.548  15.900
   84    HG   CYS  12           HG       CYS  12  93.402 -20.105  17.112
   85    H    TYR  13           HN       TYR  13  95.431 -18.355  14.188
   86    HA   TYR  13           HA       TYR  13  94.652 -16.170  14.396
   87    HB2  TYR  13           HB2      TYR  13  92.521 -17.458  12.670
   88    HB3  TYR  13           HB1      TYR  13  92.427 -15.765  13.145
   89    HD1  TYR  13           HD1      TYR  13  94.618 -14.351  12.764
   90    HD2  TYR  13           HD2      TYR  13  93.705 -18.018  10.720
   91    HE1  TYR  13           HE1      TYR  13  96.187 -13.731  10.947
   92    HE2  TYR  13           HE2      TYR  13  95.275 -17.397   8.904
   93    HH   TYR  13           HH       TYR  13  96.263 -15.335   7.957
   94    H    ALA  14           HN       ALA  14  91.362 -17.255  14.287
   95    HA   ALA  14           HA       ALA  14  90.672 -18.042  16.810
   96    HB1  ALA  14           HB1      ALA  14  91.622 -16.359  18.094
   97    HB2  ALA  14           HB2      ALA  14  90.076 -15.582  17.756
   98    HB3  ALA  14           HB3      ALA  14  91.502 -15.171  16.800
   99    H    ASP  15           HN       ASP  15  89.997 -15.606  14.367
  100    HA   ASP  15           HA       ASP  15  87.329 -16.724  13.987
  101    HB2  ASP  15           HB2      ASP  15  87.142 -15.102  15.945
  102    HB3  ASP  15           HB1      ASP  15  87.521 -13.820  14.793
  103    H    GLY  16           HN       GLY  16  90.048 -15.406  12.757
  104    HA2  GLY  16           HA2      GLY  16  90.567 -14.739  10.555
  105    HA3  GLY  16           HA1      GLY  16  88.861 -14.950  10.146
  106    H    THR  17           HN       THR  17  90.116 -12.946  12.756
  107    HA   THR  17           HA       THR  17  88.654 -10.631  11.627
  108    HB   THR  17           HB       THR  17  88.420 -11.092  14.031
  109    HG1  THR  17           HG1      THR  17  89.956  -8.881  14.279
  110   HG21  THR  17          HG21      THR  17  91.315 -10.375  14.418
  111   HG22  THR  17          HG22      THR  17  90.848 -12.051  14.134
  112   HG23  THR  17          HG23      THR  17  90.219 -11.186  15.535
  113    H    TRP  18           HN       TRP  18  89.655  -9.181  10.425
  114    HA   TRP  18           HA       TRP  18  92.551  -8.600  10.830
  115    HB2  TRP  18           HB2      TRP  18  92.213  -8.237   8.110
  116    HB3  TRP  18           HB1      TRP  18  92.932  -9.663   8.839
  117    HD1  TRP  18           HD1      TRP  18  89.491  -8.389   7.653
  118    HE1  TRP  18           HE1      TRP  18  88.094 -10.427   6.917
  119    HE3  TRP  18           HE3      TRP  18  92.690 -12.162   8.923
  120    HZ2  TRP  18           HZ2      TRP  18  88.304 -13.277   6.870
  121    HZ3  TRP  18           HZ3      TRP  18  92.067 -14.527   8.520
  122    HH2  TRP  18           HH2      TRP  18  89.880 -15.089   7.496
  123    H    GLU  19           HN       GLU  19  92.767  -6.454  11.208
  124    HA   GLU  19           HA       GLU  19  90.496  -4.672  10.810
  125    HB2  GLU  19           HB2      GLU  19  92.740  -3.052  11.400
  126    HB3  GLU  19           HB1      GLU  19  91.541  -3.630  12.542
  127    HG2  GLU  19           HG2      GLU  19  93.803  -4.217  13.278
  128    HG3  GLU  19           HG1      GLU  19  92.874  -5.668  12.907
  129    H    LEU  20           HN       LEU  20  90.124  -3.385   9.067
  130    HA   LEU  20           HA       LEU  20  92.036  -3.506   6.833
  131    HB2  LEU  20           HB2      LEU  20  89.217  -3.178   7.066
  132    HB3  LEU  20           HB1      LEU  20  89.805  -1.657   6.413
  133    HG   LEU  20           HG       LEU  20  89.283  -3.124   4.568
  134   HD11  LEU  20          HD11      LEU  20  91.165  -2.747   3.338
  135   HD12  LEU  20          HD12      LEU  20  92.252  -3.425   4.545
  136   HD13  LEU  20          HD13      LEU  20  91.614  -1.792   4.749
  137   HD21  LEU  20          HD21      LEU  20  89.717  -5.234   6.128
  138   HD22  LEU  20          HD22      LEU  20  91.326  -5.166   5.413
  139   HD23  LEU  20          HD23      LEU  20  89.914  -5.361   4.384
  140    H    SER  21           HN       SER  21  93.415  -1.855   6.311
  141    HA   SER  21           HA       SER  21  93.757   0.268   8.277
  142    HB2  SER  21           HB2      SER  21  95.531  -1.002   6.753
  143    HB3  SER  21           HB1      SER  21  95.169   0.313   5.638
  144    HG   SER  21           HG       SER  21  96.108   1.684   6.953
  145    H    VAL  22           HN       VAL  22  93.418   2.469   7.971
  146    HA   VAL  22           HA       VAL  22  92.123   3.309   5.433
  147    HB   VAL  22           HB       VAL  22  90.944   3.667   8.195
  148   HG11  VAL  22          HG11      VAL  22  89.276   5.158   6.984
  149   HG12  VAL  22          HG12      VAL  22  90.444   5.261   5.667
  150   HG13  VAL  22          HG13      VAL  22  90.857   5.881   7.268
  151   HG21  VAL  22          HG21      VAL  22  88.941   2.816   7.021
  152   HG22  VAL  22          HG22      VAL  22  90.290   1.689   6.868
  153   HG23  VAL  22          HG23      VAL  22  89.860   2.746   5.515
  154    H    HIS  23           HN       HIS  23  93.600   4.665   4.692
  155    HA   HIS  23           HA       HIS  23  95.138   6.445   6.439
  156    HB2  HIS  23           HB2      HIS  23  94.914   5.929   3.483
  157    HB3  HIS  23           HB1      HIS  23  95.749   7.378   4.044
  158    HD1  HIS  23           HD1      HIS  23  98.198   6.910   3.999
  159    HD2  HIS  23           HD2      HIS  23  96.041   3.612   5.359
  160    HE1  HIS  23           HE1      HIS  23  99.904   5.144   4.620
  161    H    VAL  24           HN       VAL  24  93.875   8.003   7.383
  162    HA   VAL  24           HA       VAL  24  91.563   9.126   6.078
  163    HB   VAL  24           HB       VAL  24  93.069  10.402   8.355
  164   HG11  VAL  24          HG11      VAL  24  90.862  11.286   7.160
  165   HG12  VAL  24          HG12      VAL  24  91.031  11.355   8.911
  166   HG13  VAL  24          HG13      VAL  24  90.090  10.065   8.172
  167   HG21  VAL  24          HG21      VAL  24  91.339   7.912   8.374
  168   HG22  VAL  24          HG22      VAL  24  91.670   8.861   9.825
  169   HG23  VAL  24          HG23      VAL  24  92.994   8.076   8.964
  170    H    THR  25           HN       THR  25  92.042  10.194   4.155
  171    HA   THR  25           HA       THR  25  94.335  11.987   3.951
  172    HB   THR  25           HB       THR  25  93.906  11.949   1.704
  173    HG1  THR  25           HG1      THR  25  92.114  12.809   0.907
  174   HG21  THR  25          HG21      THR  25  93.303   9.604   2.402
  175   HG22  THR  25          HG22      THR  25  92.543  10.126   0.898
  176   HG23  THR  25          HG23      THR  25  91.611  10.099   2.395
  177    H    ASP  26           HN       ASP  26  93.658  14.380   3.098
  178    HA   ASP  26           HA       ASP  26  92.798  16.447   3.834
  179    HB2  ASP  26           HB2      ASP  26  90.670  15.236   2.982
  180    HB3  ASP  26           HB1      ASP  26  90.319  14.930   4.682
  181    H    LEU  27           HN       LEU  27  93.717  14.047   5.714
  182    HA   LEU  27           HA       LEU  27  93.640  15.643   8.179
  183    HB2  LEU  27           HB2      LEU  27  92.132  13.119   7.760
  184    HB3  LEU  27           HB1      LEU  27  93.075  13.158   9.244
  185    HG   LEU  27           HG       LEU  27  91.305  15.500   8.505
  186   HD11  LEU  27          HD11      LEU  27  89.954  13.347   8.470
  187   HD12  LEU  27          HD12      LEU  27  89.437  14.542   9.655
  188   HD13  LEU  27          HD13      LEU  27  90.386  13.150  10.170
  189   HD21  LEU  27          HD21      LEU  27  91.409  15.993  10.827
  190   HD22  LEU  27          HD22      LEU  27  93.049  15.502  10.404
  191   HD23  LEU  27          HD23      LEU  27  91.977  14.374  11.230
  192    H    ASN  28           HN       ASN  28  94.676  12.801   6.392
  193    HA   ASN  28           HA       ASN  28  96.817  11.919   6.115
  194    HB2  ASN  28           HB2      ASN  28  97.521  14.369   6.600
  195    HB3  ASN  28           HB1      ASN  28  97.926  13.785   8.208
  196   HD21  ASN  28          HD21      ASN  28  98.489  11.069   6.828
  197   HD22  ASN  28          HD22      ASN  28 100.065  11.254   6.233
  198    H    ARG  29           HN       ARG  29  94.867  11.340   8.545
  199    HA   ARG  29           HA       ARG  29  96.859  10.161  10.384
  200    HB2  ARG  29           HB2      ARG  29  93.846   9.993  10.482
  201    HB3  ARG  29           HB1      ARG  29  94.969   9.531  11.757
  202    HG2  ARG  29           HG2      ARG  29  95.717  11.808  12.023
  203    HG3  ARG  29           HG1      ARG  29  94.777  12.325  10.627
  204    HD2  ARG  29           HD2      ARG  29  93.391  12.928  12.426
  205    HD3  ARG  29           HD1      ARG  29  92.740  11.363  11.941
  206    HE   ARG  29           HE       ARG  29  94.801  11.154  13.995
  207   HH11  ARG  29          HH11      ARG  29  94.079  10.460  16.024
  208   HH12  ARG  29          HH12      ARG  29  92.382  10.462  16.371
  209   HH21  ARG  29          HH21      ARG  29  91.478  11.684  13.253
  210   HH22  ARG  29          HH22      ARG  29  90.908  11.155  14.801
  211    H    ASP  30           HN       ASP  30  95.998   7.879  11.104
  212    HA   ASP  30           HA       ASP  30  95.235   6.227   8.761
  213    HB2  ASP  30           HB2      ASP  30  97.748   5.889  10.417
  214    HB3  ASP  30           HB1      ASP  30  97.029   4.558   9.507
  215    H    VAL  31           HN       VAL  31  93.523   5.145   9.439
  216    HA   VAL  31           HA       VAL  31  93.399   4.275  12.315
  217    HB   VAL  31           HB       VAL  31  91.091   4.864  10.462
  218   HG11  VAL  31          HG11      VAL  31  91.346   4.327  13.428
  219   HG12  VAL  31          HG12      VAL  31  90.498   3.345  12.234
  220   HG13  VAL  31          HG13      VAL  31  89.873   4.935  12.674
  221   HG21  VAL  31          HG21      VAL  31  92.437   6.917  10.928
  222   HG22  VAL  31          HG22      VAL  31  92.273   6.605  12.656
  223   HG23  VAL  31          HG23      VAL  31  90.848   6.984  11.691
  224    H    THR  32           HN       THR  32  92.314   2.280  12.693
  225    HA   THR  32           HA       THR  32  92.081   0.455  10.341
  226    HB   THR  32           HB       THR  32  93.038  -1.055  12.594
  227    HG1  THR  32           HG1      THR  32  95.120   0.115  12.713
  228   HG21  THR  32          HG21      THR  32  93.453  -1.316  10.027
  229   HG22  THR  32          HG22      THR  32  94.744  -1.760  11.141
  230   HG23  THR  32          HG23      THR  32  94.799  -0.208  10.301
  231    H    LEU  33           HN       LEU  33  90.262  -0.788  10.440
  232    HA   LEU  33           HA       LEU  33  88.595  -0.637  12.924
  233    HB2  LEU  33           HB2      LEU  33  87.977  -0.601   9.988
  234    HB3  LEU  33           HB1      LEU  33  86.777  -1.248  11.088
  235    HG   LEU  33           HG       LEU  33  86.536   1.213  10.546
  236   HD11  LEU  33          HD11      LEU  33  85.703   1.740  12.644
  237   HD12  LEU  33          HD12      LEU  33  87.027   0.954  13.501
  238   HD13  LEU  33          HD13      LEU  33  85.768  -0.018  12.735
  239   HD21  LEU  33          HD21      LEU  33  89.108   1.528  10.706
  240   HD22  LEU  33          HD22      LEU  33  88.836   1.632  12.446
  241   HD23  LEU  33          HD23      LEU  33  88.076   2.798  11.366
  242    H    ARG  34           HN       ARG  34  88.710  -2.558  13.974
  243    HA   ARG  34           HA       ARG  34  89.583  -5.007  12.919
  244    HB2  ARG  34           HB2      ARG  34  89.047  -4.153  15.414
  245    HB3  ARG  34           HB1      ARG  34  87.535  -4.961  15.108
  246    HG2  ARG  34           HG2      ARG  34  89.020  -6.522  16.161
  247    HG3  ARG  34           HG1      ARG  34  88.737  -7.013  14.490
  248    HD2  ARG  34           HD2      ARG  34  91.199  -6.808  15.566
  249    HD3  ARG  34           HD1      ARG  34  90.893  -6.616  13.866
  250    HE   ARG  34           HE       ARG  34  91.318  -4.290  14.113
  251   HH11  ARG  34          HH11      ARG  34  92.117  -2.547  15.308
  252   HH12  ARG  34          HH12      ARG  34  92.260  -2.688  17.028
  253   HH21  ARG  34          HH21      ARG  34  91.036  -5.929  17.131
  254   HH22  ARG  34          HH22      ARG  34  91.649  -4.602  18.059
  255    H    VAL  35           HN       VAL  35  88.599  -5.894  11.167
  256    HA   VAL  35           HA       VAL  35  85.638  -6.326  11.275
  257    HB   VAL  35           HB       VAL  35  85.597  -5.881   8.808
  258   HG11  VAL  35          HG11      VAL  35  85.819  -3.367   9.063
  259   HG12  VAL  35          HG12      VAL  35  86.443  -3.660  10.686
  260   HG13  VAL  35          HG13      VAL  35  84.797  -4.143  10.273
  261   HG21  VAL  35          HG21      VAL  35  88.398  -4.876   9.373
  262   HG22  VAL  35          HG22      VAL  35  87.500  -4.543   7.894
  263   HG23  VAL  35          HG23      VAL  35  87.947  -6.199   8.300
  264    H    THR  36           HN       THR  36  85.267  -7.664   9.015
  265    HA   THR  36           HA       THR  36  87.267  -9.844   8.822
  266    HB   THR  36           HB       THR  36  85.288 -11.470   8.867
  267    HG1  THR  36           HG1      THR  36  84.006  -9.186   9.140
  268   HG21  THR  36          HG21      THR  36  86.734 -11.598  10.707
  269   HG22  THR  36          HG22      THR  36  85.154 -11.336  11.442
  270   HG23  THR  36          HG23      THR  36  86.287  -9.995  11.291
  271    H    GLY  37           HN       GLY  37  86.423 -11.323   6.891
  272    HA2  GLY  37           HA2      GLY  37  85.880  -9.483   4.692
  273    HA3  GLY  37           HA1      GLY  37  86.207 -11.202   4.527
  274    H    GLU  38           HN       GLU  38  83.767  -9.436   6.385
  275    HA   GLU  38           HA       GLU  38  81.616 -10.467   4.656
  276    HB2  GLU  38           HB2      GLU  38  80.405 -11.384   6.679
  277    HB3  GLU  38           HB1      GLU  38  81.823 -12.309   6.189
  278    HG2  GLU  38           HG2      GLU  38  83.150 -11.411   7.938
  279    HG3  GLU  38           HG1      GLU  38  81.982 -10.133   8.274
  280    H    VAL  39           HN       VAL  39  82.970  -7.962   6.295
  281    HA   VAL  39           HA       VAL  39  80.479  -6.840   7.378
  282    HB   VAL  39           HB       VAL  39  81.780  -5.094   8.241
  283   HG11  VAL  39          HG11      VAL  39  83.800  -7.313   8.137
  284   HG12  VAL  39          HG12      VAL  39  82.294  -7.484   9.037
  285   HG13  VAL  39          HG13      VAL  39  83.438  -6.219   9.473
  286   HG21  VAL  39          HG21      VAL  39  83.832  -5.795   6.129
  287   HG22  VAL  39          HG22      VAL  39  84.161  -4.697   7.465
  288   HG23  VAL  39          HG23      VAL  39  82.930  -4.284   6.280
  289    H    HIS  40           HN       HIS  40  79.334  -5.152   6.463
  290    HA   HIS  40           HA       HIS  40  79.633  -4.837   3.568
  291    HB2  HIS  40           HB2      HIS  40  77.758  -2.930   4.754
  292    HB3  HIS  40           HB1      HIS  40  77.422  -4.281   3.673
  293    HD1  HIS  40           HD1      HIS  40  77.889  -3.520   7.362
  294    HD2  HIS  40           HD2      HIS  40  76.294  -6.506   4.928
  295    HE1  HIS  40           HE1      HIS  40  76.693  -5.136   8.902
  296    H    ILE  41           HN       ILE  41  80.266  -2.888   2.504
  297    HA   ILE  41           HA       ILE  41  82.365  -1.387   3.600
  298    HB   ILE  41           HB       ILE  41  80.305  -0.537   1.545
  299   HG12  ILE  41          HG12      ILE  41  83.146  -1.505   1.146
  300   HG13  ILE  41          HG11      ILE  41  81.749  -2.580   1.116
  301   HG21  ILE  41          HG21      ILE  41  81.302   1.489   2.241
  302   HG22  ILE  41          HG22      ILE  41  82.261   1.005   0.843
  303   HG23  ILE  41          HG23      ILE  41  82.881   0.736   2.473
  304   HD11  ILE  41          HD11      ILE  41  80.893  -1.651  -0.830
  305   HD12  ILE  41          HD12      ILE  41  82.626  -1.515  -1.130
  306   HD13  ILE  41          HD13      ILE  41  81.711  -0.108  -0.588
  307    H    GLY  42           HN       GLY  42  78.976  -0.343   3.302
  308    HA2  GLY  42           HA2      GLY  42  79.203   2.028   4.827
  309    HA3  GLY  42           HA1      GLY  42  77.712   1.108   4.644
  310    H    GLY  43           HN       GLY  43  79.632  -1.165   5.722
  311    HA2  GLY  43           HA2      GLY  43  78.663  -1.017   8.463
  312    HA3  GLY  43           HA1      GLY  43  79.745  -2.251   7.805
  313    H    VAL  44           HN       VAL  44  81.531  -0.195   6.708
  314    HA   VAL  44           HA       VAL  44  83.175   0.250   9.109
  315    HB   VAL  44           HB       VAL  44  83.523   0.360   6.127
  316   HG11  VAL  44          HG11      VAL  44  85.184   2.008   8.059
  317   HG12  VAL  44          HG12      VAL  44  84.356   2.568   6.606
  318   HG13  VAL  44          HG13      VAL  44  85.768   1.521   6.469
  319   HG21  VAL  44          HG21      VAL  44  84.188  -1.570   7.593
  320   HG22  VAL  44          HG22      VAL  44  85.402  -0.521   8.331
  321   HG23  VAL  44          HG23      VAL  44  85.504  -0.920   6.616
  322    H    MET  45           HN       MET  45  81.413   2.168   6.667
  323    HA   MET  45           HA       MET  45  82.116   4.777   7.425
  324    HB2  MET  45           HB2      MET  45  79.464   3.582   6.591
  325    HB3  MET  45           HB1      MET  45  79.621   5.305   6.907
  326    HG2  MET  45           HG2      MET  45  81.655   5.120   5.217
  327    HG3  MET  45           HG1      MET  45  80.804   3.678   4.676
  328    HE1  MET  45           HE1      MET  45  77.320   4.979   3.625
  329    HE2  MET  45           HE2      MET  45  77.928   4.047   4.982
  330    HE3  MET  45           HE3      MET  45  78.499   3.686   3.352
  331    H    LEU  46           HN       LEU  46  79.942   2.485   8.978
  332    HA   LEU  46           HA       LEU  46  78.960   4.318  10.983
  333    HB2  LEU  46           HB2      LEU  46  78.008   2.007  10.188
  334    HB3  LEU  46           HB1      LEU  46  79.119   1.329  11.375
  335    HG   LEU  46           HG       LEU  46  78.016   3.219  12.950
  336   HD11  LEU  46          HD11      LEU  46  76.570   4.141  11.198
  337   HD12  LEU  46          HD12      LEU  46  75.591   3.398  12.462
  338   HD13  LEU  46          HD13      LEU  46  75.846   2.552  10.934
  339   HD21  LEU  46          HD21      LEU  46  76.300   1.472  13.627
  340   HD22  LEU  46          HD22      LEU  46  77.968   0.901  13.566
  341   HD23  LEU  46          HD23      LEU  46  76.853   0.509  12.256
  342    H    LYS  47           HN       LYS  47  81.075   1.459  11.437
  343    HA   LYS  47           HA       LYS  47  81.954   2.102  14.020
  344    HB2  LYS  47           HB2      LYS  47  83.707   0.778  11.942
  345    HB3  LYS  47           HB1      LYS  47  83.762   0.570  13.692
  346    HG2  LYS  47           HG2      LYS  47  81.567  -0.494  13.674
  347    HG3  LYS  47           HG1      LYS  47  81.420  -0.208  11.941
  348    HD2  LYS  47           HD2      LYS  47  83.476  -1.584  11.579
  349    HD3  LYS  47           HD1      LYS  47  83.490  -1.953  13.302
  350    HE2  LYS  47           HE2      LYS  47  81.046  -2.496  11.614
  351    HE3  LYS  47           HE1      LYS  47  82.365  -3.663  11.719
  352    HZ1  LYS  47           HZ1      LYS  47  80.566  -4.001  13.374
  353    HZ2  LYS  47           HZ2      LYS  47  80.986  -2.515  14.082
  354    HZ3  LYS  47           HZ3      LYS  47  82.102  -3.796  14.064
  355    H    LEU  48           HN       LEU  48  83.748   2.814  10.980
  356    HA   LEU  48           HA       LEU  48  85.888   4.198  12.058
  357    HB2  LEU  48           HB2      LEU  48  84.958   3.820   9.520
  358    HB3  LEU  48           HB1      LEU  48  84.604   5.527   9.700
  359    HG   LEU  48           HG       LEU  48  87.299   5.132  10.684
  360   HD11  LEU  48          HD11      LEU  48  87.112   3.017   9.246
  361   HD12  LEU  48          HD12      LEU  48  88.449   4.105   8.897
  362   HD13  LEU  48          HD13      LEU  48  87.021   4.101   7.862
  363   HD21  LEU  48          HD21      LEU  48  86.199   6.388   8.163
  364   HD22  LEU  48          HD22      LEU  48  87.876   6.539   8.697
  365   HD23  LEU  48          HD23      LEU  48  86.569   7.204   9.684
  366    H    VAL  49           HN       VAL  49  82.853   5.733  11.033
  367    HA   VAL  49           HA       VAL  49  83.346   8.298  12.131
  368    HB   VAL  49           HB       VAL  49  80.750   6.806  11.703
  369   HG11  VAL  49          HG11      VAL  49  80.259   8.523  13.307
  370   HG12  VAL  49          HG12      VAL  49  79.756   9.140  11.737
  371   HG13  VAL  49          HG13      VAL  49  81.270   9.690  12.454
  372   HG21  VAL  49          HG21      VAL  49  80.626   8.085   9.656
  373   HG22  VAL  49          HG22      VAL  49  82.219   7.332   9.717
  374   HG23  VAL  49          HG23      VAL  49  82.035   9.041  10.114
  375    H    GLU  50           HN       GLU  50  81.629   5.515  13.636
  376    HA   GLU  50           HA       GLU  50  80.838   6.635  16.046
  377    HB2  GLU  50           HB2      GLU  50  82.025   3.918  15.476
  378    HB3  GLU  50           HB1      GLU  50  81.493   4.355  17.093
  379    HG2  GLU  50           HG2      GLU  50  79.726   4.558  14.644
  380    HG3  GLU  50           HG1      GLU  50  79.755   3.158  15.711
  381    H    LYS  51           HN       LYS  51  84.110   5.601  15.171
  382    HA   LYS  51           HA       LYS  51  85.244   6.174  17.756
  383    HB2  LYS  51           HB2      LYS  51  86.593   6.025  15.053
  384    HB3  LYS  51           HB1      LYS  51  87.389   5.931  16.625
  385    HG2  LYS  51           HG2      LYS  51  85.850   3.971  17.152
  386    HG3  LYS  51           HG1      LYS  51  85.405   3.981  15.450
  387    HD2  LYS  51           HD2      LYS  51  88.122   3.452  16.660
  388    HD3  LYS  51           HD1      LYS  51  87.146   2.384  15.666
  389    HE2  LYS  51           HE2      LYS  51  88.791   3.197  14.178
  390    HE3  LYS  51           HE1      LYS  51  87.376   4.186  13.831
  391    HZ1  LYS  51           HZ1      LYS  51  89.846   5.109  14.496
  392    HZ2  LYS  51           HZ2      LYS  51  88.973   5.255  15.946
  393    HZ3  LYS  51           HZ3      LYS  51  88.408   6.007  14.532
  394    H    LEU  52           HN       LEU  52  84.502   8.091  14.931
  395    HA   LEU  52           HA       LEU  52  86.160  10.347  15.726
  396    HB2  LEU  52           HB2      LEU  52  85.281   9.611  13.334
  397    HB3  LEU  52           HB1      LEU  52  83.868  10.554  13.785
  398    HG   LEU  52           HG       LEU  52  85.650  12.383  14.442
  399   HD11  LEU  52          HD11      LEU  52  87.649  11.040  14.121
  400   HD12  LEU  52          HD12      LEU  52  87.619  12.304  12.896
  401   HD13  LEU  52          HD13      LEU  52  87.168  10.655  12.471
  402   HD21  LEU  52          HD21      LEU  52  85.156  11.782  11.510
  403   HD22  LEU  52          HD22      LEU  52  85.467  13.362  12.226
  404   HD23  LEU  52          HD23      LEU  52  83.958  12.521  12.571
  405    H    ASP  53           HN       ASP  53  82.665  10.336  15.126
  406    HA   ASP  53           HA       ASP  53  80.875  11.121  16.375
  407    HB2  ASP  53           HB2      ASP  53  82.290   9.884  18.172
  408    HB3  ASP  53           HB1      ASP  53  82.678  11.495  18.741
  409    H    VAL  54           HN       VAL  54  80.990  12.984  15.032
  410    HA   VAL  54           HA       VAL  54  81.188  15.431  16.532
  411    HB   VAL  54           HB       VAL  54  83.527  15.203  16.288
  412   HG11  VAL  54          HG11      VAL  54  83.594  13.430  14.683
  413   HG12  VAL  54          HG12      VAL  54  84.539  14.769  14.027
  414   HG13  VAL  54          HG13      VAL  54  82.908  14.461  13.426
  415   HG21  VAL  54          HG21      VAL  54  82.502  17.441  15.587
  416   HG22  VAL  54          HG22      VAL  54  82.738  16.922  13.918
  417   HG23  VAL  54          HG23      VAL  54  84.129  17.128  14.982
  418    H    LYS  55           HN       LYS  55  80.352  17.243  15.367
  419    HA   LYS  55           HA       LYS  55  78.445  16.570  13.336
  420    HB2  LYS  55           HB2      LYS  55  79.028  18.800  15.000
  421    HB3  LYS  55           HB1      LYS  55  79.111  19.419  13.361
  422    HG2  LYS  55           HG2      LYS  55  76.727  17.707  13.998
  423    HG3  LYS  55           HG1      LYS  55  76.790  19.272  14.766
  424    HD2  LYS  55           HD2      LYS  55  77.125  20.351  12.557
  425    HD3  LYS  55           HD1      LYS  55  76.982  18.775  11.785
  426    HE2  LYS  55           HE2      LYS  55  74.802  19.664  11.631
  427    HE3  LYS  55           HE1      LYS  55  74.710  18.604  13.037
  428    HZ1  LYS  55           HZ1      LYS  55  74.092  21.266  12.970
  429    HZ2  LYS  55           HZ2      LYS  55  75.613  21.221  13.727
  430    HZ3  LYS  55           HZ3      LYS  55  74.317  20.324  14.363
  431    H    LYS  56           HN       LYS  56  81.241  15.870  12.638
  432    HA   LYS  56           HA       LYS  56  82.053  17.715  10.531
  433    HB2  LYS  56           HB2      LYS  56  83.568  16.114  11.887
  434    HB3  LYS  56           HB1      LYS  56  82.959  14.842  10.832
  435    HG2  LYS  56           HG2      LYS  56  83.832  15.945   8.874
  436    HG3  LYS  56           HG1      LYS  56  84.239  17.389   9.802
  437    HD2  LYS  56           HD2      LYS  56  85.877  16.124  11.112
  438    HD3  LYS  56           HD1      LYS  56  85.443  14.644  10.258
  439    HE2  LYS  56           HE2      LYS  56  86.416  17.089   8.777
  440    HE3  LYS  56           HE1      LYS  56  87.540  15.901   9.436
  441    HZ1  LYS  56           HZ1      LYS  56  86.340  15.742   7.019
  442    HZ2  LYS  56           HZ2      LYS  56  85.356  14.737   7.972
  443    HZ3  LYS  56           HZ3      LYS  56  87.024  14.436   7.857
  444    H    ASP  57           HN       ASP  57  82.319  16.697   8.225
  445    HA   ASP  57           HA       ASP  57  79.674  15.629   7.455
  446    HB2  ASP  57           HB2      ASP  57  81.948  16.415   5.622
  447    HB3  ASP  57           HB1      ASP  57  80.228  16.338   5.254
  448    H    TRP  58           HN       TRP  58  79.909  13.417   8.118
  449    HA   TRP  58           HA       TRP  58  82.173  11.829   7.209
  450    HB2  TRP  58           HB2      TRP  58  79.492  10.732   8.034
  451    HB3  TRP  58           HB1      TRP  58  81.065   9.984   8.199
  452    HD1  TRP  58           HD1      TRP  58  82.680  12.118   9.764
  453    HE1  TRP  58           HE1      TRP  58  82.007  12.744  12.186
  454    HE3  TRP  58           HE3      TRP  58  77.809  10.639   9.734
  455    HZ2  TRP  58           HZ2      TRP  58  79.690  12.620  13.873
  456    HZ3  TRP  58           HZ3      TRP  58  76.386  10.900  11.745
  457    HH2  TRP  58           HH2      TRP  58  77.323  11.893  13.815
  458    H    SER  59           HN       SER  59  78.730  12.007   6.387
  459    HA   SER  59           HA       SER  59  78.433  10.185   4.371
  460    HB2  SER  59           HB2      SER  59  76.790  11.752   3.368
  461    HB3  SER  59           HB1      SER  59  76.641  11.658   5.118
  462    HG   SER  59           HG       SER  59  78.388  13.519   4.706
  463    H    ASP  60           HN       ASP  60  79.521  13.543   3.779
  464    HA   ASP  60           HA       ASP  60  80.118  13.263   1.047
  465    HB2  ASP  60           HB2      ASP  60  80.233  15.441   2.079
  466    HB3  ASP  60           HB1      ASP  60  81.471  14.897   3.211
  467    H    HIS  61           HN       HIS  61  82.052  12.454   3.892
  468    HA   HIS  61           HA       HIS  61  84.279  11.451   2.267
  469    HB2  HIS  61           HB2      HIS  61  83.724  11.485   5.237
  470    HB3  HIS  61           HB1      HIS  61  85.184  10.810   4.524
  471    HD1  HIS  61           HD1      HIS  61  86.671  12.667   5.618
  472    HD2  HIS  61           HD2      HIS  61  83.776  14.130   3.001
  473    HE1  HIS  61           HE1      HIS  61  87.251  15.096   5.197
  474    H    ALA  62           HN       ALA  62  84.349   9.477   1.469
  475    HA   ALA  62           HA       ALA  62  82.923   7.244   2.869
  476    HB1  ALA  62           HB1      ALA  62  82.596   6.369   0.433
  477    HB2  ALA  62           HB2      ALA  62  82.874   8.047  -0.040
  478    HB3  ALA  62           HB3      ALA  62  81.517   7.640   1.009
  479    H    LEU  63           HN       LEU  63  83.860   5.073   1.681
  480    HA   LEU  63           HA       LEU  63  86.812   5.374   1.925
  481    HB2  LEU  63           HB2      LEU  63  85.217   2.816   1.658
  482    HB3  LEU  63           HB1      LEU  63  86.898   2.975   2.140
  483    HG   LEU  63           HG       LEU  63  85.604   2.624   4.118
  484   HD11  LEU  63          HD11      LEU  63  86.350   4.427   5.431
  485   HD12  LEU  63          HD12      LEU  63  86.092   5.594   4.136
  486   HD13  LEU  63          HD13      LEU  63  87.431   4.449   4.037
  487   HD21  LEU  63          HD21      LEU  63  83.571   3.570   4.614
  488   HD22  LEU  63          HD22      LEU  63  83.477   3.753   2.866
  489   HD23  LEU  63          HD23      LEU  63  83.972   5.115   3.870
  490    H    TRP  64           HN       TRP  64  88.232   4.870   0.311
  491    HA   TRP  64           HA       TRP  64  87.119   4.140  -2.386
  492    HB2  TRP  64           HB2      TRP  64  87.732   6.189  -3.183
  493    HB3  TRP  64           HB1      TRP  64  88.157   6.665  -1.564
  494    HD1  TRP  64           HD1      TRP  64  90.845   5.346  -1.000
  495    HE1  TRP  64           HE1      TRP  64  92.936   5.828  -2.416
  496    HE3  TRP  64           HE3      TRP  64  88.641   7.129  -5.247
  497    HZ2  TRP  64           HZ2      TRP  64  93.597   6.880  -4.989
  498    HZ3  TRP  64           HZ3      TRP  64  90.028   7.887  -7.155
  499    HH2  TRP  64           HH2      TRP  64  92.501   7.768  -7.031
  500    H    TRP  65           HN       TRP  65  88.617   2.929  -3.705
  501    HA   TRP  65           HA       TRP  65  90.815   1.646  -2.120
  502    HB2  TRP  65           HB2      TRP  65  88.847   0.244  -3.012
  503    HB3  TRP  65           HB1      TRP  65  89.534   0.512  -4.611
  504    HD1  TRP  65           HD1      TRP  65  92.537   0.403  -2.745
  505    HE1  TRP  65           HE1      TRP  65  93.533  -1.954  -2.563
  506    HE3  TRP  65           HE3      TRP  65  88.461  -2.386  -4.066
  507    HZ2  TRP  65           HZ2      TRP  65  92.727  -4.670  -2.940
  508    HZ3  TRP  65           HZ3      TRP  65  88.613  -4.857  -4.147
  509    HH2  TRP  65           HH2      TRP  65  90.738  -6.001  -3.586
  510    H    GLU  66           HN       GLU  66  92.505   3.095  -2.684
  511    HA   GLU  66           HA       GLU  66  92.959   4.204  -5.236
  512    HB2  GLU  66           HB2      GLU  66  95.372   4.340  -4.517
  513    HB3  GLU  66           HB1      GLU  66  94.209   5.028  -3.392
  514    HG2  GLU  66           HG2      GLU  66  94.228   2.896  -2.109
  515    HG3  GLU  66           HG1      GLU  66  95.457   2.284  -3.210
  516    H    LYS  67           HN       LYS  67  93.519   0.917  -4.167
  517    HA   LYS  67           HA       LYS  67  95.432   0.280  -6.252
  518    HB2  LYS  67           HB2      LYS  67  93.420  -1.630  -5.031
  519    HB3  LYS  67           HB1      LYS  67  94.954  -2.043  -5.788
  520    HG2  LYS  67           HG2      LYS  67  94.620  -0.469  -3.222
  521    HG3  LYS  67           HG1      LYS  67  95.125  -2.152  -3.340
  522    HD2  LYS  67           HD2      LYS  67  97.020  -1.266  -4.866
  523    HD3  LYS  67           HD1      LYS  67  96.608   0.321  -4.213
  524    HE2  LYS  67           HE2      LYS  67  98.239  -0.380  -2.693
  525    HE3  LYS  67           HE1      LYS  67  96.767  -0.925  -1.884
  526    HZ1  LYS  67           HZ1      LYS  67  97.074  -3.105  -2.882
  527    HZ2  LYS  67           HZ2      LYS  67  98.429  -2.670  -1.954
  528    HZ3  LYS  67           HZ3      LYS  67  98.493  -2.580  -3.649
  529    H    LYS  68           HN       LYS  68  92.243   1.178  -6.167
  530    HA   LYS  68           HA       LYS  68  91.720   0.212  -8.938
  531    HB2  LYS  68           HB2      LYS  68  89.472   0.521  -6.955
  532    HB3  LYS  68           HB1      LYS  68  89.558  -0.500  -8.387
  533    HG2  LYS  68           HG2      LYS  68  91.291  -1.021  -5.947
  534    HG3  LYS  68           HG1      LYS  68  89.678  -1.682  -6.117
  535    HD2  LYS  68           HD2      LYS  68  90.253  -2.935  -8.043
  536    HD3  LYS  68           HD1      LYS  68  91.746  -2.028  -8.279
  537    HE2  LYS  68           HE2      LYS  68  92.874  -3.192  -6.628
  538    HE3  LYS  68           HE1      LYS  68  91.418  -3.512  -5.690
  539    HZ1  LYS  68           HZ1      LYS  68  92.549  -5.395  -7.055
  540    HZ2  LYS  68           HZ2      LYS  68  91.696  -4.712  -8.356
  541    HZ3  LYS  68           HZ3      LYS  68  90.857  -5.286  -6.995
  542    H    ARG  69           HN       ARG  69  91.870   2.781  -6.693
  543    HA   ARG  69           HA       ARG  69  91.203   5.027  -6.815
  544    HB2  ARG  69           HB2      ARG  69  91.443   4.315  -9.759
  545    HB3  ARG  69           HB1      ARG  69  91.043   5.935  -9.211
  546    HG2  ARG  69           HG2      ARG  69  93.360   6.107  -9.412
  547    HG3  ARG  69           HG1      ARG  69  93.214   5.658  -7.717
  548    HD2  ARG  69           HD2      ARG  69  94.885   4.221  -8.621
  549    HD3  ARG  69           HD1      ARG  69  93.431   3.239  -8.485
  550    HE   ARG  69           HE       ARG  69  93.300   4.250 -11.059
  551   HH11  ARG  69          HH11      ARG  69  94.194   3.167 -12.831
  552   HH12  ARG  69          HH12      ARG  69  95.505   2.063 -12.583
  553   HH21  ARG  69          HH21      ARG  69  95.611   2.548  -9.151
  554   HH22  ARG  69          HH22      ARG  69  96.307   1.712 -10.499
  555    H    THR  70           HN       THR  70  89.206   3.250  -6.234
  556    HA   THR  70           HA       THR  70  86.874   4.132  -7.914
  557    HB   THR  70           HB       THR  70  87.493   1.651  -7.660
  558    HG1  THR  70           HG1      THR  70  85.518   1.997  -8.420
  559   HG21  THR  70          HG21      THR  70  87.816   2.015  -5.094
  560   HG22  THR  70          HG22      THR  70  87.085   0.516  -5.666
  561   HG23  THR  70          HG23      THR  70  86.066   1.808  -5.031
  562    H    TRP  71           HN       TRP  71  84.835   3.720  -6.350
  563    HA   TRP  71           HA       TRP  71  85.293   5.171  -3.786
  564    HB2  TRP  71           HB2      TRP  71  82.764   5.934  -4.402
  565    HB3  TRP  71           HB1      TRP  71  84.167   6.884  -4.863
  566    HD1  TRP  71           HD1      TRP  71  82.201   3.907  -6.408
  567    HE1  TRP  71           HE1      TRP  71  82.038   4.284  -8.907
  568    HE3  TRP  71           HE3      TRP  71  84.804   8.279  -6.792
  569    HZ2  TRP  71           HZ2      TRP  71  82.886   6.193 -10.875
  570    HZ3  TRP  71           HZ3      TRP  71  85.110   9.356  -9.003
  571    HH2  TRP  71           HH2      TRP  71  84.155   8.320 -11.044
  572    H    LEU  72           HN       LEU  72  85.112   3.433  -2.464
  573    HA   LEU  72           HA       LEU  72  83.567   1.147  -3.061
  574    HB2  LEU  72           HB2      LEU  72  84.475   2.181  -0.383
  575    HB3  LEU  72           HB1      LEU  72  83.950   0.533  -0.706
  576    HG   LEU  72           HG       LEU  72  86.188   1.864  -2.242
  577   HD11  LEU  72          HD11      LEU  72  87.754   0.648  -0.778
  578   HD12  LEU  72          HD12      LEU  72  86.397   0.141   0.231
  579   HD13  LEU  72          HD13      LEU  72  86.815   1.850   0.107
  580   HD21  LEU  72          HD21      LEU  72  85.097  -0.933  -2.033
  581   HD22  LEU  72          HD22      LEU  72  86.797  -0.695  -2.426
  582   HD23  LEU  72          HD23      LEU  72  85.551  -0.012  -3.469
  583    H    LEU  73           HN       LEU  73  81.580   1.886  -3.736
  584    HA   LEU  73           HA       LEU  73  79.678   2.668  -1.555
  585    HB2  LEU  73           HB2      LEU  73  78.268   3.714  -3.350
  586    HB3  LEU  73           HB1      LEU  73  79.805   4.529  -3.097
  587    HG   LEU  73           HG       LEU  73  80.599   2.857  -5.054
  588   HD11  LEU  73          HD11      LEU  73  77.626   3.230  -5.537
  589   HD12  LEU  73          HD12      LEU  73  78.478   1.698  -5.376
  590   HD13  LEU  73          HD13      LEU  73  78.778   2.727  -6.773
  591   HD21  LEU  73          HD21      LEU  73  80.751   5.281  -5.206
  592   HD22  LEU  73          HD22      LEU  73  79.014   5.413  -5.442
  593   HD23  LEU  73          HD23      LEU  73  80.019   4.672  -6.686
  594    H    LYS  74           HN       LYS  74  80.733   0.117  -3.090
  595    HA   LYS  74           HA       LYS  74  78.185  -0.994  -4.071
  596    HB2  LYS  74           HB2      LYS  74  81.006  -1.579  -4.416
  597    HB3  LYS  74           HB1      LYS  74  80.190  -3.030  -3.896
  598    HG2  LYS  74           HG2      LYS  74  80.196  -2.913  -6.343
  599    HG3  LYS  74           HG1      LYS  74  78.554  -2.819  -5.725
  600    HD2  LYS  74           HD2      LYS  74  79.170  -1.201  -7.615
  601    HD3  LYS  74           HD1      LYS  74  78.397  -0.486  -6.215
  602    HE2  LYS  74           HE2      LYS  74  80.430   0.443  -5.431
  603    HE3  LYS  74           HE1      LYS  74  81.391  -0.621  -6.446
  604    HZ1  LYS  74           HZ1      LYS  74  80.714   1.909  -7.070
  605    HZ2  LYS  74           HZ2      LYS  74  79.537   1.017  -7.909
  606    HZ3  LYS  74           HZ3      LYS  74  81.188   0.728  -8.191
  607    H    THR  75           HN       THR  75  78.276  -0.201  -1.316
  608    HA   THR  75           HA       THR  75  78.842  -2.122   0.593
  609    HB   THR  75           HB       THR  75  76.256  -0.542   0.529
  610    HG1  THR  75           HG1      THR  75  78.669   0.374   0.308
  611   HG21  THR  75          HG21      THR  75  76.132  -1.860   2.448
  612   HG22  THR  75          HG22      THR  75  76.975  -0.443   3.067
  613   HG23  THR  75          HG23      THR  75  77.881  -1.895   2.668
  614    H    HIS  76           HN       HIS  76  76.667  -2.468  -2.022
  615    HA   HIS  76           HA       HIS  76  74.774  -4.297  -0.902
  616    HB2  HIS  76           HB2      HIS  76  75.856  -4.251  -3.737
  617    HB3  HIS  76           HB1      HIS  76  74.337  -4.974  -3.208
  618    HD1  HIS  76           HD1      HIS  76  75.943  -1.529  -2.747
  619    HD2  HIS  76           HD2      HIS  76  72.285  -3.241  -3.779
  620    HE1  HIS  76           HE1      HIS  76  74.348   0.392  -3.170
  621    H    TRP  77           HN       TRP  77  78.079  -4.675  -2.000
  622    HA   TRP  77           HA       TRP  77  77.928  -7.638  -1.631
  623    HB2  TRP  77           HB2      TRP  77  80.088  -5.885  -2.835
  624    HB3  TRP  77           HB1      TRP  77  80.119  -7.634  -2.755
  625    HD1  TRP  77           HD1      TRP  77  79.249  -4.984  -5.007
  626    HE1  TRP  77           HE1      TRP  77  77.716  -5.820  -6.868
  627    HE3  TRP  77           HE3      TRP  77  77.820  -9.481  -3.057
  628    HZ2  TRP  77           HZ2      TRP  77  76.074  -8.079  -7.491
  629    HZ3  TRP  77           HZ3      TRP  77  76.268 -10.954  -4.307
  630    HH2  TRP  77           HH2      TRP  77  75.394 -10.260  -6.521
  631    H    THR  78           HN       THR  78  80.778  -7.878  -1.112
  632    HA   THR  78           HA       THR  78  81.169  -6.383   1.422
  633    HB   THR  78           HB       THR  78  81.832  -9.239   1.788
  634    HG1  THR  78           HG1      THR  78  79.303  -9.402   2.074
  635   HG21  THR  78          HG21      THR  78  80.235  -7.161   3.295
  636   HG22  THR  78          HG22      THR  78  81.735  -7.976   3.759
  637   HG23  THR  78          HG23      THR  78  80.206  -8.858   3.762
  638    H    LEU  79           HN       LEU  79  83.347  -6.977   2.324
  639    HA   LEU  79           HA       LEU  79  85.451  -6.249   0.659
  640    HB2  LEU  79           HB2      LEU  79  85.382  -7.978   3.124
  641    HB3  LEU  79           HB1      LEU  79  86.902  -7.537   2.365
  642    HG   LEU  79           HG       LEU  79  86.426  -5.164   2.738
  643   HD11  LEU  79          HD11      LEU  79  84.035  -5.057   2.537
  644   HD12  LEU  79          HD12      LEU  79  84.415  -4.607   4.198
  645   HD13  LEU  79          HD13      LEU  79  83.820  -6.225   3.843
  646   HD21  LEU  79          HD21      LEU  79  86.232  -5.287   5.324
  647   HD22  LEU  79          HD22      LEU  79  87.572  -6.154   4.570
  648   HD23  LEU  79          HD23      LEU  79  86.141  -7.038   5.104
  649    H    ASP  80           HN       ASP  80  84.853  -9.524   1.851
  650    HA   ASP  80           HA       ASP  80  86.598 -11.016   0.307
  651    HB2  ASP  80           HB2      ASP  80  85.037 -11.861   2.062
  652    HB3  ASP  80           HB1      ASP  80  83.720 -11.741   0.892
  653    H    LYS  81           HN       LYS  81  83.264 -10.197  -0.545
  654    HA   LYS  81           HA       LYS  81  83.019 -11.373  -3.014
  655    HB2  LYS  81           HB2      LYS  81  82.159  -8.523  -2.643
  656    HB3  LYS  81           HB1      LYS  81  81.327  -9.813  -3.506
  657    HG2  LYS  81           HG2      LYS  81  81.643  -9.500  -0.521
  658    HG3  LYS  81           HG1      LYS  81  80.147  -9.472  -1.439
  659    HD2  LYS  81           HD2      LYS  81  80.589 -11.845  -2.109
  660    HD3  LYS  81           HD1      LYS  81  81.947 -11.855  -0.991
  661    HE2  LYS  81           HE2      LYS  81  80.580 -11.681   0.897
  662    HE3  LYS  81           HE1      LYS  81  79.231 -11.002  -0.013
  663    HZ1  LYS  81           HZ1      LYS  81  79.379 -13.310  -1.218
  664    HZ2  LYS  81           HZ2      LYS  81  78.521 -13.132   0.237
  665    HZ3  LYS  81           HZ3      LYS  81  80.087 -13.789   0.247
  666    H    TYR  82           HN       TYR  82  84.274  -8.083  -2.487
  667    HA   TYR  82           HA       TYR  82  85.191  -7.889  -5.237
  668    HB2  TYR  82           HB2      TYR  82  84.653  -6.039  -3.327
  669    HB3  TYR  82           HB1      TYR  82  86.398  -6.119  -3.151
  670    HD1  TYR  82           HD1      TYR  82  83.941  -4.294  -4.713
  671    HD2  TYR  82           HD2      TYR  82  87.578  -6.368  -5.673
  672    HE1  TYR  82           HE1      TYR  82  84.215  -2.884  -6.733
  673    HE2  TYR  82           HE2      TYR  82  87.850  -4.959  -7.691
  674    HH   TYR  82           HH       TYR  82  86.835  -3.478  -9.046
  675    H    GLY  83           HN       GLY  83  86.760  -8.583  -2.118
  676    HA2  GLY  83           HA2      GLY  83  88.553 -10.366  -2.247
  677    HA3  GLY  83           HA1      GLY  83  89.205  -9.483  -3.628
  678    H    ILE  84           HN       ILE  84  87.941  -7.343  -1.392
  679    HA   ILE  84           HA       ILE  84  90.468  -6.180  -0.764
  680    HB   ILE  84           HB       ILE  84  87.791  -5.916   0.636
  681   HG12  ILE  84          HG12      ILE  84  89.029  -3.920  -1.265
  682   HG13  ILE  84          HG11      ILE  84  88.136  -5.299  -1.894
  683   HG21  ILE  84          HG21      ILE  84  90.345  -4.291   0.796
  684   HG22  ILE  84          HG22      ILE  84  89.508  -5.108   2.116
  685   HG23  ILE  84          HG23      ILE  84  88.785  -3.695   1.358
  686   HD11  ILE  84          HD11      ILE  84  86.826  -3.103  -1.455
  687   HD12  ILE  84          HD12      ILE  84  86.943  -3.546   0.248
  688   HD13  ILE  84          HD13      ILE  84  86.118  -4.616  -0.888
  689    H    GLN  85           HN       GLN  85  91.407  -6.025   1.426
  690    HA   GLN  85           HA       GLN  85  90.711  -7.875   3.508
  691    HB2  GLN  85           HB2      GLN  85  91.890  -9.218   1.482
  692    HB3  GLN  85           HB1      GLN  85  93.343  -8.647   2.290
  693    HG2  GLN  85           HG2      GLN  85  93.019 -10.640   3.447
  694    HG3  GLN  85           HG1      GLN  85  92.081  -9.551   4.466
  695   HE21  GLN  85          HE21      GLN  85  89.786  -9.220   2.859
  696   HE22  GLN  85          HE22      GLN  85  88.980 -10.701   2.737
  697    H    ALA  86           HN       ALA  86  93.227  -8.182   4.687
  698    HA   ALA  86           HA       ALA  86  93.691  -5.523   5.716
  699    HB1  ALA  86           HB1      ALA  86  94.943  -8.226   6.095
  700    HB2  ALA  86           HB2      ALA  86  94.109  -7.220   7.278
  701    HB3  ALA  86           HB3      ALA  86  95.742  -6.801   6.762
  702    H    ASP  87           HN       ASP  87  95.086  -7.418   3.157
  703    HA   ASP  87           HA       ASP  87  97.564  -5.902   3.020
  704    HB2  ASP  87           HB2      ASP  87  97.802  -7.045   0.807
  705    HB3  ASP  87           HB1      ASP  87  97.488  -8.171   2.130
  706    H    ALA  88           HN       ALA  88  94.356  -5.318   2.198
  707    HA   ALA  88           HA       ALA  88  95.024  -3.381   0.033
  708    HB1  ALA  88           HB1      ALA  88  93.165  -4.597  -0.655
  709    HB2  ALA  88           HB2      ALA  88  92.357  -3.263   0.168
  710    HB3  ALA  88           HB3      ALA  88  92.584  -4.809   0.990
  711    H    LYS  89           HN       LYS  89  95.558  -1.375   0.824
  712    HA   LYS  89           HA       LYS  89  94.377  -0.481   3.400
  713    HB2  LYS  89           HB2      LYS  89  96.345   1.129   1.784
  714    HB3  LYS  89           HB1      LYS  89  96.079   1.126   3.526
  715    HG2  LYS  89           HG2      LYS  89  97.195  -1.247   2.007
  716    HG3  LYS  89           HG1      LYS  89  98.188  -0.020   2.763
  717    HD2  LYS  89           HD2      LYS  89  97.586  -0.640   4.934
  718    HD3  LYS  89           HD1      LYS  89  96.097  -1.414   4.407
  719    HE2  LYS  89           HE2      LYS  89  97.818  -3.075   5.050
  720    HE3  LYS  89           HE1      LYS  89  97.346  -3.208   3.355
  721    HZ1  LYS  89           HZ1      LYS  89  99.377  -2.651   2.675
  722    HZ2  LYS  89           HZ2      LYS  89  99.887  -2.962   4.266
  723    HZ3  LYS  89           HZ3      LYS  89  99.510  -1.377   3.786
  724    H    LEU  90           HN       LEU  90  92.573   0.586   3.357
  725    HA   LEU  90           HA       LEU  90  91.729   2.051   0.920
  726    HB2  LEU  90           HB2      LEU  90  90.096   1.758   3.431
  727    HB3  LEU  90           HB1      LEU  90  89.540   1.983   1.774
  728    HG   LEU  90           HG       LEU  90  90.861  -0.476   2.925
  729   HD11  LEU  90          HD11      LEU  90  88.665  -1.509   2.194
  730   HD12  LEU  90          HD12      LEU  90  88.079   0.127   1.896
  731   HD13  LEU  90          HD13      LEU  90  88.532  -0.363   3.528
  732   HD21  LEU  90          HD21      LEU  90  90.139   0.289   0.090
  733   HD22  LEU  90          HD22      LEU  90  90.302  -1.398   0.585
  734   HD23  LEU  90          HD23      LEU  90  91.684  -0.310   0.699
  735    H    GLN  91           HN       GLN  91  90.459   4.148   1.545
  736    HA   GLN  91           HA       GLN  91  91.985   5.744   3.560
  737    HB2  GLN  91           HB2      GLN  91  91.114   6.781   0.847
  738    HB3  GLN  91           HB1      GLN  91  92.136   7.602   2.022
  739    HG2  GLN  91           HG2      GLN  91  94.003   6.292   1.508
  740    HG3  GLN  91           HG1      GLN  91  93.043   4.970   0.883
  741   HE21  GLN  91          HE21      GLN  91  91.948   8.003  -0.182
  742   HE22  GLN  91          HE22      GLN  91  92.630   7.953  -1.727
  743    H    PHE  92           HN       PHE  92  90.729   7.820   4.040
  744    HA   PHE  92           HA       PHE  92  87.769   7.429   3.708
  745    HB2  PHE  92           HB2      PHE  92  88.197   6.924   5.994
  746    HB3  PHE  92           HB1      PHE  92  89.363   8.220   6.158
  747    HD1  PHE  92           HD1      PHE  92  85.792   7.352   5.975
  748    HD2  PHE  92           HD2      PHE  92  88.622  10.544   6.464
  749    HE1  PHE  92           HE1      PHE  92  83.981   8.835   6.791
  750    HE2  PHE  92           HE2      PHE  92  86.813  12.025   7.283
  751    HZ   PHE  92           HZ       PHE  92  84.491  11.172   7.446
  752    H    THR  93           HN       THR  93  87.518   8.883   2.049
  753    HA   THR  93           HA       THR  93  88.123  11.740   2.661
  754    HB   THR  93           HB       THR  93  90.020  11.479   1.371
  755    HG1  THR  93           HG1      THR  93  89.067  11.382  -1.026
  756   HG21  THR  93          HG21      THR  93  90.239   9.712  -0.391
  757   HG22  THR  93          HG22      THR  93  88.609   9.172   0.012
  758   HG23  THR  93          HG23      THR  93  89.896   9.061   1.211
  759    HA   PRO  94           HA       PRO  94  84.370  13.217   0.824
  760    HB2  PRO  94           HB2      PRO  94  86.157  14.041  -1.454
  761    HB3  PRO  94           HB1      PRO  94  84.829  14.941  -0.692
  762    HG2  PRO  94           HG2      PRO  94  87.428  15.370  -0.064
  763    HG3  PRO  94           HG1      PRO  94  86.111  15.582   1.102
  764    HD2  PRO  94           HD2      PRO  94  88.226  13.561   1.124
  765    HD3  PRO  94           HD1      PRO  94  87.016  13.900   2.367
  766    H    TYR 541           HT1      TYR 541  48.561  35.407   2.662
  767    HA   TYR 541           HA       TYR 541  49.534  36.904   0.365
  768    HB2  TYR 541           HB2      TYR 541  48.466  37.505   3.131
  769    HB3  TYR 541           HB1      TYR 541  49.101  38.765   2.072
  770    HD1  TYR 541           HD1      TYR 541  46.693  35.888   2.043
  771    HD2  TYR 541           HD2      TYR 541  47.654  39.794   0.535
  772    HE1  TYR 541           HE1      TYR 541  44.529  35.955   0.835
  773    HE2  TYR 541           HE2      TYR 541  45.489  39.860  -0.671
  774    HH   TYR 541           HH       TYR 541  43.648  38.747  -1.202
  775    H    HIS 542           HN       HIS 542  50.358  37.557   3.732
  776    HA   HIS 542           HA       HIS 542  52.991  38.379   3.185
  777    HB2  HIS 542           HB2      HIS 542  52.301  37.058   5.803
  778    HB3  HIS 542           HB1      HIS 542  53.282  38.489   5.503
  779    HD1  HIS 542           HD1      HIS 542  49.739  37.362   5.897
  780    HD2  HIS 542           HD2      HIS 542  51.792  40.898   5.085
  781    HE1  HIS 542           HE1      HIS 542  48.055  39.239   6.134
  782    H    GLU 543           HN       GLU 543  54.898  37.096   4.446
  783    HA   GLU 543           HA       GLU 543  54.777  34.190   4.078
  784    HB2  GLU 543           HB2      GLU 543  56.736  34.258   2.441
  785    HB3  GLU 543           HB1      GLU 543  55.170  34.742   1.786
  786    HG2  GLU 543           HG2      GLU 543  55.721  37.045   1.851
  787    HG3  GLU 543           HG1      GLU 543  57.080  36.778   2.945
  788    H    ARG 544           HN       ARG 544  55.938  36.828   5.682
  789    HA   ARG 544           HA       ARG 544  58.644  35.922   6.234
  790    HB2  ARG 544           HB2      ARG 544  56.859  38.000   7.536
  791    HB3  ARG 544           HB1      ARG 544  58.497  37.669   8.075
  792    HG2  ARG 544           HG2      ARG 544  58.922  39.407   6.594
  793    HG3  ARG 544           HG1      ARG 544  59.082  38.040   5.499
  794    HD2  ARG 544           HD2      ARG 544  57.590  39.258   4.241
  795    HD3  ARG 544           HD1      ARG 544  56.408  38.487   5.294
  796    HE   ARG 544           HE       ARG 544  57.125  40.766   6.686
  797   HH11  ARG 544          HH11      ARG 544  56.051  42.739   6.421
  798   HH12  ARG 544          HH12      ARG 544  55.220  43.065   4.938
  799   HH21  ARG 544          HH21      ARG 544  56.037  40.018   3.501
  800   HH22  ARG 544          HH22      ARG 544  55.212  41.525   3.284
  801    H    ARG 545           HN       ARG 545  55.586  34.901   7.270
  802    HA   ARG 545           HA       ARG 545  56.587  33.959   9.910
  803    HB2  ARG 545           HB2      ARG 545  54.058  33.130   9.941
  804    HB3  ARG 545           HB1      ARG 545  54.439  34.818  10.224
  805    HG2  ARG 545           HG2      ARG 545  52.589  34.509   8.585
  806    HG3  ARG 545           HG1      ARG 545  53.968  35.361   7.916
  807    HD2  ARG 545           HD2      ARG 545  54.659  33.511   6.635
  808    HD3  ARG 545           HD1      ARG 545  53.738  32.384   7.617
  809    HE   ARG 545           HE       ARG 545  51.813  34.046   6.499
  810   HH11  ARG 545          HH11      ARG 545  50.821  33.593   4.518
  811   HH12  ARG 545          HH12      ARG 545  51.627  32.570   3.376
  812   HH21  ARG 545          HH21      ARG 545  54.403  32.059   5.390
  813   HH22  ARG 545          HH22      ARG 545  53.654  31.701   3.870
  814    H    GLY 546           HN       GLY 546  54.839  31.603   9.874
  815    HA2  GLY 546           HA2      GLY 546  55.089  29.848   7.753
  816    HA3  GLY 546           HA1      GLY 546  56.668  29.777   8.535
  817    H    SER 547           HN       SER 547  56.803  28.935  10.690
  818    HA   SER 547           HA       SER 547  54.470  28.009  12.133
  819    HB2  SER 547           HB2      SER 547  55.913  26.162  10.269
  820    HB3  SER 547           HB1      SER 547  55.387  25.511  11.819
  821    HG   SER 547           HG       SER 547  53.613  25.264  10.642
  822    H    LEU 548           HN       LEU 548  55.225  28.223  14.214
  823    HA   LEU 548           HA       LEU 548  57.966  28.537  14.821
  824    HB2  LEU 548           HB2      LEU 548  55.450  28.258  16.351
  825    HB3  LEU 548           HB1      LEU 548  56.885  27.758  17.238
  826    HG   LEU 548           HG       LEU 548  57.936  29.983  16.560
  827   HD11  LEU 548          HD11      LEU 548  56.647  30.701  14.728
  828   HD12  LEU 548          HD12      LEU 548  56.138  31.758  16.037
  829   HD13  LEU 548          HD13      LEU 548  55.125  30.398  15.558
  830   HD21  LEU 548          HD21      LEU 548  56.959  31.161  18.353
  831   HD22  LEU 548          HD22      LEU 548  56.773  29.462  18.786
  832   HD23  LEU 548          HD23      LEU 548  55.402  30.362  18.140
  833    H    CYS 549           HN       CYS 549  59.587  27.143  15.353
  834    HA   CYS 549           HA       CYS 549  59.061  24.263  15.010
  835    HB2  CYS 549           HB2      CYS 549  61.123  24.917  14.058
  836    HB3  CYS 549           HB1      CYS 549  61.487  26.019  15.371
  837    H    SER 550           HN       SER 550  58.002  23.498  16.768
  838    HA   SER 550           HA       SER 550  58.036  24.501  19.363
  839    HB2  SER 550           HB2      SER 550  56.371  22.920  18.847
  840    HB3  SER 550           HB1      SER 550  57.543  21.682  18.408
  841    HG   SER 550           HG       SER 550  56.628  22.487  20.881
  842    H    GLY 551           HN       GLY 551  59.437  24.589  20.896
  843    HA2  GLY 551           HA2      GLY 551  61.173  23.530  22.325
  844    HA3  GLY 551           HA1      GLY 551  61.834  22.788  20.861
  845    H    CYS 552           HN       CYS 552  61.374  25.050  19.205
  846    HA   CYS 552           HA       CYS 552  63.569  26.860  20.118
  847    HB2  CYS 552           HB2      CYS 552  62.468  25.969  17.460
  848    HB3  CYS 552           HB1      CYS 552  63.349  27.482  17.579
  849    H    GLN 553           HN       GLN 553  60.309  26.610  18.853
  850    HA   GLN 553           HA       GLN 553  58.607  28.116  18.644
  851    HB2  GLN 553           HB2      GLN 553  59.973  29.317  21.036
  852    HB3  GLN 553           HB1      GLN 553  58.381  29.806  20.451
  853    HG2  GLN 553           HG2      GLN 553  59.109  26.963  21.157
  854    HG3  GLN 553           HG1      GLN 553  58.303  28.060  22.260
  855   HE21  GLN 553          HE21      GLN 553  57.937  26.336  19.188
  856   HE22  GLN 553          HE22      GLN 553  56.241  26.402  19.145
  857    H    LYS 554           HN       LYS 554  60.154  28.475  16.779
  858    HA   LYS 554           HA       LYS 554  60.270  31.400  16.342
  859    HB2  LYS 554           HB2      LYS 554  62.505  29.480  15.633
  860    HB3  LYS 554           HB1      LYS 554  62.430  31.157  15.109
  861    HG2  LYS 554           HG2      LYS 554  62.442  30.281  18.008
  862    HG3  LYS 554           HG1      LYS 554  63.877  30.797  17.129
  863    HD2  LYS 554           HD2      LYS 554  62.449  32.946  16.599
  864    HD3  LYS 554           HD1      LYS 554  61.490  32.423  17.982
  865    HE2  LYS 554           HE2      LYS 554  63.099  33.854  18.937
  866    HE3  LYS 554           HE1      LYS 554  63.752  32.243  19.231
  867    HZ1  LYS 554           HZ1      LYS 554  64.890  32.627  16.954
  868    HZ2  LYS 554           HZ2      LYS 554  65.549  33.338  18.349
  869    HZ3  LYS 554           HZ3      LYS 554  64.612  34.268  17.280
  870    HA   PRO 555           HA       PRO 555  57.730  29.837  12.925
  871    HB2  PRO 555           HB2      PRO 555  58.881  32.123  11.426
  872    HB3  PRO 555           HB1      PRO 555  57.189  31.667  11.657
  873    HG2  PRO 555           HG2      PRO 555  58.401  33.739  13.003
  874    HG3  PRO 555           HG1      PRO 555  57.011  32.848  13.633
  875    HD2  PRO 555           HD2      PRO 555  59.799  32.821  14.597
  876    HD3  PRO 555           HD1      PRO 555  58.339  32.185  15.394
  877    H    ILE 556           HN       ILE 556  58.093  28.381  11.429
  878    HA   ILE 556           HA       ILE 556  60.837  27.918  10.412
  879    HB   ILE 556           HB       ILE 556  58.255  26.318  10.335
  880   HG12  ILE 556          HG12      ILE 556  60.827  25.477  11.671
  881   HG13  ILE 556          HG11      ILE 556  59.772  26.601  12.501
  882   HG21  ILE 556          HG21      ILE 556  59.802  24.496   9.505
  883   HG22  ILE 556          HG22      ILE 556  60.986  25.756   9.177
  884   HG23  ILE 556          HG23      ILE 556  59.432  25.764   8.342
  885   HD11  ILE 556          HD11      ILE 556  58.165  25.006  12.902
  886   HD12  ILE 556          HD12      ILE 556  59.521  23.902  12.707
  887   HD13  ILE 556          HD13      ILE 556  58.429  24.194  11.357
  888    H    THR 557           HN       THR 557  61.069  29.444   8.732
  889    HA   THR 557           HA       THR 557  58.885  29.673   6.723
  890    HB   THR 557           HB       THR 557  59.832  31.730   6.121
  891    HG1  THR 557           HG1      THR 557  61.911  31.411   5.754
  892   HG21  THR 557          HG21      THR 557  60.012  32.900   8.184
  893   HG22  THR 557          HG22      THR 557  60.693  31.494   9.004
  894   HG23  THR 557          HG23      THR 557  58.992  31.504   8.541
  895    H    GLY 558           HN       GLY 558  59.164  27.757   5.589
  896    HA2  GLY 558           HA2      GLY 558  60.475  27.659   3.220
  897    HA3  GLY 558           HA1      GLY 558  61.726  27.087   4.331
  898    H    ARG 559           HN       ARG 559  61.523  25.081   5.248
  899    HA   ARG 559           HA       ARG 559  59.222  23.380   4.368
  900    HB2  ARG 559           HB2      ARG 559  62.165  22.867   4.766
  901    HB3  ARG 559           HB1      ARG 559  61.039  21.538   5.041
  902    HG2  ARG 559           HG2      ARG 559  60.826  23.169   2.519
  903    HG3  ARG 559           HG1      ARG 559  62.061  21.927   2.637
  904    HD2  ARG 559           HD2      ARG 559  60.491  20.197   2.871
  905    HD3  ARG 559           HD1      ARG 559  59.198  21.285   3.355
  906    HE   ARG 559           HE       ARG 559  59.864  20.443   0.672
  907   HH11  ARG 559          HH11      ARG 559  59.158  21.538  -1.147
  908   HH12  ARG 559          HH12      ARG 559  58.503  23.133  -0.987
  909   HH21  ARG 559          HH21      ARG 559  58.902  23.244   2.451
  910   HH22  ARG 559          HH22      ARG 559  58.360  24.097   1.045
  911    H    CYS 560           HN       CYS 560  58.337  21.982   6.041
  912    HA   CYS 560           HA       CYS 560  59.343  22.457   8.785
  913    HB2  CYS 560           HB2      CYS 560  57.077  22.978   9.620
  914    HB3  CYS 560           HB1      CYS 560  57.691  24.212   8.515
  915    HG   CYS 560           HG       CYS 560  56.065  22.117   7.026
  916    H    ILE 561           HN       ILE 561  59.442  20.696   9.882
  917    HA   ILE 561           HA       ILE 561  58.040  18.280   8.937
  918    HB   ILE 561           HB       ILE 561  60.081  18.764  11.130
  919   HG12  ILE 561          HG12      ILE 561  60.210  17.594   8.354
  920   HG13  ILE 561          HG11      ILE 561  60.926  19.111   8.873
  921   HG21  ILE 561          HG21      ILE 561  58.569  16.777  11.557
  922   HG22  ILE 561          HG22      ILE 561  60.260  16.351  11.313
  923   HG23  ILE 561          HG23      ILE 561  59.099  16.124  10.005
  924   HD11  ILE 561          HD11      ILE 561  61.699  16.318   9.733
  925   HD12  ILE 561          HD12      ILE 561  62.249  17.776  10.563
  926   HD13  ILE 561          HD13      ILE 561  62.697  17.502   8.880
  927    H    THR 562           HN       THR 562  56.578  17.234  10.197
  928    HA   THR 562           HA       THR 562  55.523  18.700  12.579
  929    HB   THR 562           HB       THR 562  53.835  16.945  10.813
  930    HG1  THR 562           HG1      THR 562  54.865  19.321  10.229
  931   HG21  THR 562          HG21      THR 562  52.009  17.993  11.957
  932   HG22  THR 562          HG22      THR 562  53.076  19.203  12.670
  933   HG23  THR 562          HG23      THR 562  53.172  17.522  13.199
  934    H    ALA 563           HN       ALA 563  54.913  17.505  14.316
  935    HA   ALA 563           HA       ALA 563  55.707  14.622  14.306
  936    HB1  ALA 563           HB1      ALA 563  56.590  14.945  16.529
  937    HB2  ALA 563           HB2      ALA 563  55.975  16.600  16.574
  938    HB3  ALA 563           HB3      ALA 563  57.292  16.180  15.474
  939    H    MET 564           HN       MET 564  54.794  15.162  17.276
  940    HA   MET 564           HA       MET 564  52.241  13.880  17.060
  941    HB2  MET 564           HB2      MET 564  53.101  15.505  19.442
  942    HB3  MET 564           HB1      MET 564  52.226  13.972  19.402
  943    HG2  MET 564           HG2      MET 564  54.381  12.993  18.353
  944    HG3  MET 564           HG1      MET 564  55.156  14.476  18.907
  945    HE1  MET 564           HE1      MET 564  56.000  11.299  21.182
  946    HE2  MET 564           HE2      MET 564  56.154  11.895  19.531
  947    HE3  MET 564           HE3      MET 564  54.797  10.857  19.961
  948    H    ALA 565           HN       ALA 565  52.669  16.422  15.671
  949    HA   ALA 565           HA       ALA 565  50.888  17.888  14.913
  950    HB1  ALA 565           HB1      ALA 565  50.285  18.387  17.841
  951    HB2  ALA 565           HB2      ALA 565  49.373  17.235  16.857
  952    HB3  ALA 565           HB3      ALA 565  49.374  18.945  16.442
  953    H    LYS 566           HN       LYS 566  53.515  17.888  16.958
  954    HA   LYS 566           HA       LYS 566  53.813  20.808  17.171
  955    HB2  LYS 566           HB2      LYS 566  55.349  18.380  17.995
  956    HB3  LYS 566           HB1      LYS 566  56.294  19.840  17.733
  957    HG2  LYS 566           HG2      LYS 566  55.118  21.042  19.396
  958    HG3  LYS 566           HG1      LYS 566  53.812  19.860  19.451
  959    HD2  LYS 566           HD2      LYS 566  56.608  18.943  20.092
  960    HD3  LYS 566           HD1      LYS 566  55.724  19.861  21.303
  961    HE2  LYS 566           HE2      LYS 566  54.072  18.213  21.541
  962    HE3  LYS 566           HE1      LYS 566  54.369  17.539  19.933
  963    HZ1  LYS 566           HZ1      LYS 566  55.217  16.162  21.800
  964    HZ2  LYS 566           HZ2      LYS 566  56.316  17.403  22.174
  965    HZ3  LYS 566           HZ3      LYS 566  56.409  16.603  20.678
  966    H    LYS 567           HN       LYS 567  55.639  21.919  16.099
  967    HA   LYS 567           HA       LYS 567  56.149  20.798  13.376
  968    HB2  LYS 567           HB2      LYS 567  56.773  23.615  14.181
  969    HB3  LYS 567           HB1      LYS 567  56.328  22.998  12.603
  970    HG2  LYS 567           HG2      LYS 567  54.480  23.250  15.001
  971    HG3  LYS 567           HG1      LYS 567  54.471  24.279  13.579
  972    HD2  LYS 567           HD2      LYS 567  53.920  21.280  13.541
  973    HD3  LYS 567           HD1      LYS 567  52.695  22.546  13.474
  974    HE2  LYS 567           HE2      LYS 567  54.033  23.441  11.430
  975    HE3  LYS 567           HE1      LYS 567  54.765  21.839  11.412
  976    HZ1  LYS 567           HZ1      LYS 567  52.211  22.626  10.509
  977    HZ2  LYS 567           HZ2      LYS 567  52.045  21.459  11.733
  978    HZ3  LYS 567           HZ3      LYS 567  52.977  21.121  10.354
  979    H    PHE 568           HN       PHE 568  58.487  21.593  12.568
  980    HA   PHE 568           HA       PHE 568  60.442  21.711  14.767
  981    HB2  PHE 568           HB2      PHE 568  59.738  19.167  13.408
  982    HB3  PHE 568           HB1      PHE 568  61.461  19.460  13.485
  983    HD1  PHE 568           HD1      PHE 568  62.500  19.987  15.765
  984    HD2  PHE 568           HD2      PHE 568  58.513  18.449  15.318
  985    HE1  PHE 568           HE1      PHE 568  62.507  19.276  18.141
  986    HE2  PHE 568           HE2      PHE 568  58.521  17.738  17.693
  987    HZ   PHE 568           HZ       PHE 568  60.518  18.151  19.105
  988    H    HIS 569           HN       HIS 569  62.249  22.737  14.058
  989    HA   HIS 569           HA       HIS 569  62.496  23.837  11.464
  990    HB2  HIS 569           HB2      HIS 569  64.437  23.213  13.659
  991    HB3  HIS 569           HB1      HIS 569  65.070  23.732  12.109
  992    HD2  HIS 569           HD2      HIS 569  63.566  26.321  11.313
  993    HE1  HIS 569           HE1      HIS 569  63.729  27.539  15.343
  994    HA   PRO 570           HA       PRO 570  63.058  19.714   9.550
  995    HB2  PRO 570           HB2      PRO 570  64.213  21.338   7.324
  996    HB3  PRO 570           HB1      PRO 570  62.929  20.119   7.278
  997    HG2  PRO 570           HG2      PRO 570  62.439  22.807   7.088
  998    HG3  PRO 570           HG1      PRO 570  61.275  21.653   7.750
  999    HD2  PRO 570           HD2      PRO 570  62.865  23.705   9.176
 1000    HD3  PRO 570           HD1      PRO 570  61.391  22.859   9.699
 1001    H    GLU 571           HN       GLU 571  65.327  22.138  10.323
 1002    HA   GLU 571           HA       GLU 571  67.711  20.573   9.590
 1003    HB2  GLU 571           HB2      GLU 571  67.746  23.124  11.188
 1004    HB3  GLU 571           HB1      GLU 571  68.936  22.516  10.038
 1005    HG2  GLU 571           HG2      GLU 571  67.158  22.773   8.244
 1006    HG3  GLU 571           HG1      GLU 571  66.203  23.644   9.448
 1007    H    HIS 572           HN       HIS 572  66.317  22.008  12.526
 1008    HA   HIS 572           HA       HIS 572  68.155  20.773  14.331
 1009    HB2  HIS 572           HB2      HIS 572  65.290  21.576  14.948
 1010    HB3  HIS 572           HB1      HIS 572  66.620  21.445  16.098
 1011    HD2  HIS 572           HD2      HIS 572  68.706  22.947  13.752
 1012    HE1  HIS 572           HE1      HIS 572  66.438  26.347  14.760
 1013    H    PHE 573           HN       PHE 573  65.971  19.290  12.358
 1014    HA   PHE 573           HA       PHE 573  66.002  16.839  14.088
 1015    HB2  PHE 573           HB2      PHE 573  63.710  18.123  13.835
 1016    HB3  PHE 573           HB1      PHE 573  63.712  17.410  12.231
 1017    HD1  PHE 573           HD1      PHE 573  63.615  16.707  15.846
 1018    HD2  PHE 573           HD2      PHE 573  63.471  15.010  11.903
 1019    HE1  PHE 573           HE1      PHE 573  62.819  14.561  16.800
 1020    HE2  PHE 573           HE2      PHE 573  62.675  12.863  12.857
 1021    HZ   PHE 573           HZ       PHE 573  62.349  12.638  15.305
 1022    H    VAL 574           HN       VAL 574  67.993  17.078  12.464
 1023    HA   VAL 574           HA       VAL 574  67.382  16.113   9.751
 1024    HB   VAL 574           HB       VAL 574  69.854  16.323   9.439
 1025   HG11  VAL 574          HG11      VAL 574  67.907  18.446   9.974
 1026   HG12  VAL 574          HG12      VAL 574  69.078  18.314   8.677
 1027   HG13  VAL 574          HG13      VAL 574  69.565  18.999  10.210
 1028   HG21  VAL 574          HG21      VAL 574  71.164  17.407  11.207
 1029   HG22  VAL 574          HG22      VAL 574  70.430  15.936  11.848
 1030   HG23  VAL 574          HG23      VAL 574  69.731  17.521  12.239
 1031    H    CYS 575           HN       CYS 575  69.104  14.438   8.949
 1032    HA   CYS 575           HA       CYS 575  68.818  11.999  10.575
 1033    HB2  CYS 575           HB2      CYS 575  68.654  11.163   8.465
 1034    HB3  CYS 575           HB1      CYS 575  69.257  12.673   7.785
 1035    H    ALA 576           HN       ALA 576  70.635  10.833  11.514
 1036    HA   ALA 576           HA       ALA 576  73.051  12.605  11.757
 1037    HB1  ALA 576           HB1      ALA 576  73.696  10.709  13.433
 1038    HB2  ALA 576           HB2      ALA 576  72.017  10.193  13.259
 1039    HB3  ALA 576           HB3      ALA 576  72.384  11.804  13.873
 1040    H    PHE 577           HN       PHE 577  73.504  12.106   9.480
 1041    HA   PHE 577           HA       PHE 577  75.612  10.106   9.240
 1042    HB2  PHE 577           HB2      PHE 577  73.748   8.768   8.335
 1043    HB3  PHE 577           HB1      PHE 577  73.270  10.095   7.293
 1044    HD1  PHE 577           HD1      PHE 577  76.017   7.640   7.953
 1045    HD2  PHE 577           HD2      PHE 577  74.307  10.459   5.192
 1046    HE1  PHE 577           HE1      PHE 577  77.541   6.832   6.185
 1047    HE2  PHE 577           HE2      PHE 577  75.835   9.637   3.422
 1048    HZ   PHE 577           HZ       PHE 577  77.453   7.829   3.918
 1049    H    CYS 578           HN       CYS 578  73.425  12.237   7.672
 1050    HA   CYS 578           HA       CYS 578  75.554  14.143   6.848
 1051    HB2  CYS 578           HB2      CYS 578  74.226  14.594   4.799
 1052    HB3  CYS 578           HB1      CYS 578  74.737  12.914   4.831
 1053    H    LEU 579           HN       LEU 579  74.912  15.033   8.920
 1054    HA   LEU 579           HA       LEU 579  72.386  15.625   9.865
 1055    HB2  LEU 579           HB2      LEU 579  74.892  17.290  10.154
 1056    HB3  LEU 579           HB1      LEU 579  73.488  17.374  11.210
 1057    HG   LEU 579           HG       LEU 579  74.384  14.590  10.938
 1058   HD11  LEU 579          HD11      LEU 579  76.428  16.548  12.021
 1059   HD12  LEU 579          HD12      LEU 579  76.601  15.589  10.555
 1060   HD13  LEU 579          HD13      LEU 579  76.528  14.793  12.126
 1061   HD21  LEU 579          HD21      LEU 579  74.201  14.578  13.304
 1062   HD22  LEU 579          HD22      LEU 579  72.967  15.719  12.774
 1063   HD23  LEU 579          HD23      LEU 579  74.496  16.312  13.424
 1064    H    LYS 580           HN       LYS 580  72.909  16.647   6.820
 1065    HA   LYS 580           HA       LYS 580  72.206  19.486   7.282
 1066    HB2  LYS 580           HB2      LYS 580  72.738  19.868   5.073
 1067    HB3  LYS 580           HB1      LYS 580  73.675  18.411   5.343
 1068    HG2  LYS 580           HG2      LYS 580  70.883  18.407   4.117
 1069    HG3  LYS 580           HG1      LYS 580  72.373  18.432   3.190
 1070    HD2  LYS 580           HD2      LYS 580  72.996  16.286   3.846
 1071    HD3  LYS 580           HD1      LYS 580  71.982  16.319   5.284
 1072    HE2  LYS 580           HE2      LYS 580  71.209  14.917   3.209
 1073    HE3  LYS 580           HE1      LYS 580  70.033  15.892   4.091
 1074    HZ1  LYS 580           HZ1      LYS 580  71.475  16.712   1.629
 1075    HZ2  LYS 580           HZ2      LYS 580  70.371  17.676   2.489
 1076    HZ3  LYS 580           HZ3      LYS 580  69.844  16.256   1.719
 1077    H    GLN 581           HN       GLN 581  70.395  16.568   6.102
 1078    HA   GLN 581           HA       GLN 581  67.979  18.014   6.840
 1079    HB2  GLN 581           HB2      GLN 581  68.529  18.900   4.582
 1080    HB3  GLN 581           HB1      GLN 581  68.188  17.298   3.935
 1081    HG2  GLN 581           HG2      GLN 581  66.142  18.498   3.742
 1082    HG3  GLN 581           HG1      GLN 581  65.927  17.485   5.156
 1083   HE21  GLN 581          HE21      GLN 581  66.348  18.573   7.311
 1084   HE22  GLN 581          HE22      GLN 581  66.033  20.228   7.436
 1085    H    LEU 582           HN       LEU 582  66.262  16.844   7.268
 1086    HA   LEU 582           HA       LEU 582  66.108  14.028   6.346
 1087    HB2  LEU 582           HB2      LEU 582  67.063  14.229   8.682
 1088    HB3  LEU 582           HB1      LEU 582  65.513  14.878   9.181
 1089    HG   LEU 582           HG       LEU 582  64.415  12.786   8.482
 1090   HD11  LEU 582          HD11      LEU 582  66.370  10.882   8.128
 1091   HD12  LEU 582          HD12      LEU 582  67.079  12.263   7.298
 1092   HD13  LEU 582          HD13      LEU 582  65.501  11.667   6.812
 1093   HD21  LEU 582          HD21      LEU 582  65.806  11.259  10.144
 1094   HD22  LEU 582          HD22      LEU 582  64.941  12.675  10.736
 1095   HD23  LEU 582          HD23      LEU 582  66.676  12.760  10.461
 1096    H    ASN 583           HN       ASN 583  63.824  13.164   6.836
 1097    HA   ASN 583           HA       ASN 583  61.745  15.283   6.959
 1098    HB2  ASN 583           HB2      ASN 583  62.302  13.513   4.577
 1099    HB3  ASN 583           HB1      ASN 583  60.668  14.090   4.889
 1100   HD21  ASN 583          HD21      ASN 583  61.848  14.945   2.563
 1101   HD22  ASN 583          HD22      ASN 583  62.290  16.574   2.687
 1102    H    LYS 584           HN       LYS 584  60.024  14.546   8.114
 1103    HA   LYS 584           HA       LYS 584  59.979  12.101   9.492
 1104    HB2  LYS 584           HB2      LYS 584  57.507  12.527   9.699
 1105    HB3  LYS 584           HB1      LYS 584  58.511  13.899  10.166
 1106    HG2  LYS 584           HG2      LYS 584  58.239  14.888   7.926
 1107    HG3  LYS 584           HG1      LYS 584  57.252  13.520   7.430
 1108    HD2  LYS 584           HD2      LYS 584  56.599  15.595   9.537
 1109    HD3  LYS 584           HD1      LYS 584  55.777  15.344   8.002
 1110    HE2  LYS 584           HE2      LYS 584  55.337  12.930   8.930
 1111    HE3  LYS 584           HE1      LYS 584  55.678  13.672  10.497
 1112    HZ1  LYS 584           HZ1      LYS 584  53.600  14.500   8.545
 1113    HZ2  LYS 584           HZ2      LYS 584  53.992  15.371   9.949
 1114    HZ3  LYS 584           HZ3      LYS 584  53.346  13.805  10.072
 1115    H    GLY 585           HN       GLY 585  59.149  12.805   6.220
 1116    HA2  GLY 585           HA2      GLY 585  57.560  10.368   5.842
 1117    HA3  GLY 585           HA1      GLY 585  58.007  11.527   4.592
 1118    H    THR 586           HN       THR 586  60.813  11.316   5.785
 1119    HA   THR 586           HA       THR 586  61.597   8.652   4.684
 1120    HB   THR 586           HB       THR 586  63.119   9.556   3.175
 1121    HG1  THR 586           HG1      THR 586  63.262  11.532   5.103
 1122   HG21  THR 586          HG21      THR 586  61.128  11.833   3.373
 1123   HG22  THR 586          HG22      THR 586  60.766  10.279   2.621
 1124   HG23  THR 586          HG23      THR 586  62.018  11.319   1.937
 1125    H    PHE 587           HN       PHE 587  61.352   9.871   7.418
 1126    HA   PHE 587           HA       PHE 587  64.195  10.063   8.241
 1127    HB2  PHE 587           HB2      PHE 587  63.488  10.890  10.296
 1128    HB3  PHE 587           HB1      PHE 587  62.271  11.511   9.203
 1129    HD1  PHE 587           HD1      PHE 587  62.507  10.392  12.358
 1130    HD2  PHE 587           HD2      PHE 587  60.429   9.318   8.756
 1131    HE1  PHE 587           HE1      PHE 587  60.742   9.288  13.701
 1132    HE2  PHE 587           HE2      PHE 587  58.666   8.218  10.099
 1133    HZ   PHE 587           HZ       PHE 587  58.821   8.201  12.572
 1134    H    LYS 588           HN       LYS 588  65.221   8.231   8.381
 1135    HA   LYS 588           HA       LYS 588  63.903   5.799   9.484
 1136    HB2  LYS 588           HB2      LYS 588  65.554   6.257   7.238
 1137    HB3  LYS 588           HB1      LYS 588  66.619   5.521   8.394
 1138    HG2  LYS 588           HG2      LYS 588  65.499   3.898   6.839
 1139    HG3  LYS 588           HG1      LYS 588  65.296   3.543   8.539
 1140    HD2  LYS 588           HD2      LYS 588  63.256   3.339   6.902
 1141    HD3  LYS 588           HD1      LYS 588  63.016   4.008   8.497
 1142    HE2  LYS 588           HE2      LYS 588  62.665   6.160   7.669
 1143    HE3  LYS 588           HE1      LYS 588  63.663   5.887   6.259
 1144    HZ1  LYS 588           HZ1      LYS 588  61.728   5.643   5.218
 1145    HZ2  LYS 588           HZ2      LYS 588  60.867   5.365   6.656
 1146    HZ3  LYS 588           HZ3      LYS 588  61.711   4.094   5.908
 1147    H    GLU 589           HN       GLU 589  65.433   4.475  10.943
 1148    HA   GLU 589           HA       GLU 589  67.432   6.110  12.372
 1149    HB2  GLU 589           HB2      GLU 589  65.651   6.885  13.663
 1150    HB3  GLU 589           HB1      GLU 589  64.764   5.371  13.557
 1151    HG2  GLU 589           HG2      GLU 589  66.232   4.314  15.135
 1152    HG3  GLU 589           HG1      GLU 589  67.395   5.642  15.052
 1153    H    GLN 590           HN       GLN 590  68.649   4.930  13.836
 1154    HA   GLN 590           HA       GLN 590  68.323   2.074  14.153
 1155    HB2  GLN 590           HB2      GLN 590  69.590   2.675  11.849
 1156    HB3  GLN 590           HB1      GLN 590  70.964   2.836  12.935
 1157    HG2  GLN 590           HG2      GLN 590  70.151   0.516  13.879
 1158    HG3  GLN 590           HG1      GLN 590  69.294   0.429  12.376
 1159   HE21  GLN 590          HE21      GLN 590  70.577  -1.205  11.355
 1160   HE22  GLN 590          HE22      GLN 590  72.210  -0.967  10.961
 1161    H    ASN 591           HN       ASN 591  69.614   1.383  15.908
 1162    HA   ASN 591           HA       ASN 591  70.642   1.758  17.986
 1163    HB2  ASN 591           HB2      ASN 591  72.680   3.643  17.224
 1164    HB3  ASN 591           HB1      ASN 591  72.853   1.913  17.443
 1165   HD21  ASN 591          HD21      ASN 591  71.380   0.918  15.336
 1166   HD22  ASN 591          HD22      ASN 591  71.993   1.429  13.838
 1167    H    ASP 592           HN       ASP 592  68.510   3.722  17.000
 1168    HA   ASP 592           HA       ASP 592  67.364   5.442  18.133
 1169    HB2  ASP 592           HB2      ASP 592  69.813   6.113  19.746
 1170    HB3  ASP 592           HB1      ASP 592  68.114   6.283  20.181
 1171    H    LYS 593           HN       LYS 593  70.136   5.687  16.321
 1172    HA   LYS 593           HA       LYS 593  70.319   8.619  16.372
 1173    HB2  LYS 593           HB2      LYS 593  71.713   6.655  14.576
 1174    HB3  LYS 593           HB1      LYS 593  72.183   8.314  14.909
 1175    HG2  LYS 593           HG2      LYS 593  72.298   7.527  17.394
 1176    HG3  LYS 593           HG1      LYS 593  72.348   5.906  16.705
 1177    HD2  LYS 593           HD2      LYS 593  74.304   6.527  15.341
 1178    HD3  LYS 593           HD1      LYS 593  74.260   8.159  16.010
 1179    HE2  LYS 593           HE2      LYS 593  74.447   5.761  17.835
 1180    HE3  LYS 593           HE1      LYS 593  75.893   6.420  17.070
 1181    HZ1  LYS 593           HZ1      LYS 593  74.851   8.652  17.967
 1182    HZ2  LYS 593           HZ2      LYS 593  75.852   7.679  18.936
 1183    HZ3  LYS 593           HZ3      LYS 593  74.163   7.601  19.106
 1184    HA   PRO 594           HA       PRO 594  67.067   8.707  13.131
 1185    HB2  PRO 594           HB2      PRO 594  68.354  11.341  12.590
 1186    HB3  PRO 594           HB1      PRO 594  66.649  10.965  12.830
 1187    HG2  PRO 594           HG2      PRO 594  68.153  12.204  14.713
 1188    HG3  PRO 594           HG1      PRO 594  66.825  11.112  15.134
 1189    HD2  PRO 594           HD2      PRO 594  69.761  10.663  15.377
 1190    HD3  PRO 594           HD1      PRO 594  68.424   9.880  16.252
 1191    H    TYR 595           HN       TYR 595  67.145   8.943  10.680
 1192    HA   TYR 595           HA       TYR 595  69.732   9.089   9.351
 1193    HB2  TYR 595           HB2      TYR 595  68.482   6.411   9.942
 1194    HB3  TYR 595           HB1      TYR 595  69.460   6.623   8.503
 1195    HD1  TYR 595           HD1      TYR 595  69.597   5.462  11.761
 1196    HD2  TYR 595           HD2      TYR 595  71.753   7.984   9.048
 1197    HE1  TYR 595           HE1      TYR 595  71.685   5.024  13.014
 1198    HE2  TYR 595           HE2      TYR 595  73.846   7.554  10.315
 1199    HH   TYR 595           HH       TYR 595  74.760   6.554  12.061
 1200    H    CYS 596           HN       CYS 596  69.374   9.468   7.140
 1201    HA   CYS 596           HA       CYS 596  66.615   9.466   6.144
 1202    HB2  CYS 596           HB2      CYS 596  69.087   9.431   4.387
 1203    HB3  CYS 596           HB1      CYS 596  67.508  10.111   4.028
 1204    H    GLN 597           HN       GLN 597  65.878   7.792   4.556
 1205    HA   GLN 597           HA       GLN 597  66.719   5.198   5.351
 1206    HB2  GLN 597           HB2      GLN 597  64.607   5.163   4.345
 1207    HB3  GLN 597           HB1      GLN 597  65.073   6.293   3.104
 1208    HG2  GLN 597           HG2      GLN 597  64.901   4.321   1.876
 1209    HG3  GLN 597           HG1      GLN 597  66.603   4.308   2.282
 1210   HE21  GLN 597          HE21      GLN 597  66.088   3.634   5.140
 1211   HE22  GLN 597          HE22      GLN 597  65.619   2.023   5.158
 1212    H    ASN 598           HN       ASN 598  67.398   6.983   2.356
 1213    HA   ASN 598           HA       ASN 598  69.263   5.328   1.162
 1214    HB2  ASN 598           HB2      ASN 598  69.839   8.274   1.317
 1215    HB3  ASN 598           HB1      ASN 598  69.933   7.195  -0.070
 1216   HD21  ASN 598          HD21      ASN 598  67.508   6.021  -0.199
 1217   HD22  ASN 598          HD22      ASN 598  66.274   7.167  -0.366
 1218    H    CYS 599           HN       CYS 599  69.660   7.198   4.089
 1219    HA   CYS 599           HA       CYS 599  72.572   6.843   4.119
 1220    HB2  CYS 599           HB2      CYS 599  70.602   7.955   6.132
 1221    HB3  CYS 599           HB1      CYS 599  72.332   7.836   6.430
 1222    H    PHE 600           HN       PHE 600  70.009   5.893   6.450
 1223    HA   PHE 600           HA       PHE 600  71.510   3.980   7.850
 1224    HB2  PHE 600           HB2      PHE 600  69.471   4.348   8.888
 1225    HB3  PHE 600           HB1      PHE 600  68.596   4.452   7.366
 1226    HD1  PHE 600           HD1      PHE 600  70.259   2.050   9.696
 1227    HD2  PHE 600           HD2      PHE 600  67.413   2.578   6.523
 1228    HE1  PHE 600           HE1      PHE 600  69.500  -0.294   9.985
 1229    HE2  PHE 600           HE2      PHE 600  66.655   0.235   6.811
 1230    HZ   PHE 600           HZ       PHE 600  67.699  -1.201   8.543
 1231    H    LEU 601           HN       LEU 601  69.274   3.312   5.129
 1232    HA   LEU 601           HA       LEU 601  69.802   0.598   4.845
 1233    HB2  LEU 601           HB2      LEU 601  68.410   0.878   3.069
 1234    HB3  LEU 601           HB1      LEU 601  68.478   2.605   3.367
 1235    HG   LEU 601           HG       LEU 601  70.493   2.716   1.860
 1236   HD11  LEU 601          HD11      LEU 601  70.042   0.279   0.377
 1237   HD12  LEU 601          HD12      LEU 601  70.344  -0.147   2.059
 1238   HD13  LEU 601          HD13      LEU 601  71.514   0.826   1.174
 1239   HD21  LEU 601          HD21      LEU 601  69.178   2.476  -0.218
 1240   HD22  LEU 601          HD22      LEU 601  68.239   3.259   1.050
 1241   HD23  LEU 601          HD23      LEU 601  67.957   1.563   0.667
 1242    H    LYS 602           HN       LYS 602  71.720   3.315   3.580
 1243    HA   LYS 602           HA       LYS 602  73.593   1.774   2.122
 1244    HB2  LYS 602           HB2      LYS 602  73.431   4.275   2.077
 1245    HB3  LYS 602           HB1      LYS 602  74.200   4.309   3.654
 1246    HG2  LYS 602           HG2      LYS 602  75.834   4.694   1.884
 1247    HG3  LYS 602           HG1      LYS 602  76.179   3.175   2.702
 1248    HD2  LYS 602           HD2      LYS 602  75.515   1.882   0.871
 1249    HD3  LYS 602           HD1      LYS 602  74.439   3.133   0.246
 1250    HE2  LYS 602           HE2      LYS 602  76.499   2.840  -1.138
 1251    HE3  LYS 602           HE1      LYS 602  76.351   4.466  -0.473
 1252    HZ1  LYS 602           HZ1      LYS 602  78.393   2.554  -0.057
 1253    HZ2  LYS 602           HZ2      LYS 602  77.682   2.973   1.429
 1254    HZ3  LYS 602           HZ3      LYS 602  78.337   4.179   0.427
 1255    H    LEU 603           HN       LEU 603  73.184   2.062   5.546
 1256    HA   LEU 603           HA       LEU 603  75.936   1.146   6.108
 1257    HB2  LEU 603           HB2      LEU 603  73.746   1.348   8.159
 1258    HB3  LEU 603           HB1      LEU 603  75.483   1.592   8.359
 1259    HG   LEU 603           HG       LEU 603  73.548   3.394   6.894
 1260   HD11  LEU 603          HD11      LEU 603  75.354   4.064   9.213
 1261   HD12  LEU 603          HD12      LEU 603  73.725   3.430   9.455
 1262   HD13  LEU 603          HD13      LEU 603  73.959   4.963   8.617
 1263   HD21  LEU 603          HD21      LEU 603  76.566   3.385   7.048
 1264   HD22  LEU 603          HD22      LEU 603  75.663   4.863   6.713
 1265   HD23  LEU 603          HD23      LEU 603  75.549   3.493   5.612
 1266    H    PHE 604           HN       PHE 604  72.659  -0.092   6.860
 1267    HA   PHE 604           HA       PHE 604  73.835  -2.843   7.039
 1268    HB2  PHE 604           HB2      PHE 604  71.549  -1.440   8.384
 1269    HB3  PHE 604           HB1      PHE 604  71.405  -3.177   8.134
 1270    HD1  PHE 604           HD1      PHE 604  73.874  -0.626   9.397
 1271    HD2  PHE 604           HD2      PHE 604  72.333  -4.628   9.720
 1272    HE1  PHE 604           HE1      PHE 604  75.347  -1.040  11.345
 1273    HE2  PHE 604           HE2      PHE 604  73.807  -5.036  11.669
 1274    HZ   PHE 604           HZ       PHE 604  75.314  -3.243  12.482
 1275    H    CYS 605           HN       CYS 605  73.151  -1.520   4.485
 1276    HA   CYS 605           HA       CYS 605  70.733  -2.144   3.301
 1277    HB2  CYS 605           HB2      CYS 605  72.443  -1.159   1.938
 1278    HB3  CYS 605           HB1      CYS 605  73.531  -2.519   2.203
 1279    HG   CYS 605           HG       CYS 605  72.542  -3.338   0.068
  Start of MODEL    3
    1    H    MET   1           HT1      MET   1 100.530 -26.341   8.271
    2    HA   MET   1           HA       MET   1 100.735 -26.250   5.365
    3    HB2  MET   1           HB2      MET   1  98.264 -26.338   5.977
    4    HB3  MET   1           HB1      MET   1  98.498 -24.840   6.861
    5    HG2  MET   1           HG2      MET   1  99.380 -25.013   3.984
    6    HG3  MET   1           HG1      MET   1  97.682 -24.766   4.364
    7    HE1  MET   1           HE1      MET   1  96.835 -22.495   4.070
    8    HE2  MET   1           HE2      MET   1  98.062 -22.661   2.817
    9    HE3  MET   1           HE3      MET   1  97.942 -21.158   3.728
   10    H    ALA   2           HN       ALA   2  99.564 -23.548   7.225
   11    HA   ALA   2           HA       ALA   2 102.288 -22.625   7.906
   12    HB1  ALA   2           HB1      ALA   2 102.222 -20.653   6.563
   13    HB2  ALA   2           HB2      ALA   2 100.531 -20.914   6.136
   14    HB3  ALA   2           HB3      ALA   2 101.779 -21.972   5.479
   15    H    LEU   3           HN       LEU   3  98.824 -21.886   7.726
   16    HA   LEU   3           HA       LEU   3  98.671 -19.803   9.609
   17    HB2  LEU   3           HB2      LEU   3  96.792 -22.102   9.106
   18    HB3  LEU   3           HB1      LEU   3  96.384 -20.639  10.001
   19    HG   LEU   3           HG       LEU   3  97.136 -19.335   7.912
   20   HD11  LEU   3          HD11      LEU   3  98.226 -20.770   6.472
   21   HD12  LEU   3          HD12      LEU   3  96.603 -20.878   5.807
   22   HD13  LEU   3          HD13      LEU   3  97.202 -22.149   6.870
   23   HD21  LEU   3          HD21      LEU   3  94.929 -19.654   6.860
   24   HD22  LEU   3          HD22      LEU   3  94.820 -19.572   8.619
   25   HD23  LEU   3          HD23      LEU   3  94.715 -21.130   7.801
   26    H    ASP   4           HN       ASP   4  97.836 -23.175  10.202
   27    HA   ASP   4           HA       ASP   4  98.149 -22.879  13.048
   28    HB2  ASP   4           HB2      ASP   4  96.540 -24.479  12.153
   29    HB3  ASP   4           HB1      ASP   4  97.830 -25.328  11.300
   30    H    GLY   5           HN       GLY   5 100.455 -22.607  10.967
   31    HA2  GLY   5           HA2      GLY   5 102.383 -24.650  11.532
   32    HA3  GLY   5           HA1      GLY   5 102.768 -23.003  11.015
   33    H    ILE   6           HN       ILE   6 100.970 -22.244  13.362
   34    HA   ILE   6           HA       ILE   6 103.071 -22.370  15.490
   35    HB   ILE   6           HB       ILE   6 101.441 -20.194  16.100
   36   HG12  ILE   6          HG12      ILE   6 100.344 -20.588  13.841
   37   HG13  ILE   6          HG11      ILE   6 100.953 -18.963  14.133
   38   HG21  ILE   6          HG21      ILE   6 103.990 -20.300  14.500
   39   HG22  ILE   6          HG22      ILE   6 103.819 -20.068  16.240
   40   HG23  ILE   6          HG23      ILE   6 103.291 -18.807  15.127
   41   HD11  ILE   6          HD11      ILE   6 102.997 -20.665  12.892
   42   HD12  ILE   6          HD12      ILE   6 102.366 -19.105  12.374
   43   HD13  ILE   6          HD13      ILE   6 101.524 -20.586  11.930
   44    H    ARG   7           HN       ARG   7  99.870 -21.088  16.048
   45    HA   ARG   7           HA       ARG   7  98.867 -23.611  17.174
   46    HB2  ARG   7           HB2      ARG   7  98.447 -22.431  19.398
   47    HB3  ARG   7           HB1      ARG   7 100.106 -22.906  19.057
   48    HG2  ARG   7           HG2      ARG   7  99.418 -20.179  18.092
   49    HG3  ARG   7           HG1      ARG   7  99.350 -20.368  19.842
   50    HD2  ARG   7           HD2      ARG   7 101.636 -21.124  19.925
   51    HD3  ARG   7           HD1      ARG   7 101.714 -21.241  18.168
   52    HE   ARG   7           HE       ARG   7 101.055 -18.554  18.886
   53   HH11  ARG   7          HH11      ARG   7 102.690 -16.996  18.803
   54   HH12  ARG   7          HH12      ARG   7 104.348 -17.498  18.823
   55   HH21  ARG   7          HH21      ARG   7 103.599 -20.879  18.999
   56   HH22  ARG   7          HH22      ARG   7 104.863 -19.696  18.933
   57    H    MET   8           HN       MET   8  97.729 -20.605  18.492
   58    HA   MET   8           HA       MET   8  95.639 -20.353  16.420
   59    HB2  MET   8           HB2      MET   8  94.152 -20.327  18.850
   60    HB3  MET   8           HB1      MET   8  94.070 -21.503  17.556
   61    HG2  MET   8           HG2      MET   8  95.747 -22.889  18.543
   62    HG3  MET   8           HG1      MET   8  96.176 -21.684  19.740
   63    HE1  MET   8           HE1      MET   8  95.980 -23.369  21.645
   64    HE2  MET   8           HE2      MET   8  95.601 -24.628  20.473
   65    HE3  MET   8           HE3      MET   8  94.604 -24.448  21.914
   66    HA   PRO   9           HA       PRO   9  95.202 -16.405  19.329
   67    HB2  PRO   9           HB2      PRO   9  97.870 -16.837  20.672
   68    HB3  PRO   9           HB1      PRO   9  96.462 -15.916  21.252
   69    HG2  PRO   9           HG2      PRO   9  96.879 -18.303  22.210
   70    HG3  PRO   9           HG1      PRO   9  95.243 -17.841  21.688
   71    HD2  PRO   9           HD2      PRO   9  97.209 -19.627  20.290
   72    HD3  PRO   9           HD1      PRO   9  95.455 -19.755  20.434
   73    H    ASP  10           HN       ASP  10  98.085 -17.870  18.129
   74    HA   ASP  10           HA       ASP  10  98.816 -15.386  16.602
   75    HB2  ASP  10           HB2      ASP  10 100.484 -16.363  18.330
   76    HB3  ASP  10           HB1      ASP  10 100.690 -17.687  17.186
   77    H    GLY  11           HN       GLY  11  98.071 -18.764  16.534
   78    HA2  GLY  11           HA2      GLY  11  98.675 -18.993  13.639
   79    HA3  GLY  11           HA1      GLY  11  98.179 -20.305  14.702
   80    H    CYS  12           HN       CYS  12  96.314 -17.587  15.267
   81    HA   CYS  12           HA       CYS  12  94.326 -18.042  13.162
   82    HB2  CYS  12           HB2      CYS  12  93.775 -19.883  14.668
   83    HB3  CYS  12           HB1      CYS  12  93.759 -18.785  16.048
   84    HG   CYS  12           HG       CYS  12  91.602 -17.694  15.153
   85    H    TYR  13           HN       TYR  13  93.108 -17.040  16.234
   86    HA   TYR  13           HA       TYR  13  93.835 -14.242  16.078
   87    HB2  TYR  13           HB2      TYR  13  91.237 -15.164  14.842
   88    HB3  TYR  13           HB1      TYR  13  91.313 -13.583  15.618
   89    HD1  TYR  13           HD1      TYR  13  93.373 -12.081  14.932
   90    HD2  TYR  13           HD2      TYR  13  91.853 -15.343  12.584
   91    HE1  TYR  13           HE1      TYR  13  94.445 -11.127  12.910
   92    HE2  TYR  13           HE2      TYR  13  92.925 -14.387  10.563
   93    HH   TYR  13           HH       TYR  13  94.161 -12.744   9.742
   94    H    ALA  14           HN       ALA  14  90.546 -14.765  16.830
   95    HA   ALA  14           HA       ALA  14  90.687 -15.837  19.457
   96    HB1  ALA  14           HB1      ALA  14  90.962 -12.836  19.232
   97    HB2  ALA  14           HB2      ALA  14  91.941 -13.947  20.189
   98    HB3  ALA  14           HB3      ALA  14  90.280 -13.598  20.669
   99    H    ASP  15           HN       ASP  15  89.154 -13.407  17.396
  100    HA   ASP  15           HA       ASP  15  86.533 -14.697  17.944
  101    HB2  ASP  15           HB2      ASP  15  86.806 -12.703  19.464
  102    HB3  ASP  15           HB1      ASP  15  86.949 -11.696  18.024
  103    H    GLY  16           HN       GLY  16  88.773 -13.749  15.763
  104    HA2  GLY  16           HA2      GLY  16  88.640 -13.716  13.402
  105    HA3  GLY  16           HA1      GLY  16  86.886 -13.866  13.536
  106    H    THR  17           HN       THR  17  88.437 -11.419  15.406
  107    HA   THR  17           HA       THR  17  87.085  -9.347  13.767
  108    HB   THR  17           HB       THR  17  87.675  -7.884  15.711
  109    HG1  THR  17           HG1      THR  17  88.655 -10.344  16.709
  110   HG21  THR  17          HG21      THR  17  86.158  -9.084  17.337
  111   HG22  THR  17          HG22      THR  17  86.158 -10.442  16.210
  112   HG23  THR  17          HG23      THR  17  85.507  -8.878  15.712
  113    H    TRP  18           HN       TRP  18  88.242  -8.246  12.346
  114    HA   TRP  18           HA       TRP  18  91.142  -7.721  12.843
  115    HB2  TRP  18           HB2      TRP  18  91.011  -7.814  10.102
  116    HB3  TRP  18           HB1      TRP  18  91.527  -9.163  11.101
  117    HD1  TRP  18           HD1      TRP  18  88.177  -7.764   9.741
  118    HE1  TRP  18           HE1      TRP  18  86.676  -9.768   9.131
  119    HE3  TRP  18           HE3      TRP  18  91.219 -11.612  11.158
  120    HZ2  TRP  18           HZ2      TRP  18  86.755 -12.624   9.222
  121    HZ3  TRP  18           HZ3      TRP  18  90.483 -13.963  10.885
  122    HH2  TRP  18           HH2      TRP  18  88.256 -14.473   9.919
  123    H    GLU  19           HN       GLU  19  91.418  -5.565  12.930
  124    HA   GLU  19           HA       GLU  19  89.299  -3.785  12.031
  125    HB2  GLU  19           HB2      GLU  19  91.502  -2.145  12.615
  126    HB3  GLU  19           HB1      GLU  19  90.207  -2.565  13.727
  127    HG2  GLU  19           HG2      GLU  19  92.435  -3.046  14.673
  128    HG3  GLU  19           HG1      GLU  19  91.458  -4.505  14.498
  129    H    LEU  20           HN       LEU  20  89.143  -2.794  10.105
  130    HA   LEU  20           HA       LEU  20  91.222  -3.329   8.100
  131    HB2  LEU  20           HB2      LEU  20  88.413  -2.870   8.045
  132    HB3  LEU  20           HB1      LEU  20  89.119  -1.497   7.208
  133    HG   LEU  20           HG       LEU  20  88.672  -3.207   5.577
  134   HD11  LEU  20          HD11      LEU  20  90.666  -3.145   4.477
  135   HD12  LEU  20          HD12      LEU  20  91.608  -3.657   5.873
  136   HD13  LEU  20          HD13      LEU  20  91.057  -1.986   5.745
  137   HD21  LEU  20          HD21      LEU  20  90.492  -5.177   6.952
  138   HD22  LEU  20          HD22      LEU  20  89.216  -5.475   5.779
  139   HD23  LEU  20          HD23      LEU  20  88.801  -5.067   7.440
  140    H    SER  21           HN       SER  21  92.716  -1.827   7.441
  141    HA   SER  21           HA       SER  21  92.993   0.579   9.064
  142    HB2  SER  21           HB2      SER  21  94.834  -0.970   7.944
  143    HB3  SER  21           HB1      SER  21  94.611   0.131   6.587
  144    HG   SER  21           HG       SER  21  94.940   1.851   8.145
  145    H    VAL  22           HN       VAL  22  92.798   2.708   8.376
  146    HA   VAL  22           HA       VAL  22  91.735   3.167   5.640
  147    HB   VAL  22           HB       VAL  22  90.363   3.920   8.219
  148   HG11  VAL  22          HG11      VAL  22  90.417   6.006   7.004
  149   HG12  VAL  22          HG12      VAL  22  88.832   5.292   6.721
  150   HG13  VAL  22          HG13      VAL  22  90.079   5.188   5.475
  151   HG21  VAL  22          HG21      VAL  22  88.429   2.963   7.038
  152   HG22  VAL  22          HG22      VAL  22  89.763   1.805   7.069
  153   HG23  VAL  22          HG23      VAL  22  89.423   2.726   5.597
  154    H    HIS  23           HN       HIS  23  93.322   4.377   4.838
  155    HA   HIS  23           HA       HIS  23  94.731   6.402   6.426
  156    HB2  HIS  23           HB2      HIS  23  94.797   5.393   3.593
  157    HB3  HIS  23           HB1      HIS  23  95.600   6.917   3.979
  158    HD1  HIS  23           HD1      HIS  23  95.442   3.694   6.018
  159    HD2  HIS  23           HD2      HIS  23  98.263   6.176   4.212
  160    HE1  HIS  23           HE1      HIS  23  97.716   2.783   6.663
  161    H    VAL  24           HN       VAL  24  93.416   8.112   6.969
  162    HA   VAL  24           HA       VAL  24  91.286   9.017   5.256
  163    HB   VAL  24           HB       VAL  24  92.504  10.747   7.398
  164   HG11  VAL  24          HG11      VAL  24  90.389  11.268   5.947
  165   HG12  VAL  24          HG12      VAL  24  90.308  11.515   7.690
  166   HG13  VAL  24          HG13      VAL  24  89.596  10.075   6.976
  167   HG21  VAL  24          HG21      VAL  24  91.000   8.144   7.764
  168   HG22  VAL  24          HG22      VAL  24  91.061   9.386   9.017
  169   HG23  VAL  24          HG23      VAL  24  92.547   8.609   8.475
  170    H    THR  25           HN       THR  25  92.014   9.661   3.250
  171    HA   THR  25           HA       THR  25  94.350  11.303   2.846
  172    HB   THR  25           HB       THR  25  93.858  11.130   0.583
  173    HG1  THR  25           HG1      THR  25  91.952  12.416   0.824
  174   HG21  THR  25          HG21      THR  25  93.596   8.843   1.768
  175   HG22  THR  25          HG22      THR  25  92.985   8.982   0.119
  176   HG23  THR  25          HG23      THR  25  91.868   9.051   1.482
  177    H    ASP  26           HN       ASP  26  94.156  13.570   1.912
  178    HA   ASP  26           HA       ASP  26  93.338  15.770   2.030
  179    HB2  ASP  26           HB2      ASP  26  91.067  14.435   1.531
  180    HB3  ASP  26           HB1      ASP  26  90.711  14.866   3.203
  181    H    LEU  27           HN       LEU  27  92.432  13.607   4.692
  182    HA   LEU  27           HA       LEU  27  92.968  15.737   6.675
  183    HB2  LEU  27           HB2      LEU  27  91.493  13.183   6.611
  184    HB3  LEU  27           HB1      LEU  27  92.386  13.420   8.102
  185    HG   LEU  27           HG       LEU  27  90.480  15.472   6.917
  186   HD11  LEU  27          HD11      LEU  27  88.964  14.732   8.792
  187   HD12  LEU  27          HD12      LEU  27  90.048  13.367   9.050
  188   HD13  LEU  27          HD13      LEU  27  89.182  13.531   7.521
  189   HD21  LEU  27          HD21      LEU  27  90.588  16.120   9.509
  190   HD22  LEU  27          HD22      LEU  27  91.807  16.703   8.386
  191   HD23  LEU  27          HD23      LEU  27  92.154  15.315   9.413
  192    H    ASN  28           HN       ASN  28  94.233  12.778   5.338
  193    HA   ASN  28           HA       ASN  28  96.395  11.900   5.389
  194    HB2  ASN  28           HB2      ASN  28  97.012  14.409   5.575
  195    HB3  ASN  28           HB1      ASN  28  97.271  14.080   7.281
  196   HD21  ASN  28          HD21      ASN  28  98.015  11.209   6.358
  197   HD22  ASN  28          HD22      ASN  28  99.638  11.361   5.897
  198    H    ARG  29           HN       ARG  29  94.257  11.584   7.664
  199    HA   ARG  29           HA       ARG  29  96.064  10.731   9.842
  200    HB2  ARG  29           HB2      ARG  29  93.050  10.634   9.661
  201    HB3  ARG  29           HB1      ARG  29  94.016  10.294  11.096
  202    HG2  ARG  29           HG2      ARG  29  94.840  12.563  11.163
  203    HG3  ARG  29           HG1      ARG  29  94.075  12.932   9.624
  204    HD2  ARG  29           HD2      ARG  29  92.534  13.804  11.166
  205    HD3  ARG  29           HD1      ARG  29  91.869  12.205  10.830
  206    HE   ARG  29           HE       ARG  29  92.324  11.627  13.066
  207   HH11  ARG  29          HH11      ARG  29  93.208  11.993  15.114
  208   HH12  ARG  29          HH12      ARG  29  94.314  13.306  15.342
  209   HH21  ARG  29          HH21      ARG  29  94.178  14.344  12.037
  210   HH22  ARG  29          HH22      ARG  29  94.864  14.637  13.601
  211    H    ASP  30           HN       ASP  30  95.106   8.589  10.837
  212    HA   ASP  30           HA       ASP  30  94.525   6.585   8.730
  213    HB2  ASP  30           HB2      ASP  30  96.871   6.524  10.640
  214    HB3  ASP  30           HB1      ASP  30  96.205   5.052   9.929
  215    H    VAL  31           HN       VAL  31  92.745   5.611   9.403
  216    HA   VAL  31           HA       VAL  31  92.336   5.221  12.356
  217    HB   VAL  31           HB       VAL  31  90.188   5.551  10.251
  218   HG11  VAL  31          HG11      VAL  31  88.834   6.026  12.336
  219   HG12  VAL  31          HG12      VAL  31  90.230   5.519  13.283
  220   HG13  VAL  31          HG13      VAL  31  89.426   4.369  12.214
  221   HG21  VAL  31          HG21      VAL  31  89.941   7.853  11.104
  222   HG22  VAL  31          HG22      VAL  31  91.568   7.621  10.467
  223   HG23  VAL  31          HG23      VAL  31  91.292   7.603  12.209
  224    H    THR  32           HN       THR  32  91.142   3.337  12.943
  225    HA   THR  32           HA       THR  32  91.085   1.157  10.903
  226    HB   THR  32           HB       THR  32  91.754   0.021  13.462
  227    HG1  THR  32           HG1      THR  32  92.969   2.439  12.891
  228   HG21  THR  32          HG21      THR  32  93.582  -0.935  12.332
  229   HG22  THR  32          HG22      THR  32  93.752   0.445  11.246
  230   HG23  THR  32          HG23      THR  32  92.410  -0.681  11.040
  231    H    LEU  33           HN       LEU  33  89.233  -0.052  11.016
  232    HA   LEU  33           HA       LEU  33  87.319   0.535  13.249
  233    HB2  LEU  33           HB2      LEU  33  87.029   0.064  10.302
  234    HB3  LEU  33           HB1      LEU  33  85.707  -0.409  11.348
  235    HG   LEU  33           HG       LEU  33  85.551   1.932  10.377
  236   HD11  LEU  33          HD11      LEU  33  84.519   1.049  12.641
  237   HD12  LEU  33          HD12      LEU  33  84.463   2.763  12.251
  238   HD13  LEU  33          HD13      LEU  33  85.677   2.160  13.376
  239   HD21  LEU  33          HD21      LEU  33  86.985   3.644  11.141
  240   HD22  LEU  33          HD22      LEU  33  88.075   2.308  10.773
  241   HD23  LEU  33          HD23      LEU  33  87.627   2.654  12.440
  242    H    ARG  34           HN       ARG  34  87.374  -1.149  14.639
  243    HA   ARG  34           HA       ARG  34  88.228  -3.790  14.040
  244    HB2  ARG  34           HB2      ARG  34  88.039  -2.803  16.356
  245    HB3  ARG  34           HB1      ARG  34  86.291  -2.969  16.215
  246    HG2  ARG  34           HG2      ARG  34  87.113  -4.920  17.381
  247    HG3  ARG  34           HG1      ARG  34  86.618  -5.418  15.765
  248    HD2  ARG  34           HD2      ARG  34  88.779  -5.808  15.067
  249    HD3  ARG  34           HD1      ARG  34  89.479  -4.604  16.149
  250    HE   ARG  34           HE       ARG  34  88.337  -6.796  17.645
  251   HH11  ARG  34          HH11      ARG  34  89.780  -8.249  18.598
  252   HH12  ARG  34          HH12      ARG  34  91.428  -8.289  18.063
  253   HH21  ARG  34          HH21      ARG  34  91.003  -5.785  15.702
  254   HH22  ARG  34          HH22      ARG  34  92.119  -6.895  16.426
  255    H    VAL  35           HN       VAL  35  87.222  -4.767  12.354
  256    HA   VAL  35           HA       VAL  35  84.250  -5.125  12.524
  257    HB   VAL  35           HB       VAL  35  84.286  -5.147  10.027
  258   HG11  VAL  35          HG11      VAL  35  83.529  -3.132  11.054
  259   HG12  VAL  35          HG12      VAL  35  84.699  -2.623   9.836
  260   HG13  VAL  35          HG13      VAL  35  85.166  -2.682  11.538
  261   HG21  VAL  35          HG21      VAL  35  86.614  -5.659   9.621
  262   HG22  VAL  35          HG22      VAL  35  87.130  -4.210  10.479
  263   HG23  VAL  35          HG23      VAL  35  86.279  -4.067   8.943
  264    H    THR  36           HN       THR  36  83.885  -6.857  10.526
  265    HA   THR  36           HA       THR  36  85.791  -9.107  10.898
  266    HB   THR  36           HB       THR  36  83.757 -10.620  11.119
  267    HG1  THR  36           HG1      THR  36  82.497  -8.427  10.652
  268   HG21  THR  36          HG21      THR  36  85.079 -10.305  13.053
  269   HG22  THR  36          HG22      THR  36  83.423  -9.993  13.570
  270   HG23  THR  36          HG23      THR  36  84.519  -8.648  13.262
  271    H    GLY  37           HN       GLY  37  85.178 -10.846   9.205
  272    HA2  GLY  37           HA2      GLY  37  84.870  -9.479   6.666
  273    HA3  GLY  37           HA1      GLY  37  85.120 -11.207   6.866
  274    H    GLU  38           HN       GLU  38  82.601  -9.084   8.160
  275    HA   GLU  38           HA       GLU  38  80.582 -10.371   6.423
  276    HB2  GLU  38           HB2      GLU  38  79.123 -10.758   8.461
  277    HB3  GLU  38           HB1      GLU  38  80.510 -11.837   8.317
  278    HG2  GLU  38           HG2      GLU  38  81.723 -10.711   9.989
  279    HG3  GLU  38           HG1      GLU  38  80.704  -9.274   9.891
  280    H    VAL  39           HN       VAL  39  81.913  -7.621   7.631
  281    HA   VAL  39           HA       VAL  39  79.383  -6.195   8.125
  282    HB   VAL  39           HB       VAL  39  80.688  -4.356   8.784
  283   HG11  VAL  39          HG11      VAL  39  82.483  -6.663   9.482
  284   HG12  VAL  39          HG12      VAL  39  80.857  -6.523  10.145
  285   HG13  VAL  39          HG13      VAL  39  82.050  -5.272  10.476
  286   HG21  VAL  39          HG21      VAL  39  83.140  -4.197   8.323
  287   HG22  VAL  39          HG22      VAL  39  82.181  -4.142   6.857
  288   HG23  VAL  39          HG23      VAL  39  83.012  -5.634   7.313
  289    H    HIS  40           HN       HIS  40  78.398  -4.855   6.652
  290    HA   HIS  40           HA       HIS  40  79.240  -5.093   3.867
  291    HB2  HIS  40           HB2      HIS  40  77.174  -3.083   4.720
  292    HB3  HIS  40           HB1      HIS  40  77.187  -4.158   3.320
  293    HD1  HIS  40           HD1      HIS  40  75.305  -3.763   6.210
  294    HD2  HIS  40           HD2      HIS  40  77.238  -7.078   4.582
  295    HE1  HIS  40           HE1      HIS  40  74.195  -5.804   7.215
  296    H    ILE  41           HN       ILE  41  80.089  -3.398   2.560
  297    HA   ILE  41           HA       ILE  41  82.037  -1.711   3.601
  298    HB   ILE  41           HB       ILE  41  80.230  -1.202   1.222
  299   HG12  ILE  41          HG12      ILE  41  83.081  -2.219   1.283
  300   HG13  ILE  41          HG11      ILE  41  81.679  -3.290   1.270
  301   HG21  ILE  41          HG21      ILE  41  82.248   0.221   0.499
  302   HG22  ILE  41          HG22      ILE  41  82.735   0.184   2.192
  303   HG23  ILE  41          HG23      ILE  41  81.193   0.906   1.731
  304   HD11  ILE  41          HD11      ILE  41  81.909  -1.099  -0.784
  305   HD12  ILE  41          HD12      ILE  41  81.012  -2.614  -0.868
  306   HD13  ILE  41          HD13      ILE  41  82.771  -2.622  -1.012
  307    H    GLY  42           HN       GLY  42  78.770  -0.650   2.686
  308    HA2  GLY  42           HA2      GLY  42  78.920   1.935   3.764
  309    HA3  GLY  42           HA1      GLY  42  77.425   1.041   3.573
  310    H    GLY  43           HN       GLY  43  78.843  -1.091   5.295
  311    HA2  GLY  43           HA2      GLY  43  77.661  -0.281   7.811
  312    HA3  GLY  43           HA1      GLY  43  78.683  -1.701   7.554
  313    H    VAL  44           HN       VAL  44  80.800  -0.081   6.339
  314    HA   VAL  44           HA       VAL  44  82.168   0.752   8.809
  315    HB   VAL  44           HB       VAL  44  82.969   0.364   5.915
  316   HG11  VAL  44          HG11      VAL  44  85.315   0.995   6.722
  317   HG12  VAL  44          HG12      VAL  44  84.537   1.727   8.124
  318   HG13  VAL  44          HG13      VAL  44  84.197   2.342   6.506
  319   HG21  VAL  44          HG21      VAL  44  82.819  -1.537   7.598
  320   HG22  VAL  44          HG22      VAL  44  84.149  -0.767   8.463
  321   HG23  VAL  44          HG23      VAL  44  84.387  -1.344   6.814
  322    H    MET  45           HN       MET  45  80.952   2.209   5.788
  323    HA   MET  45           HA       MET  45  81.920   4.823   5.977
  324    HB2  MET  45           HB2      MET  45  79.211   3.752   5.180
  325    HB3  MET  45           HB1      MET  45  79.528   5.479   5.126
  326    HG2  MET  45           HG2      MET  45  81.635   4.766   3.716
  327    HG3  MET  45           HG1      MET  45  80.724   3.291   3.439
  328    HE1  MET  45           HE1      MET  45  78.392   3.220   1.914
  329    HE2  MET  45           HE2      MET  45  77.388   4.666   1.867
  330    HE3  MET  45           HE3      MET  45  77.843   3.981   3.413
  331    H    LEU  46           HN       LEU  46  79.322   3.289   7.805
  332    HA   LEU  46           HA       LEU  46  78.604   5.747   9.191
  333    HB2  LEU  46           HB2      LEU  46  77.354   3.318   8.730
  334    HB3  LEU  46           HB1      LEU  46  77.752   3.194  10.441
  335    HG   LEU  46           HG       LEU  46  76.310   5.560   9.188
  336   HD11  LEU  46          HD11      LEU  46  75.108   3.197   9.343
  337   HD12  LEU  46          HD12      LEU  46  74.268   4.682   9.803
  338   HD13  LEU  46          HD13      LEU  46  74.955   3.636  11.046
  339   HD21  LEU  46          HD21      LEU  46  77.173   4.837  11.987
  340   HD22  LEU  46          HD22      LEU  46  75.752   5.850  11.744
  341   HD23  LEU  46          HD23      LEU  46  77.320   6.375  11.136
  342    H    LYS  47           HN       LYS  47  80.116   2.692  10.372
  343    HA   LYS  47           HA       LYS  47  80.689   3.584  12.974
  344    HB2  LYS  47           HB2      LYS  47  82.528   1.834  11.320
  345    HB3  LYS  47           HB1      LYS  47  82.409   1.890  13.078
  346    HG2  LYS  47           HG2      LYS  47  80.244   0.906  13.071
  347    HG3  LYS  47           HG1      LYS  47  80.054   1.170  11.341
  348    HD2  LYS  47           HD2      LYS  47  81.766  -0.459  10.828
  349    HD3  LYS  47           HD1      LYS  47  82.182  -0.623  12.534
  350    HE2  LYS  47           HE2      LYS  47  79.436  -1.264  11.432
  351    HE3  LYS  47           HE1      LYS  47  80.710  -2.471  11.616
  352    HZ1  LYS  47           HZ1      LYS  47  79.718  -2.677  13.627
  353    HZ2  LYS  47           HZ2      LYS  47  79.157  -1.074  13.657
  354    HZ3  LYS  47           HZ3      LYS  47  80.781  -1.415  14.019
  355    H    LEU  48           HN       LEU  48  83.047   3.630  10.258
  356    HA   LEU  48           HA       LEU  48  85.102   5.008  11.494
  357    HB2  LEU  48           HB2      LEU  48  85.351   4.213   9.221
  358    HB3  LEU  48           HB1      LEU  48  84.072   5.276   8.653
  359    HG   LEU  48           HG       LEU  48  85.555   7.247   9.322
  360   HD11  LEU  48          HD11      LEU  48  87.041   5.977  10.865
  361   HD12  LEU  48          HD12      LEU  48  87.937   6.808   9.598
  362   HD13  LEU  48          HD13      LEU  48  87.653   5.075   9.482
  363   HD21  LEU  48          HD21      LEU  48  86.535   5.260   7.269
  364   HD22  LEU  48          HD22      LEU  48  87.064   6.940   7.360
  365   HD23  LEU  48          HD23      LEU  48  85.375   6.563   7.011
  366    H    VAL  49           HN       VAL  49  82.217   6.461   9.992
  367    HA   VAL  49           HA       VAL  49  82.971   9.176  10.595
  368    HB   VAL  49           HB       VAL  49  80.340   7.845   9.959
  369   HG11  VAL  49          HG11      VAL  49  79.704   9.727  11.293
  370   HG12  VAL  49          HG12      VAL  49  79.507  10.208   9.612
  371   HG13  VAL  49          HG13      VAL  49  80.915  10.753  10.522
  372   HG21  VAL  49          HG21      VAL  49  81.915   9.880   8.379
  373   HG22  VAL  49          HG22      VAL  49  80.626   8.823   7.802
  374   HG23  VAL  49          HG23      VAL  49  82.198   8.145   8.226
  375    H    GLU  50           HN       GLU  50  80.776   6.869  12.231
  376    HA   GLU  50           HA       GLU  50  79.823   8.417  14.320
  377    HB2  GLU  50           HB2      GLU  50  80.770   5.548  14.312
  378    HB3  GLU  50           HB1      GLU  50  80.028   6.278  15.734
  379    HG2  GLU  50           HG2      GLU  50  78.726   6.283  13.002
  380    HG3  GLU  50           HG1      GLU  50  78.423   5.040  14.214
  381    H    LYS  51           HN       LYS  51  83.044   6.967  14.063
  382    HA   LYS  51           HA       LYS  51  83.862   7.849  16.695
  383    HB2  LYS  51           HB2      LYS  51  85.542   6.983  14.341
  384    HB3  LYS  51           HB1      LYS  51  86.065   7.082  16.024
  385    HG2  LYS  51           HG2      LYS  51  84.124   5.503  16.568
  386    HG3  LYS  51           HG1      LYS  51  84.005   5.231  14.833
  387    HD2  LYS  51           HD2      LYS  51  86.361   4.644  16.631
  388    HD3  LYS  51           HD1      LYS  51  85.379   3.500  15.732
  389    HE2  LYS  51           HE2      LYS  51  87.358   3.740  14.453
  390    HE3  LYS  51           HE1      LYS  51  86.158   4.725  13.617
  391    HZ1  LYS  51           HZ1      LYS  51  87.565   6.141  15.680
  392    HZ2  LYS  51           HZ2      LYS  51  87.286   6.578  14.062
  393    HZ3  LYS  51           HZ3      LYS  51  88.594   5.569  14.460
  394    H    LEU  52           HN       LEU  52  83.956   9.243  13.466
  395    HA   LEU  52           HA       LEU  52  85.940  11.216  13.907
  396    HB2  LEU  52           HB2      LEU  52  84.642  10.493  11.730
  397    HB3  LEU  52           HB1      LEU  52  83.499  11.738  12.220
  398    HG   LEU  52           HG       LEU  52  85.471  13.316  12.406
  399   HD11  LEU  52          HD11      LEU  52  86.852  10.894  11.308
  400   HD12  LEU  52          HD12      LEU  52  87.445  12.114  12.430
  401   HD13  LEU  52          HD13      LEU  52  87.361  12.473  10.712
  402   HD21  LEU  52          HD21      LEU  52  84.935  12.157   9.655
  403   HD22  LEU  52          HD22      LEU  52  85.467  13.800  10.012
  404   HD23  LEU  52          HD23      LEU  52  83.857  13.271  10.495
  405    H    ASP  53           HN       ASP  53  82.440  11.729  13.871
  406    HA   ASP  53           HA       ASP  53  81.043  12.956  15.260
  407    HB2  ASP  53           HB2      ASP  53  82.758  12.030  16.984
  408    HB3  ASP  53           HB1      ASP  53  83.359  13.676  17.017
  409    H    VAL  54           HN       VAL  54  81.064  14.327  13.402
  410    HA   VAL  54           HA       VAL  54  81.488  17.065  14.044
  411    HB   VAL  54           HB       VAL  54  83.827  16.606  13.712
  412   HG11  VAL  54          HG11      VAL  54  83.464  14.491  12.455
  413   HG12  VAL  54          HG12      VAL  54  84.687  15.531  11.722
  414   HG13  VAL  54          HG13      VAL  54  83.072  15.448  11.026
  415   HG21  VAL  54          HG21      VAL  54  84.342  18.087  11.827
  416   HG22  VAL  54          HG22      VAL  54  82.962  18.716  12.725
  417   HG23  VAL  54          HG23      VAL  54  82.711  17.884  11.195
  418    H    LYS  55           HN       LYS  55  79.960  18.118  12.902
  419    HA   LYS  55           HA       LYS  55  78.386  16.783  10.923
  420    HB2  LYS  55           HB2      LYS  55  77.944  18.918  12.492
  421    HB3  LYS  55           HB1      LYS  55  78.403  19.764  11.023
  422    HG2  LYS  55           HG2      LYS  55  76.075  19.538  10.842
  423    HG3  LYS  55           HG1      LYS  55  76.711  18.279   9.822
  424    HD2  LYS  55           HD2      LYS  55  76.144  16.568  11.345
  425    HD3  LYS  55           HD1      LYS  55  75.995  17.699  12.681
  426    HE2  LYS  55           HE2      LYS  55  73.944  18.571  11.864
  427    HE3  LYS  55           HE1      LYS  55  74.175  17.828  10.281
  428    HZ1  LYS  55           HZ1      LYS  55  72.959  16.741  12.583
  429    HZ2  LYS  55           HZ2      LYS  55  74.299  15.788  12.155
  430    HZ3  LYS  55           HZ3      LYS  55  73.065  16.080  11.025
  431    H    LYS  56           HN       LYS  56  81.167  16.716  10.142
  432    HA   LYS  56           HA       LYS  56  81.568  18.674   8.016
  433    HB2  LYS  56           HB2      LYS  56  83.545  17.772   9.057
  434    HB3  LYS  56           HB1      LYS  56  83.007  16.114   8.785
  435    HG2  LYS  56           HG2      LYS  56  83.475  16.203   6.486
  436    HG3  LYS  56           HG1      LYS  56  83.404  17.964   6.438
  437    HD2  LYS  56           HD2      LYS  56  85.735  17.157   6.255
  438    HD3  LYS  56           HD1      LYS  56  85.498  18.100   7.725
  439    HE2  LYS  56           HE2      LYS  56  85.229  15.091   7.714
  440    HE3  LYS  56           HE1      LYS  56  86.788  15.883   7.961
  441    HZ1  LYS  56           HZ1      LYS  56  86.170  15.948  10.090
  442    HZ2  LYS  56           HZ2      LYS  56  84.532  15.665   9.739
  443    HZ3  LYS  56           HZ3      LYS  56  85.168  17.237   9.634
  444    H    ASP  57           HN       ASP  57  81.756  17.980   5.717
  445    HA   ASP  57           HA       ASP  57  79.422  16.546   4.876
  446    HB2  ASP  57           HB2      ASP  57  80.757  16.638   2.589
  447    HB3  ASP  57           HB1      ASP  57  80.103  18.109   3.301
  448    H    TRP  58           HN       TRP  58  79.474  14.484   5.722
  449    HA   TRP  58           HA       TRP  58  81.767  12.708   5.273
  450    HB2  TRP  58           HB2      TRP  58  78.981  12.110   6.232
  451    HB3  TRP  58           HB1      TRP  58  80.329  11.007   6.306
  452    HD1  TRP  58           HD1      TRP  58  82.471  13.119   7.524
  453    HE1  TRP  58           HE1      TRP  58  82.203  13.758  10.022
  454    HE3  TRP  58           HE3      TRP  58  77.573  11.962   8.223
  455    HZ2  TRP  58           HZ2      TRP  58  80.158  13.734  12.046
  456    HZ3  TRP  58           HZ3      TRP  58  76.477  12.274  10.419
  457    HH2  TRP  58           HH2      TRP  58  77.768  13.173  12.332
  458    H    SER  59           HN       SER  59  78.390  12.969   4.168
  459    HA   SER  59           HA       SER  59  78.073  10.776   2.546
  460    HB2  SER  59           HB2      SER  59  77.233  13.640   2.138
  461    HB3  SER  59           HB1      SER  59  76.769  12.380   1.001
  462    HG   SER  59           HG       SER  59  76.218  11.299   3.219
  463    H    ASP  60           HN       ASP  60  79.503  13.847   1.402
  464    HA   ASP  60           HA       ASP  60  80.208  13.056  -1.181
  465    HB2  ASP  60           HB2      ASP  60  80.501  15.342  -0.478
  466    HB3  ASP  60           HB1      ASP  60  81.659  14.865   0.764
  467    H    HIS  61           HN       HIS  61  81.633  12.022   1.837
  468    HA   HIS  61           HA       HIS  61  84.031  10.956   0.505
  469    HB2  HIS  61           HB2      HIS  61  83.106  10.988   3.375
  470    HB3  HIS  61           HB1      HIS  61  84.550  10.152   2.846
  471    HD1  HIS  61           HD1      HIS  61  86.597  11.532   3.101
  472    HD2  HIS  61           HD2      HIS  61  83.258  13.888   2.289
  473    HE1  HIS  61           HE1      HIS  61  87.406  13.931   3.070
  474    H    ALA  62           HN       ALA  62  84.681   8.769   0.757
  475    HA   ALA  62           HA       ALA  62  82.825   6.668   1.502
  476    HB1  ALA  62           HB1      ALA  62  82.005   7.491  -0.803
  477    HB2  ALA  62           HB2      ALA  62  82.333   5.765  -0.651
  478    HB3  ALA  62           HB3      ALA  62  83.503   6.818  -1.446
  479    H    LEU  63           HN       LEU  63  83.930   4.449   0.846
  480    HA   LEU  63           HA       LEU  63  86.851   4.822   1.287
  481    HB2  LEU  63           HB2      LEU  63  85.187   2.287   1.346
  482    HB3  LEU  63           HB1      LEU  63  86.882   2.417   1.791
  483    HG   LEU  63           HG       LEU  63  85.510   2.408   3.784
  484   HD11  LEU  63          HD11      LEU  63  86.362   5.279   3.498
  485   HD12  LEU  63          HD12      LEU  63  87.558   3.981   3.502
  486   HD13  LEU  63          HD13      LEU  63  86.502   4.212   4.893
  487   HD21  LEU  63          HD21      LEU  63  83.658   3.723   4.163
  488   HD22  LEU  63          HD22      LEU  63  83.535   3.569   2.412
  489   HD23  LEU  63          HD23      LEU  63  84.220   5.031   3.124
  490    H    TRP  64           HN       TRP  64  88.417   3.980  -0.061
  491    HA   TRP  64           HA       TRP  64  87.526   2.874  -2.710
  492    HB2  TRP  64           HB2      TRP  64  88.324   4.742  -3.748
  493    HB3  TRP  64           HB1      TRP  64  88.634   5.450  -2.188
  494    HD1  TRP  64           HD1      TRP  64  91.177   4.119  -1.167
  495    HE1  TRP  64           HE1      TRP  64  93.411   4.263  -2.434
  496    HE3  TRP  64           HE3      TRP  64  89.467   5.278  -5.838
  497    HZ2  TRP  64           HZ2      TRP  64  94.357   4.843  -5.067
  498    HZ3  TRP  64           HZ3      TRP  64  91.060   5.643  -7.701
  499    HH2  TRP  64           HH2      TRP  64  93.501   5.429  -7.322
  500    H    TRP  65           HN       TRP  65  89.069   1.399  -3.655
  501    HA   TRP  65           HA       TRP  65  91.014   0.290  -1.665
  502    HB2  TRP  65           HB2      TRP  65  89.045  -1.126  -2.531
  503    HB3  TRP  65           HB1      TRP  65  89.903  -1.168  -4.066
  504    HD1  TRP  65           HD1      TRP  65  92.693  -1.135  -1.895
  505    HE1  TRP  65           HE1      TRP  65  93.484  -3.485  -1.227
  506    HE3  TRP  65           HE3      TRP  65  88.566  -3.853  -3.188
  507    HZ2  TRP  65           HZ2      TRP  65  92.505  -6.175  -1.246
  508    HZ3  TRP  65           HZ3      TRP  65  88.528  -6.304  -2.853
  509    HH2  TRP  65           HH2      TRP  65  90.489  -7.471  -1.886
  510    H    GLU  66           HN       GLU  66  92.835   1.563  -2.291
  511    HA   GLU  66           HA       GLU  66  93.599   2.186  -4.930
  512    HB2  GLU  66           HB2      GLU  66  95.939   2.320  -3.997
  513    HB3  GLU  66           HB1      GLU  66  94.726   3.247  -3.124
  514    HG2  GLU  66           HG2      GLU  66  94.484   1.386  -1.506
  515    HG3  GLU  66           HG1      GLU  66  95.735   0.502  -2.372
  516    H    LYS  67           HN       LYS  67  93.845  -0.893  -3.271
  517    HA   LYS  67           HA       LYS  67  95.892  -1.980  -5.009
  518    HB2  LYS  67           HB2      LYS  67  93.633  -3.536  -3.719
  519    HB3  LYS  67           HB1      LYS  67  95.192  -4.165  -4.236
  520    HG2  LYS  67           HG2      LYS  67  94.747  -2.168  -2.000
  521    HG3  LYS  67           HG1      LYS  67  95.125  -3.876  -1.795
  522    HD2  LYS  67           HD2      LYS  67  97.219  -3.384  -3.227
  523    HD3  LYS  67           HD1      LYS  67  96.876  -1.686  -2.895
  524    HE2  LYS  67           HE2      LYS  67  98.257  -2.159  -1.087
  525    HE3  LYS  67           HE1      LYS  67  96.696  -2.586  -0.378
  526    HZ1  LYS  67           HZ1      LYS  67  97.365  -4.672  -0.179
  527    HZ2  LYS  67           HZ2      LYS  67  98.903  -4.229  -0.749
  528    HZ3  LYS  67           HZ3      LYS  67  97.716  -4.776  -1.835
  529    H    LYS  68           HN       LYS  68  92.777  -0.913  -5.410
  530    HA   LYS  68           HA       LYS  68  92.459  -2.284  -8.038
  531    HB2  LYS  68           HB2      LYS  68  90.056  -1.557  -6.372
  532    HB3  LYS  68           HB1      LYS  68  90.215  -2.798  -7.611
  533    HG2  LYS  68           HG2      LYS  68  91.671  -2.998  -4.953
  534    HG3  LYS  68           HG1      LYS  68  90.044  -3.602  -5.183
  535    HD2  LYS  68           HD2      LYS  68  90.718  -5.181  -6.811
  536    HD3  LYS  68           HD1      LYS  68  92.275  -4.390  -7.047
  537    HE2  LYS  68           HE2      LYS  68  93.183  -5.301  -5.121
  538    HE3  LYS  68           HE1      LYS  68  91.628  -5.422  -4.301
  539    HZ1  LYS  68           HZ1      LYS  68  92.953  -7.309  -6.021
  540    HZ2  LYS  68           HZ2      LYS  68  91.323  -7.057  -6.430
  541    HZ3  LYS  68           HZ3      LYS  68  91.742  -7.562  -4.862
  542    H    ARG  69           HN       ARG  69  92.557   0.598  -6.215
  543    HA   ARG  69           HA       ARG  69  92.041   2.823  -6.742
  544    HB2  ARG  69           HB2      ARG  69  92.530   1.647  -9.499
  545    HB3  ARG  69           HB1      ARG  69  92.184   3.352  -9.250
  546    HG2  ARG  69           HG2      ARG  69  94.514   3.383  -9.210
  547    HG3  ARG  69           HG1      ARG  69  94.172   3.196  -7.494
  548    HD2  ARG  69           HD2      ARG  69  95.815   1.553  -7.967
  549    HD3  ARG  69           HD1      ARG  69  94.293   0.670  -7.919
  550    HE   ARG  69           HE       ARG  69  94.806   1.523 -10.604
  551   HH11  ARG  69          HH11      ARG  69  95.547  -0.020 -12.078
  552   HH12  ARG  69          HH12      ARG  69  96.255  -1.488 -11.493
  553   HH21  ARG  69          HH21      ARG  69  95.860  -0.656  -8.148
  554   HH22  ARG  69          HH22      ARG  69  96.432  -1.849  -9.266
  555    H    THR  70           HN       THR  70  89.893   1.260  -6.119
  556    HA   THR  70           HA       THR  70  87.792   1.980  -8.145
  557    HB   THR  70           HB       THR  70  88.242  -0.462  -7.454
  558    HG1  THR  70           HG1      THR  70  86.110   0.808  -8.118
  559   HG21  THR  70          HG21      THR  70  88.311   0.290  -4.953
  560   HG22  THR  70          HG22      THR  70  87.560  -1.250  -5.370
  561   HG23  THR  70          HG23      THR  70  86.555   0.166  -5.060
  562    H    TRP  71           HN       TRP  71  85.589   1.847  -6.698
  563    HA   TRP  71           HA       TRP  71  85.902   3.673  -4.367
  564    HB2  TRP  71           HB2      TRP  71  83.462   4.399  -5.304
  565    HB3  TRP  71           HB1      TRP  71  84.933   5.232  -5.776
  566    HD1  TRP  71           HD1      TRP  71  82.973   2.123  -7.027
  567    HE1  TRP  71           HE1      TRP  71  83.042   2.114  -9.561
  568    HE3  TRP  71           HE3      TRP  71  85.803   6.291  -7.828
  569    HZ2  TRP  71           HZ2      TRP  71  84.144   3.667 -11.709
  570    HZ3  TRP  71           HZ3      TRP  71  86.345   7.004 -10.139
  571    HH2  TRP  71           HH2      TRP  71  85.521   5.698 -12.079
  572    H    LEU  72           HN       LEU  72  85.533   2.195  -2.804
  573    HA   LEU  72           HA       LEU  72  84.008  -0.148  -3.178
  574    HB2  LEU  72           HB2      LEU  72  84.699   1.302  -0.632
  575    HB3  LEU  72           HB1      LEU  72  84.125  -0.359  -0.718
  576    HG   LEU  72           HG       LEU  72  86.539   0.609  -2.251
  577   HD11  LEU  72          HD11      LEU  72  87.823  -0.615  -0.397
  578   HD12  LEU  72          HD12      LEU  72  86.347  -0.448   0.557
  579   HD13  LEU  72          HD13      LEU  72  87.190   0.989  -0.027
  580   HD21  LEU  72          HD21      LEU  72  86.998  -2.002  -1.882
  581   HD22  LEU  72          HD22      LEU  72  85.995  -1.420  -3.210
  582   HD23  LEU  72          HD23      LEU  72  85.241  -2.047  -1.743
  583    H    LEU  73           HN       LEU  73  82.096   0.464  -4.144
  584    HA   LEU  73           HA       LEU  73  80.013   1.538  -2.276
  585    HB2  LEU  73           HB2      LEU  73  78.767   2.307  -4.331
  586    HB3  LEU  73           HB1      LEU  73  80.262   3.182  -4.021
  587    HG   LEU  73           HG       LEU  73  81.261   1.292  -5.667
  588   HD11  LEU  73          HD11      LEU  73  79.740   0.718  -7.447
  589   HD12  LEU  73          HD12      LEU  73  78.465   1.720  -6.752
  590   HD13  LEU  73          HD13      LEU  73  78.961   0.243  -5.940
  591   HD21  LEU  73          HD21      LEU  73  79.770   3.801  -6.482
  592   HD22  LEU  73          HD22      LEU  73  80.853   2.913  -7.553
  593   HD23  LEU  73          HD23      LEU  73  81.479   3.663  -6.091
  594    H    LYS  74           HN       LYS  74  81.215  -1.175  -3.384
  595    HA   LYS  74           HA       LYS  74  78.891  -2.508  -4.510
  596    HB2  LYS  74           HB2      LYS  74  81.189  -3.990  -3.247
  597    HB3  LYS  74           HB1      LYS  74  80.233  -4.427  -4.649
  598    HG2  LYS  74           HG2      LYS  74  82.046  -2.007  -4.739
  599    HG3  LYS  74           HG1      LYS  74  82.700  -3.611  -4.970
  600    HD2  LYS  74           HD2      LYS  74  82.247  -2.990  -7.169
  601    HD3  LYS  74           HD1      LYS  74  80.784  -3.871  -6.764
  602    HE2  LYS  74           HE2      LYS  74  79.533  -1.895  -6.557
  603    HE3  LYS  74           HE1      LYS  74  80.965  -0.898  -6.352
  604    HZ1  LYS  74           HZ1      LYS  74  80.976  -0.551  -8.517
  605    HZ2  LYS  74           HZ2      LYS  74  79.621  -1.556  -8.719
  606    HZ3  LYS  74           HZ3      LYS  74  81.187  -2.211  -8.792
  607    H    THR  75           HN       THR  75  77.861  -1.414  -2.279
  608    HA   THR  75           HA       THR  75  78.113  -2.908   0.135
  609    HB   THR  75           HB       THR  75  75.677  -2.096   0.497
  610    HG1  THR  75           HG1      THR  75  76.047  -1.593  -2.105
  611   HG21  THR  75          HG21      THR  75  76.509   0.358   0.525
  612   HG22  THR  75          HG22      THR  75  78.046  -0.304  -0.028
  613   HG23  THR  75          HG23      THR  75  77.370  -0.815   1.520
  614    H    HIS  76           HN       HIS  76  77.082  -3.916  -2.869
  615    HA   HIS  76           HA       HIS  76  74.863  -5.589  -2.337
  616    HB2  HIS  76           HB2      HIS  76  77.113  -6.066  -4.307
  617    HB3  HIS  76           HB1      HIS  76  75.509  -6.797  -4.367
  618    HD1  HIS  76           HD1      HIS  76  77.292  -4.153  -5.882
  619    HD2  HIS  76           HD2      HIS  76  73.451  -4.452  -4.288
  620    HE1  HIS  76           HE1      HIS  76  75.948  -2.259  -6.892
  621    H    TRP  77           HN       TRP  77  78.352  -6.286  -2.019
  622    HA   TRP  77           HA       TRP  77  77.613  -8.820  -0.591
  623    HB2  TRP  77           HB2      TRP  77  79.956  -9.537  -1.369
  624    HB3  TRP  77           HB1      TRP  77  78.672  -9.543  -2.554
  625    HD1  TRP  77           HD1      TRP  77  81.088  -6.778  -1.282
  626    HE1  TRP  77           HE1      TRP  77  82.106  -5.621  -3.347
  627    HE3  TRP  77           HE3      TRP  77  78.847  -9.471  -4.997
  628    HZ2  TRP  77           HZ2      TRP  77  81.986  -5.812  -6.201
  629    HZ3  TRP  77           HZ3      TRP  77  79.317  -8.965  -7.377
  630    HH2  TRP  77           HH2      TRP  77  80.882  -7.140  -7.983
  631    H    THR  78           HN       THR  78  80.232  -9.370   0.456
  632    HA   THR  78           HA       THR  78  80.578  -7.025   2.302
  633    HB   THR  78           HB       THR  78  81.412  -9.613   3.420
  634    HG1  THR  78           HG1      THR  78  78.708  -9.662   3.275
  635   HG21  THR  78          HG21      THR  78  80.956  -8.023   5.055
  636   HG22  THR  78          HG22      THR  78  79.444  -8.931   5.027
  637   HG23  THR  78          HG23      THR  78  79.541  -7.382   4.209
  638    H    LEU  79           HN       LEU  79  82.755  -7.962   3.656
  639    HA   LEU  79           HA       LEU  79  84.951  -7.252   1.911
  640    HB2  LEU  79           HB2      LEU  79  84.860  -8.415   4.697
  641    HB3  LEU  79           HB1      LEU  79  86.348  -7.928   3.913
  642    HG   LEU  79           HG       LEU  79  85.600  -5.608   3.838
  643   HD11  LEU  79          HD11      LEU  79  83.242  -5.761   3.494
  644   HD12  LEU  79          HD12      LEU  79  83.430  -5.064   5.099
  645   HD13  LEU  79          HD13      LEU  79  83.035  -6.772   4.928
  646   HD21  LEU  79          HD21      LEU  79  85.315  -7.046   6.495
  647   HD22  LEU  79          HD22      LEU  79  85.243  -5.284   6.380
  648   HD23  LEU  79          HD23      LEU  79  86.702  -6.142   5.881
  649    H    ASP  80           HN       ASP  80  84.241 -10.133   3.819
  650    HA   ASP  80           HA       ASP  80  86.130 -11.932   2.876
  651    HB2  ASP  80           HB2      ASP  80  84.458 -12.382   4.637
  652    HB3  ASP  80           HB1      ASP  80  83.199 -12.479   3.402
  653    H    LYS  81           HN       LYS  81  82.892 -11.422   1.567
  654    HA   LYS  81           HA       LYS  81  82.871 -13.160  -0.558
  655    HB2  LYS  81           HB2      LYS  81  81.966 -10.320  -0.912
  656    HB3  LYS  81           HB1      LYS  81  81.223 -11.786  -1.547
  657    HG2  LYS  81           HG2      LYS  81  81.249 -10.818   1.317
  658    HG3  LYS  81           HG1      LYS  81  79.848 -11.058   0.284
  659    HD2  LYS  81           HD2      LYS  81  80.427 -13.500   0.195
  660    HD3  LYS  81           HD1      LYS  81  81.638 -13.191   1.433
  661    HE2  LYS  81           HE2      LYS  81  80.018 -12.569   3.039
  662    HE3  LYS  81           HE1      LYS  81  78.762 -12.364   1.819
  663    HZ1  LYS  81           HZ1      LYS  81  78.298 -14.408   2.791
  664    HZ2  LYS  81           HZ2      LYS  81  79.932 -14.870   2.857
  665    HZ3  LYS  81           HZ3      LYS  81  79.117 -14.830   1.367
  666    H    TYR  82           HN       TYR  82  84.058  -9.810  -0.710
  667    HA   TYR  82           HA       TYR  82  85.188 -10.178  -3.349
  668    HB2  TYR  82           HB2      TYR  82  84.518  -7.979  -1.967
  669    HB3  TYR  82           HB1      TYR  82  86.219  -8.026  -1.520
  670    HD1  TYR  82           HD1      TYR  82  84.001  -6.691  -3.853
  671    HD2  TYR  82           HD2      TYR  82  87.810  -8.667  -3.650
  672    HE1  TYR  82           HE1      TYR  82  84.616  -5.733  -6.055
  673    HE2  TYR  82           HE2      TYR  82  88.424  -7.708  -5.852
  674    HH   TYR  82           HH       TYR  82  86.100  -6.041  -7.842
  675    H    GLY  83           HN       GLY  83  86.548 -10.155  -0.058
  676    HA2  GLY  83           HA2      GLY  83  88.340 -11.923   0.308
  677    HA3  GLY  83           HA1      GLY  83  89.090 -11.325  -1.173
  678    H    ILE  84           HN       ILE  84  87.688  -8.759   0.401
  679    HA   ILE  84           HA       ILE  84  90.164  -7.484   1.011
  680    HB   ILE  84           HB       ILE  84  87.376  -6.919   2.061
  681   HG12  ILE  84          HG12      ILE  84  88.796  -5.351  -0.092
  682   HG13  ILE  84          HG11      ILE  84  87.998  -6.866  -0.518
  683   HG21  ILE  84          HG21      ILE  84  88.932  -5.799   3.491
  684   HG22  ILE  84          HG22      ILE  84  88.382  -4.583   2.342
  685   HG23  ILE  84          HG23      ILE  84  89.961  -5.341   2.133
  686   HD11  ILE  84          HD11      ILE  84  85.873  -6.060   0.125
  687   HD12  ILE  84          HD12      ILE  84  86.616  -4.687  -0.696
  688   HD13  ILE  84          HD13      ILE  84  86.563  -4.737   1.066
  689    H    GLN  85           HN       GLN  85  90.895  -6.841   3.196
  690    HA   GLN  85           HA       GLN  85  89.957  -8.183   5.557
  691    HB2  GLN  85           HB2      GLN  85  91.260  -9.959   3.999
  692    HB3  GLN  85           HB1      GLN  85  92.659  -9.237   4.782
  693    HG2  GLN  85           HG2      GLN  85  92.180 -10.916   6.321
  694    HG3  GLN  85           HG1      GLN  85  91.193  -9.617   6.987
  695   HE21  GLN  85          HE21      GLN  85  89.053  -9.631   5.142
  696   HE22  GLN  85          HE22      GLN  85  88.215 -11.092   5.285
  697    H    ALA  86           HN       ALA  86  92.403  -8.297   6.957
  698    HA   ALA  86           HA       ALA  86  92.859  -5.483   7.474
  699    HB1  ALA  86           HB1      ALA  86  93.041  -6.964   9.336
  700    HB2  ALA  86           HB2      ALA  86  94.692  -6.450   8.986
  701    HB3  ALA  86           HB3      ALA  86  94.131  -8.037   8.459
  702    H    ASP  87           HN       ASP  87  94.363  -7.901   5.489
  703    HA   ASP  87           HA       ASP  87  96.913  -6.538   5.243
  704    HB2  ASP  87           HB2      ASP  87  97.199  -8.085   3.274
  705    HB3  ASP  87           HB1      ASP  87  96.808  -8.914   4.782
  706    H    ALA  88           HN       ALA  88  93.798  -5.995   4.091
  707    HA   ALA  88           HA       ALA  88  94.706  -4.501   1.679
  708    HB1  ALA  88           HB1      ALA  88  92.184  -5.747   2.643
  709    HB2  ALA  88           HB2      ALA  88  92.826  -5.666   1.006
  710    HB3  ALA  88           HB3      ALA  88  91.993  -4.271   1.692
  711    H    LYS  89           HN       LYS  89  95.291  -2.406   2.172
  712    HA   LYS  89           HA       LYS  89  93.966  -1.046   4.461
  713    HB2  LYS  89           HB2      LYS  89  96.144   0.181   2.780
  714    HB3  LYS  89           HB1      LYS  89  95.734   0.498   4.463
  715    HG2  LYS  89           HG2      LYS  89  96.832  -2.155   3.493
  716    HG3  LYS  89           HG1      LYS  89  97.833  -0.854   4.099
  717    HD2  LYS  89           HD2      LYS  89  97.038  -1.044   6.288
  718    HD3  LYS  89           HD1      LYS  89  95.544  -1.822   5.784
  719    HE2  LYS  89           HE2      LYS  89  97.053  -3.446   6.843
  720    HE3  LYS  89           HE1      LYS  89  96.773  -3.831   5.144
  721    HZ1  LYS  89           HZ1      LYS  89  99.003  -2.067   5.593
  722    HZ2  LYS  89           HZ2      LYS  89  98.898  -3.461   4.628
  723    HZ3  LYS  89           HZ3      LYS  89  99.200  -3.598   6.294
  724    H    LEU  90           HN       LEU  90  92.246   0.098   4.102
  725    HA   LEU  90           HA       LEU  90  91.658   1.143   1.390
  726    HB2  LEU  90           HB2      LEU  90  89.838   1.358   3.778
  727    HB3  LEU  90           HB1      LEU  90  89.413   1.314   2.068
  728    HG   LEU  90           HG       LEU  90  90.542  -0.959   3.704
  729   HD11  LEU  90          HD11      LEU  90  87.875  -0.662   2.303
  730   HD12  LEU  90          HD12      LEU  90  88.122  -0.425   4.032
  731   HD13  LEU  90          HD13      LEU  90  88.384  -2.014   3.314
  732   HD21  LEU  90          HD21      LEU  90  89.998  -0.655   0.744
  733   HD22  LEU  90          HD22      LEU  90  90.041  -2.241   1.522
  734   HD23  LEU  90          HD23      LEU  90  91.475  -1.216   1.534
  735    H    GLN  91           HN       GLN  91  90.475   3.367   1.532
  736    HA   GLN  91           HA       GLN  91  91.902   5.229   3.375
  737    HB2  GLN  91           HB2      GLN  91  91.379   5.805   0.444
  738    HB3  GLN  91           HB1      GLN  91  92.335   6.767   1.565
  739    HG2  GLN  91           HG2      GLN  91  94.154   5.304   1.477
  740    HG3  GLN  91           HG1      GLN  91  93.175   3.936   1.005
  741   HE21  GLN  91          HE21      GLN  91  92.378   6.772  -0.695
  742   HE22  GLN  91          HE22      GLN  91  93.194   6.404  -2.126
  743    H    PHE  92           HN       PHE  92  90.717   7.324   3.532
  744    HA   PHE  92           HA       PHE  92  87.800   7.077   2.831
  745    HB2  PHE  92           HB2      PHE  92  88.046   6.868   5.228
  746    HB3  PHE  92           HB1      PHE  92  89.109   8.253   5.310
  747    HD1  PHE  92           HD1      PHE  92  85.640   7.122   4.788
  748    HD2  PHE  92           HD2      PHE  92  88.218  10.531   5.209
  749    HE1  PHE  92           HE1      PHE  92  83.664   8.575   5.161
  750    HE2  PHE  92           HE2      PHE  92  86.247  11.982   5.574
  751    HZ   PHE  92           HZ       PHE  92  83.969  11.005   5.554
  752    H    THR  93           HN       THR  93  88.106   8.203   0.907
  753    HA   THR  93           HA       THR  93  89.176  11.002   1.101
  754    HB   THR  93           HB       THR  93  90.382  10.337  -0.722
  755    HG1  THR  93           HG1      THR  93  88.823   9.937  -2.645
  756   HG21  THR  93          HG21      THR  93  89.947   8.212  -1.917
  757   HG22  THR  93          HG22      THR  93  88.453   8.016  -1.000
  758   HG23  THR  93          HG23      THR  93  90.009   7.981  -0.170
  759    HA   PRO  94           HA       PRO  94  85.247  12.812   0.214
  760    HB2  PRO  94           HB2      PRO  94  85.888  14.755  -1.641
  761    HB3  PRO  94           HB1      PRO  94  86.254  14.889   0.091
  762    HG2  PRO  94           HG2      PRO  94  88.040  14.060  -2.157
  763    HG3  PRO  94           HG1      PRO  94  88.385  15.118  -0.776
  764    HD2  PRO  94           HD2      PRO  94  89.206  12.539  -0.823
  765    HD3  PRO  94           HD1      PRO  94  88.711  13.331   0.688
  766    H    TYR 541           HT1      TYR 541  61.929  38.434  12.071
  767    HA   TYR 541           HA       TYR 541  59.976  37.189  13.819
  768    HB2  TYR 541           HB2      TYR 541  61.842  38.691  14.557
  769    HB3  TYR 541           HB1      TYR 541  61.099  40.002  13.640
  770    HD1  TYR 541           HD1      TYR 541  60.370  37.495  16.323
  771    HD2  TYR 541           HD2      TYR 541  59.406  41.320  14.620
  772    HE1  TYR 541           HE1      TYR 541  58.859  37.965  18.233
  773    HE2  TYR 541           HE2      TYR 541  57.896  41.790  16.530
  774    HH   TYR 541           HH       TYR 541  57.859  40.835  19.120
  775    H    HIS 542           HN       HIS 542  59.096  37.442  11.060
  776    HA   HIS 542           HA       HIS 542  57.551  39.780  10.595
  777    HB2  HIS 542           HB2      HIS 542  56.894  36.961   9.700
  778    HB3  HIS 542           HB1      HIS 542  56.406  38.464   8.927
  779    HD1  HIS 542           HD1      HIS 542  58.411  36.025   7.888
  780    HD2  HIS 542           HD2      HIS 542  59.394  39.941   8.924
  781    HE1  HIS 542           HE1      HIS 542  60.598  36.548   6.721
  782    H    GLU 543           HN       GLU 543  54.930  39.030  10.234
  783    HA   GLU 543           HA       GLU 543  53.999  38.684  13.040
  784    HB2  GLU 543           HB2      GLU 543  52.867  40.564  12.351
  785    HB3  GLU 543           HB1      GLU 543  53.106  40.187  10.652
  786    HG2  GLU 543           HG2      GLU 543  50.705  40.182  11.325
  787    HG3  GLU 543           HG1      GLU 543  51.237  38.628  10.684
  788    H    ARG 544           HN       ARG 544  53.716  37.327   9.809
  789    HA   ARG 544           HA       ARG 544  51.613  35.484  10.248
  790    HB2  ARG 544           HB2      ARG 544  54.064  34.878   8.579
  791    HB3  ARG 544           HB1      ARG 544  52.413  34.311   8.330
  792    HG2  ARG 544           HG2      ARG 544  53.317  37.194   8.119
  793    HG3  ARG 544           HG1      ARG 544  53.003  36.131   6.756
  794    HD2  ARG 544           HD2      ARG 544  50.657  35.854   8.136
  795    HD3  ARG 544           HD1      ARG 544  51.074  37.516   8.541
  796    HE   ARG 544           HE       ARG 544  49.947  36.706   6.096
  797   HH11  ARG 544          HH11      ARG 544  50.254  37.746   4.131
  798   HH12  ARG 544          HH12      ARG 544  51.577  38.848   3.941
  799   HH21  ARG 544          HH21      ARG 544  52.735  38.445   7.172
  800   HH22  ARG 544          HH22      ARG 544  52.980  39.233   5.654
  801    H    ARG 545           HN       ARG 545  51.490  33.690  11.534
  802    HA   ARG 545           HA       ARG 545  53.731  32.921  13.193
  803    HB2  ARG 545           HB2      ARG 545  51.259  31.236  12.787
  804    HB3  ARG 545           HB1      ARG 545  52.230  31.447  14.238
  805    HG2  ARG 545           HG2      ARG 545  50.467  33.552  12.975
  806    HG3  ARG 545           HG1      ARG 545  50.106  32.641  14.431
  807    HD2  ARG 545           HD2      ARG 545  52.457  33.594  15.224
  808    HD3  ARG 545           HD1      ARG 545  52.106  34.841  14.031
  809    HE   ARG 545           HE       ARG 545  50.990  34.697  16.635
  810   HH11  ARG 545          HH11      ARG 545  48.995  35.554  17.208
  811   HH12  ARG 545          HH12      ARG 545  47.871  36.007  15.970
  812   HH21  ARG 545          HH21      ARG 545  49.956  35.102  13.365
  813   HH22  ARG 545          HH22      ARG 545  48.411  35.741  13.803
  814    H    GLY 546           HN       GLY 546  53.068  30.042  13.055
  815    HA2  GLY 546           HA2      GLY 546  53.493  28.919  10.491
  816    HA3  GLY 546           HA1      GLY 546  55.083  29.201  11.202
  817    H    SER 547           HN       SER 547  55.853  27.684  12.569
  818    HA   SER 547           HA       SER 547  54.125  26.068  14.268
  819    HB2  SER 547           HB2      SER 547  55.264  24.975  11.718
  820    HB3  SER 547           HB1      SER 547  55.264  23.930  13.135
  821    HG   SER 547           HG       SER 547  53.248  24.525  11.516
  822    H    LEU 548           HN       LEU 548  55.369  26.099  16.090
  823    HA   LEU 548           HA       LEU 548  58.085  26.818  16.113
  824    HB2  LEU 548           HB2      LEU 548  56.141  25.753  18.069
  825    HB3  LEU 548           HB1      LEU 548  57.817  25.406  18.470
  826    HG   LEU 548           HG       LEU 548  58.292  27.891  18.081
  827   HD11  LEU 548          HD11      LEU 548  55.285  27.881  17.911
  828   HD12  LEU 548          HD12      LEU 548  56.447  28.625  16.820
  829   HD13  LEU 548          HD13      LEU 548  56.175  29.315  18.413
  830   HD21  LEU 548          HD21      LEU 548  57.859  26.734  20.348
  831   HD22  LEU 548          HD22      LEU 548  56.268  27.484  20.269
  832   HD23  LEU 548          HD23      LEU 548  57.720  28.489  20.273
  833    H    CYS 549           HN       CYS 549  60.000  25.712  15.899
  834    HA   CYS 549           HA       CYS 549  59.813  22.897  15.051
  835    HB2  CYS 549           HB2      CYS 549  61.470  24.005  13.815
  836    HB3  CYS 549           HB1      CYS 549  61.968  24.998  15.169
  837    H    SER 550           HN       SER 550  59.369  21.641  16.758
  838    HA   SER 550           HA       SER 550  59.900  22.059  19.442
  839    HB2  SER 550           HB2      SER 550  58.493  20.263  19.026
  840    HB3  SER 550           HB1      SER 550  59.557  19.577  17.803
  841    HG   SER 550           HG       SER 550  59.820  19.559  20.618
  842    H    GLY 551           HN       GLY 551  61.649  22.232  20.571
  843    HA2  GLY 551           HA2      GLY 551  63.856  21.342  21.299
  844    HA3  GLY 551           HA1      GLY 551  64.217  21.027  19.597
  845    H    CYS 552           HN       CYS 552  63.041  23.380  18.580
  846    HA   CYS 552           HA       CYS 552  65.069  25.423  19.372
  847    HB2  CYS 552           HB2      CYS 552  63.433  24.835  16.922
  848    HB3  CYS 552           HB1      CYS 552  64.024  26.464  17.174
  849    H    GLN 553           HN       GLN 553  61.665  24.734  18.900
  850    HA   GLN 553           HA       GLN 553  59.767  25.872  19.465
  851    HB2  GLN 553           HB2      GLN 553  61.546  26.889  21.664
  852    HB3  GLN 553           HB1      GLN 553  59.796  27.117  21.608
  853    HG2  GLN 553           HG2      GLN 553  61.145  24.420  21.455
  854    HG3  GLN 553           HG1      GLN 553  60.509  25.104  22.937
  855   HE21  GLN 553          HE21      GLN 553  59.595  23.898  19.737
  856   HE22  GLN 553          HE22      GLN 553  57.966  23.597  20.112
  857    H    LYS 554           HN       LYS 554  60.675  26.853  17.414
  858    HA   LYS 554           HA       LYS 554  60.270  29.781  17.610
  859    HB2  LYS 554           HB2      LYS 554  62.457  28.437  15.989
  860    HB3  LYS 554           HB1      LYS 554  62.015  30.136  15.843
  861    HG2  LYS 554           HG2      LYS 554  62.965  28.823  18.403
  862    HG3  LYS 554           HG1      LYS 554  63.993  29.759  17.324
  863    HD2  LYS 554           HD2      LYS 554  62.139  31.619  17.643
  864    HD3  LYS 554           HD1      LYS 554  61.748  30.697  19.095
  865    HE2  LYS 554           HE2      LYS 554  63.328  32.318  19.809
  866    HE3  LYS 554           HE1      LYS 554  64.247  30.820  19.659
  867    HZ1  LYS 554           HZ1      LYS 554  65.522  32.428  18.574
  868    HZ2  LYS 554           HZ2      LYS 554  64.176  33.123  17.805
  869    HZ3  LYS 554           HZ3      LYS 554  64.745  31.599  17.315
  870    HA   PRO 555           HA       PRO 555  57.124  28.342  14.665
  871    HB2  PRO 555           HB2      PRO 555  57.420  31.057  13.508
  872    HB3  PRO 555           HB1      PRO 555  55.956  30.208  14.028
  873    HG2  PRO 555           HG2      PRO 555  57.148  32.214  15.489
  874    HG3  PRO 555           HG1      PRO 555  56.164  30.938  16.212
  875    HD2  PRO 555           HD2      PRO 555  59.079  31.353  16.422
  876    HD3  PRO 555           HD1      PRO 555  58.034  30.285  17.391
  877    H    ILE 556           HN       ILE 556  57.321  27.265  12.857
  878    HA   ILE 556           HA       ILE 556  59.703  27.603  11.134
  879    HB   ILE 556           HB       ILE 556  57.488  25.529  11.276
  880   HG12  ILE 556          HG12      ILE 556  60.417  25.007  11.760
  881   HG13  ILE 556          HG11      ILE 556  59.467  25.717  13.048
  882   HG21  ILE 556          HG21      ILE 556  59.026  24.260   9.718
  883   HG22  ILE 556          HG22      ILE 556  59.870  25.780   9.439
  884   HG23  ILE 556          HG23      ILE 556  58.171  25.620   8.995
  885   HD11  ILE 556          HD11      ILE 556  58.302  23.771  13.436
  886   HD12  ILE 556          HD12      ILE 556  59.689  23.029  12.653
  887   HD13  ILE 556          HD13      ILE 556  58.228  23.348  11.725
  888    H    THR 557           HN       THR 557  59.214  29.425   9.848
  889    HA   THR 557           HA       THR 557  56.564  29.520   8.491
  890    HB   THR 557           HB       THR 557  56.957  31.814   8.172
  891    HG1  THR 557           HG1      THR 557  59.577  30.975   8.150
  892   HG21  THR 557          HG21      THR 557  57.452  32.598  10.377
  893   HG22  THR 557          HG22      THR 557  58.488  31.208  10.705
  894   HG23  THR 557          HG23      THR 557  56.742  30.994  10.579
  895    H    GLY 558           HN       GLY 558  56.869  27.954   6.916
  896    HA2  GLY 558           HA2      GLY 558  57.535  28.602   4.358
  897    HA3  GLY 558           HA1      GLY 558  59.093  28.083   5.018
  898    H    ARG 559           HN       ARG 559  59.413  25.937   5.479
  899    HA   ARG 559           HA       ARG 559  57.236  24.019   4.738
  900    HB2  ARG 559           HB2      ARG 559  60.227  24.019   4.368
  901    HB3  ARG 559           HB1      ARG 559  59.403  22.471   4.557
  902    HG2  ARG 559           HG2      ARG 559  58.344  24.491   2.592
  903    HG3  ARG 559           HG1      ARG 559  59.727  23.506   2.150
  904    HD2  ARG 559           HD2      ARG 559  58.517  21.505   2.271
  905    HD3  ARG 559           HD1      ARG 559  57.268  22.188   3.303
  906    HE   ARG 559           HE       ARG 559  57.288  22.083   0.415
  907   HH11  ARG 559          HH11      ARG 559  55.967  23.372  -0.849
  908   HH12  ARG 559          HH12      ARG 559  55.172  24.739  -0.141
  909   HH21  ARG 559          HH21      ARG 559  56.480  24.206   3.021
  910   HH22  ARG 559          HH22      ARG 559  55.461  25.209   2.043
  911    H    CYS 560           HN       CYS 560  56.964  22.232   6.217
  912    HA   CYS 560           HA       CYS 560  58.592  22.323   8.696
  913    HB2  CYS 560           HB2      CYS 560  56.576  22.314  10.123
  914    HB3  CYS 560           HB1      CYS 560  56.727  23.808   9.195
  915    HG   CYS 560           HG       CYS 560  54.271  22.443   9.092
  916    H    ILE 561           HN       ILE 561  59.143  20.414   9.312
  917    HA   ILE 561           HA       ILE 561  57.782  18.040   8.199
  918    HB   ILE 561           HB       ILE 561  60.287  18.378   9.872
  919   HG12  ILE 561          HG12      ILE 561  59.761  17.810   6.963
  920   HG13  ILE 561          HG11      ILE 561  60.451  19.282   7.621
  921   HG21  ILE 561          HG21      ILE 561  59.076  16.113  10.109
  922   HG22  ILE 561          HG22      ILE 561  60.740  16.059   9.532
  923   HG23  ILE 561          HG23      ILE 561  59.412  15.896   8.389
  924   HD11  ILE 561          HD11      ILE 561  61.670  16.516   7.559
  925   HD12  ILE 561          HD12      ILE 561  62.296  17.799   8.608
  926   HD13  ILE 561          HD13      ILE 561  62.316  18.003   6.852
  927    H    THR 562           HN       THR 562  56.834  16.541   9.493
  928    HA   THR 562           HA       THR 562  56.326  17.306  12.344
  929    HB   THR 562           HB       THR 562  54.392  15.742  10.645
  930    HG1  THR 562           HG1      THR 562  53.495  18.163  11.135
  931   HG21  THR 562          HG21      THR 562  54.326  15.620  13.169
  932   HG22  THR 562          HG22      THR 562  52.847  16.236  12.427
  933   HG23  THR 562          HG23      THR 562  53.991  17.352  13.173
  934    H    ALA 563           HN       ALA 563  56.326  15.693  13.820
  935    HA   ALA 563           HA       ALA 563  57.309  13.018  12.909
  936    HB1  ALA 563           HB1      ALA 563  59.005  14.560  14.011
  937    HB2  ALA 563           HB2      ALA 563  58.792  12.979  14.780
  938    HB3  ALA 563           HB3      ALA 563  58.039  14.412  15.481
  939    H    MET 564           HN       MET 564  57.213  12.790  16.059
  940    HA   MET 564           HA       MET 564  54.798  11.256  16.185
  941    HB2  MET 564           HB2      MET 564  56.131  12.444  18.605
  942    HB3  MET 564           HB1      MET 564  55.416  10.843  18.404
  943    HG2  MET 564           HG2      MET 564  57.291  10.444  16.658
  944    HG3  MET 564           HG1      MET 564  58.053  11.866  17.368
  945    HE1  MET 564           HE1      MET 564  59.068   8.395  17.517
  946    HE2  MET 564           HE2      MET 564  60.184   9.049  18.713
  947    HE3  MET 564           HE3      MET 564  59.772  10.002  17.290
  948    H    ALA 565           HN       ALA 565  54.656  14.080  15.384
  949    HA   ALA 565           HA       ALA 565  52.636  15.423  15.448
  950    HB1  ALA 565           HB1      ALA 565  52.768  15.183  18.466
  951    HB2  ALA 565           HB2      ALA 565  51.734  14.150  17.470
  952    HB3  ALA 565           HB3      ALA 565  51.481  15.891  17.494
  953    H    LYS 566           HN       LYS 566  55.695  15.333  16.727
  954    HA   LYS 566           HA       LYS 566  55.831  18.127  17.614
  955    HB2  LYS 566           HB2      LYS 566  58.089  16.223  16.931
  956    HB3  LYS 566           HB1      LYS 566  58.199  17.678  17.902
  957    HG2  LYS 566           HG2      LYS 566  56.496  15.281  18.636
  958    HG3  LYS 566           HG1      LYS 566  58.122  15.552  19.240
  959    HD2  LYS 566           HD2      LYS 566  57.096  16.667  20.961
  960    HD3  LYS 566           HD1      LYS 566  56.939  17.992  19.812
  961    HE2  LYS 566           HE2      LYS 566  54.734  17.749  20.537
  962    HE3  LYS 566           HE1      LYS 566  54.724  16.712  19.113
  963    HZ1  LYS 566           HZ1      LYS 566  53.844  15.320  20.676
  964    HZ2  LYS 566           HZ2      LYS 566  54.753  15.977  21.952
  965    HZ3  LYS 566           HZ3      LYS 566  55.487  14.930  20.834
  966    H    LYS 567           HN       LYS 567  56.931  19.795  16.389
  967    HA   LYS 567           HA       LYS 567  56.867  19.298  13.443
  968    HB2  LYS 567           HB2      LYS 567  57.350  21.964  14.726
  969    HB3  LYS 567           HB1      LYS 567  56.610  21.617  13.178
  970    HG2  LYS 567           HG2      LYS 567  55.400  21.060  15.908
  971    HG3  LYS 567           HG1      LYS 567  54.896  22.317  14.787
  972    HD2  LYS 567           HD2      LYS 567  54.739  19.319  14.252
  973    HD3  LYS 567           HD1      LYS 567  53.386  20.375  14.658
  974    HE2  LYS 567           HE2      LYS 567  54.119  21.780  12.603
  975    HE3  LYS 567           HE1      LYS 567  55.036  20.348  12.140
  976    HZ1  LYS 567           HZ1      LYS 567  52.666  19.286  12.774
  977    HZ2  LYS 567           HZ2      LYS 567  53.118  19.735  11.199
  978    HZ3  LYS 567           HZ3      LYS 567  52.181  20.786  12.149
  979    H    PHE 568           HN       PHE 568  58.790  20.622  12.279
  980    HA   PHE 568           HA       PHE 568  61.229  20.659  13.903
  981    HB2  PHE 568           HB2      PHE 568  60.429  18.242  12.447
  982    HB3  PHE 568           HB1      PHE 568  62.018  18.790  11.935
  983    HD1  PHE 568           HD1      PHE 568  63.766  19.273  13.755
  984    HD2  PHE 568           HD2      PHE 568  60.133  17.108  14.511
  985    HE1  PHE 568           HE1      PHE 568  64.758  18.331  15.823
  986    HE2  PHE 568           HE2      PHE 568  61.126  16.166  16.579
  987    HZ   PHE 568           HZ       PHE 568  63.438  16.777  17.235
  988    H    HIS 569           HN       HIS 569  62.641  21.996  13.071
  989    HA   HIS 569           HA       HIS 569  62.273  23.641  10.817
  990    HB2  HIS 569           HB2      HIS 569  64.516  22.741  12.488
  991    HB3  HIS 569           HB1      HIS 569  64.990  23.478  10.972
  992    HD2  HIS 569           HD2      HIS 569  63.125  26.105  10.917
  993    HE1  HIS 569           HE1      HIS 569  64.437  26.762  14.879
  994    HA   PRO 570           HA       PRO 570  62.517  20.130   7.842
  995    HB2  PRO 570           HB2      PRO 570  63.070  22.398   5.976
  996    HB3  PRO 570           HB1      PRO 570  61.921  21.059   5.811
  997    HG2  PRO 570           HG2      PRO 570  61.116  23.560   6.485
  998    HG3  PRO 570           HG1      PRO 570  60.300  22.112   7.087
  999    HD2  PRO 570           HD2      PRO 570  62.029  24.021   8.562
 1000    HD3  PRO 570           HD1      PRO 570  60.801  22.889   9.190
 1001    H    GLU 571           HN       GLU 571  65.045  22.177   8.838
 1002    HA   GLU 571           HA       GLU 571  67.043  20.697   7.158
 1003    HB2  GLU 571           HB2      GLU 571  67.678  23.167   8.756
 1004    HB3  GLU 571           HB1      GLU 571  68.453  22.556   7.294
 1005    HG2  GLU 571           HG2      GLU 571  66.166  22.963   6.155
 1006    HG3  GLU 571           HG1      GLU 571  65.799  23.948   7.572
 1007    H    HIS 572           HN       HIS 572  66.607  22.121  10.339
 1008    HA   HIS 572           HA       HIS 572  68.635  20.938  11.841
 1009    HB2  HIS 572           HB2      HIS 572  66.589  22.512  12.332
 1010    HB3  HIS 572           HB1      HIS 572  65.817  21.037  12.885
 1011    HD2  HIS 572           HD2      HIS 572  69.255  20.494  14.055
 1012    HE1  HIS 572           HE1      HIS 572  67.576  22.960  17.041
 1013    H    PHE 573           HN       PHE 573  66.054  19.415  10.236
 1014    HA   PHE 573           HA       PHE 573  66.503  16.844  11.719
 1015    HB2  PHE 573           HB2      PHE 573  64.179  17.874  11.859
 1016    HB3  PHE 573           HB1      PHE 573  64.055  17.605  10.121
 1017    HD1  PHE 573           HD1      PHE 573  63.425  15.493   9.275
 1018    HD2  PHE 573           HD2      PHE 573  64.766  15.844  13.341
 1019    HE1  PHE 573           HE1      PHE 573  62.808  13.128   9.683
 1020    HE2  PHE 573           HE2      PHE 573  64.149  13.478  13.749
 1021    HZ   PHE 573           HZ       PHE 573  63.170  12.119  11.921
 1022    H    VAL 574           HN       VAL 574  68.309  17.383   9.856
 1023    HA   VAL 574           HA       VAL 574  67.438  16.351   7.250
 1024    HB   VAL 574           HB       VAL 574  69.868  16.687   6.663
 1025   HG11  VAL 574          HG11      VAL 574  69.068  18.673   5.939
 1026   HG12  VAL 574          HG12      VAL 574  69.369  19.384   7.503
 1027   HG13  VAL 574          HG13      VAL 574  67.805  18.649   7.150
 1028   HG21  VAL 574          HG21      VAL 574  69.954  18.002   9.405
 1029   HG22  VAL 574          HG22      VAL 574  71.287  17.895   8.239
 1030   HG23  VAL 574          HG23      VAL 574  70.682  16.432   9.024
 1031    H    CYS 575           HN       CYS 575  69.143  14.650   6.309
 1032    HA   CYS 575           HA       CYS 575  69.027  12.265   7.982
 1033    HB2  CYS 575           HB2      CYS 575  69.078  11.488   5.837
 1034    HB3  CYS 575           HB1      CYS 575  69.853  12.951   5.244
 1035    H    ALA 576           HN       ALA 576  70.738  11.313   9.224
 1036    HA   ALA 576           HA       ALA 576  73.037  13.191   9.602
 1037    HB1  ALA 576           HB1      ALA 576  73.500  11.982  11.580
 1038    HB2  ALA 576           HB2      ALA 576  72.655  10.541  11.014
 1039    HB3  ALA 576           HB3      ALA 576  71.737  11.968  11.501
 1040    H    PHE 577           HN       PHE 577  73.610  12.712   7.394
 1041    HA   PHE 577           HA       PHE 577  75.853  10.880   7.283
 1042    HB2  PHE 577           HB2      PHE 577  73.823   9.634   6.141
 1043    HB3  PHE 577           HB1      PHE 577  74.029  10.823   4.858
 1044    HD1  PHE 577           HD1      PHE 577  74.431   7.802   4.503
 1045    HD2  PHE 577           HD2      PHE 577  77.253  10.886   5.485
 1046    HE1  PHE 577           HE1      PHE 577  76.258   6.454   3.561
 1047    HE2  PHE 577           HE2      PHE 577  79.062   9.524   4.562
 1048    HZ   PHE 577           HZ       PHE 577  78.574   7.310   3.597
 1049    H    CYS 578           HN       CYS 578  73.664  12.798   5.368
 1050    HA   CYS 578           HA       CYS 578  75.796  14.743   4.614
 1051    HB2  CYS 578           HB2      CYS 578  73.732  15.466   3.045
 1052    HB3  CYS 578           HB1      CYS 578  74.820  14.169   2.566
 1053    H    LEU 579           HN       LEU 579  75.142  17.028   4.941
 1054    HA   LEU 579           HA       LEU 579  73.268  17.322   7.229
 1055    HB2  LEU 579           HB2      LEU 579  75.015  19.620   6.488
 1056    HB3  LEU 579           HB1      LEU 579  74.623  18.961   8.070
 1057    HG   LEU 579           HG       LEU 579  76.980  18.675   7.626
 1058   HD11  LEU 579          HD11      LEU 579  76.037  15.873   7.196
 1059   HD12  LEU 579          HD12      LEU 579  75.436  16.733   8.614
 1060   HD13  LEU 579          HD13      LEU 579  77.170  16.520   8.381
 1061   HD21  LEU 579          HD21      LEU 579  76.290  18.369   4.955
 1062   HD22  LEU 579          HD22      LEU 579  76.824  16.749   5.412
 1063   HD23  LEU 579          HD23      LEU 579  77.890  18.129   5.648
 1064    H    LYS 580           HN       LYS 580  72.747  17.553   4.004
 1065    HA   LYS 580           HA       LYS 580  71.687  20.348   4.119
 1066    HB2  LYS 580           HB2      LYS 580  71.934  20.462   1.835
 1067    HB3  LYS 580           HB1      LYS 580  73.198  19.318   2.246
 1068    HG2  LYS 580           HG2      LYS 580  70.430  18.518   1.259
 1069    HG3  LYS 580           HG1      LYS 580  71.860  18.643   0.254
 1070    HD2  LYS 580           HD2      LYS 580  72.947  16.849   1.344
 1071    HD3  LYS 580           HD1      LYS 580  71.829  16.880   2.703
 1072    HE2  LYS 580           HE2      LYS 580  71.450  15.025   0.999
 1073    HE3  LYS 580           HE1      LYS 580  70.048  16.016   1.404
 1074    HZ1  LYS 580           HZ1      LYS 580  70.736  15.544  -1.079
 1075    HZ2  LYS 580           HZ2      LYS 580  71.738  16.891  -0.814
 1076    HZ3  LYS 580           HZ3      LYS 580  70.056  17.026  -0.613
 1077    H    GLN 581           HN       GLN 581  70.222  17.056   3.401
 1078    HA   GLN 581           HA       GLN 581  67.724  18.271   4.244
 1079    HB2  GLN 581           HB2      GLN 581  68.028  19.128   1.928
 1080    HB3  GLN 581           HB1      GLN 581  67.792  17.479   1.352
 1081    HG2  GLN 581           HG2      GLN 581  65.643  18.502   1.272
 1082    HG3  GLN 581           HG1      GLN 581  65.607  17.505   2.711
 1083   HE21  GLN 581          HE21      GLN 581  66.060  18.680   4.822
 1084   HE22  GLN 581          HE22      GLN 581  65.603  20.302   4.936
 1085    H    LEU 582           HN       LEU 582  66.136  17.003   4.774
 1086    HA   LEU 582           HA       LEU 582  66.094  14.164   3.952
 1087    HB2  LEU 582           HB2      LEU 582  67.146  14.474   6.237
 1088    HB3  LEU 582           HB1      LEU 582  65.587  15.055   6.793
 1089    HG   LEU 582           HG       LEU 582  64.578  12.898   6.113
 1090   HD11  LEU 582          HD11      LEU 582  67.283  12.494   4.954
 1091   HD12  LEU 582          HD12      LEU 582  65.740  11.784   4.492
 1092   HD13  LEU 582          HD13      LEU 582  66.646  11.101   5.837
 1093   HD21  LEU 582          HD21      LEU 582  66.875  13.006   8.060
 1094   HD22  LEU 582          HD22      LEU 582  65.952  11.518   7.848
 1095   HD23  LEU 582          HD23      LEU 582  65.143  12.990   8.380
 1096    H    ASN 583           HN       ASN 583  63.810  13.270   4.533
 1097    HA   ASN 583           HA       ASN 583  61.737  15.378   4.792
 1098    HB2  ASN 583           HB2      ASN 583  62.270  13.799   2.278
 1099    HB3  ASN 583           HB1      ASN 583  60.616  14.255   2.666
 1100   HD21  ASN 583          HD21      ASN 583  61.728  15.329   0.381
 1101   HD22  ASN 583          HD22      ASN 583  62.061  16.973   0.610
 1102    H    LYS 584           HN       LYS 584  59.992  14.614   5.857
 1103    HA   LYS 584           HA       LYS 584  59.938  12.168   7.196
 1104    HB2  LYS 584           HB2      LYS 584  57.426  12.582   7.293
 1105    HB3  LYS 584           HB1      LYS 584  58.445  13.914   7.844
 1106    HG2  LYS 584           HG2      LYS 584  58.097  15.173   5.885
 1107    HG3  LYS 584           HG1      LYS 584  57.572  13.765   4.953
 1108    HD2  LYS 584           HD2      LYS 584  55.661  15.221   5.548
 1109    HD3  LYS 584           HD1      LYS 584  55.530  13.630   6.291
 1110    HE2  LYS 584           HE2      LYS 584  56.239  14.457   8.422
 1111    HE3  LYS 584           HE1      LYS 584  56.742  15.997   7.726
 1112    HZ1  LYS 584           HZ1      LYS 584  54.692  16.786   7.900
 1113    HZ2  LYS 584           HZ2      LYS 584  54.293  15.411   8.814
 1114    HZ3  LYS 584           HZ3      LYS 584  54.018  15.429   7.138
 1115    H    GLY 585           HN       GLY 585  59.302  12.822   3.881
 1116    HA2  GLY 585           HA2      GLY 585  57.738  10.369   3.453
 1117    HA3  GLY 585           HA1      GLY 585  58.222  11.528   2.217
 1118    H    THR 586           HN       THR 586  60.988  11.427   3.417
 1119    HA   THR 586           HA       THR 586  61.861   8.730   2.465
 1120    HB   THR 586           HB       THR 586  63.393   9.607   0.946
 1121    HG1  THR 586           HG1      THR 586  63.499  12.198   1.436
 1122   HG21  THR 586          HG21      THR 586  61.034  10.227   0.305
 1123   HG22  THR 586          HG22      THR 586  62.263  11.284  -0.392
 1124   HG23  THR 586          HG23      THR 586  61.320  11.823   1.001
 1125    H    PHE 587           HN       PHE 587  61.539  10.074   5.133
 1126    HA   PHE 587           HA       PHE 587  64.366  10.371   5.988
 1127    HB2  PHE 587           HB2      PHE 587  63.614  11.281   7.990
 1128    HB3  PHE 587           HB1      PHE 587  62.418  11.846   6.846
 1129    HD1  PHE 587           HD1      PHE 587  62.612  10.829  10.053
 1130    HD2  PHE 587           HD2      PHE 587  60.571   9.662   6.461
 1131    HE1  PHE 587           HE1      PHE 587  60.831   9.766  11.406
 1132    HE2  PHE 587           HE2      PHE 587  58.793   8.601   7.812
 1133    HZ   PHE 587           HZ       PHE 587  58.921   8.651  10.287
 1134    H    LYS 588           HN       LYS 588  65.410   8.564   6.247
 1135    HA   LYS 588           HA       LYS 588  64.115   6.204   7.516
 1136    HB2  LYS 588           HB2      LYS 588  65.762   6.501   5.244
 1137    HB3  LYS 588           HB1      LYS 588  66.837   5.889   6.458
 1138    HG2  LYS 588           HG2      LYS 588  65.751   4.111   5.051
 1139    HG3  LYS 588           HG1      LYS 588  65.555   3.903   6.776
 1140    HD2  LYS 588           HD2      LYS 588  63.519   3.519   5.166
 1141    HD3  LYS 588           HD1      LYS 588  63.266   4.321   6.696
 1142    HE2  LYS 588           HE2      LYS 588  62.871   6.384   5.684
 1143    HE3  LYS 588           HE1      LYS 588  63.884   6.012   4.307
 1144    HZ1  LYS 588           HZ1      LYS 588  62.217   4.418   3.568
 1145    HZ2  LYS 588           HZ2      LYS 588  61.585   5.992   3.671
 1146    HZ3  LYS 588           HZ3      LYS 588  61.226   4.848   4.875
 1147    H    GLU 589           HN       GLU 589  65.720   5.021   9.070
 1148    HA   GLU 589           HA       GLU 589  67.560   6.903  10.435
 1149    HB2  GLU 589           HB2      GLU 589  65.658   7.562  11.610
 1150    HB3  GLU 589           HB1      GLU 589  64.939   5.957  11.573
 1151    HG2  GLU 589           HG2      GLU 589  66.445   5.158  13.260
 1152    HG3  GLU 589           HG1      GLU 589  67.463   6.597  13.133
 1153    H    GLN 590           HN       GLN 590  68.829   5.934  12.010
 1154    HA   GLN 590           HA       GLN 590  68.823   3.029  12.367
 1155    HB2  GLN 590           HB2      GLN 590  70.167   3.705  10.193
 1156    HB3  GLN 590           HB1      GLN 590  71.374   4.277  11.334
 1157    HG2  GLN 590           HG2      GLN 590  72.117   2.097  11.151
 1158    HG3  GLN 590           HG1      GLN 590  70.927   1.850  12.426
 1159   HE21  GLN 590          HE21      GLN 590  71.553   1.392   8.968
 1160   HE22  GLN 590          HE22      GLN 590  70.259   0.329   8.694
 1161    H    ASN 591           HN       ASN 591  69.990   2.519  14.289
 1162    HA   ASN 591           HA       ASN 591  70.634   3.040  16.474
 1163    HB2  ASN 591           HB2      ASN 591  72.699   4.821  16.269
 1164    HB3  ASN 591           HB1      ASN 591  72.864   3.106  15.956
 1165   HD21  ASN 591          HD21      ASN 591  72.130   2.560  13.564
 1166   HD22  ASN 591          HD22      ASN 591  72.755   3.586  12.372
 1167    H    ASP 592           HN       ASP 592  68.540   4.824  15.202
 1168    HA   ASP 592           HA       ASP 592  67.172   6.498  16.149
 1169    HB2  ASP 592           HB2      ASP 592  69.411   7.421  17.930
 1170    HB3  ASP 592           HB1      ASP 592  67.672   7.507  18.197
 1171    H    LYS 593           HN       LYS 593  70.065   6.859  14.572
 1172    HA   LYS 593           HA       LYS 593  70.049   9.790  14.465
 1173    HB2  LYS 593           HB2      LYS 593  71.738   7.825  12.946
 1174    HB3  LYS 593           HB1      LYS 593  72.063   9.534  13.198
 1175    HG2  LYS 593           HG2      LYS 593  71.946   8.910  15.745
 1176    HG3  LYS 593           HG1      LYS 593  72.213   7.266  15.171
 1177    HD2  LYS 593           HD2      LYS 593  74.285   7.920  14.084
 1178    HD3  LYS 593           HD1      LYS 593  74.000   9.618  14.474
 1179    HE2  LYS 593           HE2      LYS 593  74.281   7.433  16.557
 1180    HE3  LYS 593           HE1      LYS 593  75.610   8.469  16.035
 1181    HZ1  LYS 593           HZ1      LYS 593  73.294   9.104  17.674
 1182    HZ2  LYS 593           HZ2      LYS 593  73.774  10.298  16.564
 1183    HZ3  LYS 593           HZ3      LYS 593  74.870   9.728  17.732
 1184    HA   PRO 594           HA       PRO 594  67.140   9.624  10.946
 1185    HB2  PRO 594           HB2      PRO 594  68.495  12.163  10.180
 1186    HB3  PRO 594           HB1      PRO 594  66.776  11.836  10.408
 1187    HG2  PRO 594           HG2      PRO 594  68.297  13.250  12.195
 1188    HG3  PRO 594           HG1      PRO 594  66.864  12.323  12.662
 1189    HD2  PRO 594           HD2      PRO 594  69.717  11.731  13.209
 1190    HD3  PRO 594           HD1      PRO 594  68.257  11.094  14.008
 1191    H    TYR 595           HN       TYR 595  67.335   9.534   8.543
 1192    HA   TYR 595           HA       TYR 595  69.933   9.596   7.255
 1193    HB2  TYR 595           HB2      TYR 595  68.842   6.984   8.253
 1194    HB3  TYR 595           HB1      TYR 595  69.701   7.005   6.723
 1195    HD1  TYR 595           HD1      TYR 595  71.969   8.453   6.813
 1196    HD2  TYR 595           HD2      TYR 595  70.126   6.485  10.150
 1197    HE1  TYR 595           HE1      TYR 595  74.167   8.339   7.968
 1198    HE2  TYR 595           HE2      TYR 595  72.324   6.385  11.296
 1199    HH   TYR 595           HH       TYR 595  75.012   6.469  10.129
 1200    H    CYS 596           HN       CYS 596  69.636   9.559   4.980
 1201    HA   CYS 596           HA       CYS 596  66.866   9.529   4.001
 1202    HB2  CYS 596           HB2      CYS 596  69.297   9.333   2.209
 1203    HB3  CYS 596           HB1      CYS 596  67.740  10.070   1.870
 1204    H    GLN 597           HN       GLN 597  66.129   7.817   2.449
 1205    HA   GLN 597           HA       GLN 597  66.879   5.240   3.410
 1206    HB2  GLN 597           HB2      GLN 597  64.772   5.195   2.406
 1207    HB3  GLN 597           HB1      GLN 597  65.254   6.272   1.127
 1208    HG2  GLN 597           HG2      GLN 597  65.046   4.262  -0.036
 1209    HG3  GLN 597           HG1      GLN 597  66.747   4.227   0.375
 1210   HE21  GLN 597          HE21      GLN 597  66.065   3.726   3.279
 1211   HE22  GLN 597          HE22      GLN 597  65.631   2.105   3.349
 1212    H    ASN 598           HN       ASN 598  67.614   6.839   0.312
 1213    HA   ASN 598           HA       ASN 598  69.472   5.042  -0.720
 1214    HB2  ASN 598           HB2      ASN 598  70.157   7.962  -0.856
 1215    HB3  ASN 598           HB1      ASN 598  70.126   6.761  -2.140
 1216   HD21  ASN 598          HD21      ASN 598  67.695   5.777  -2.274
 1217   HD22  ASN 598          HD22      ASN 598  66.500   6.967  -2.418
 1218    H    CYS 599           HN       CYS 599  69.829   7.253   1.961
 1219    HA   CYS 599           HA       CYS 599  72.712   6.868   2.190
 1220    HB2  CYS 599           HB2      CYS 599  70.589   8.259   3.805
 1221    HB3  CYS 599           HB1      CYS 599  72.149   7.940   4.539
 1222    H    PHE 600           HN       PHE 600  69.984   6.039   4.360
 1223    HA   PHE 600           HA       PHE 600  71.377   4.227   6.018
 1224    HB2  PHE 600           HB2      PHE 600  69.323   4.762   6.929
 1225    HB3  PHE 600           HB1      PHE 600  68.540   4.822   5.358
 1226    HD1  PHE 600           HD1      PHE 600  69.473   2.687   8.200
 1227    HD2  PHE 600           HD2      PHE 600  67.648   2.784   4.315
 1228    HE1  PHE 600           HE1      PHE 600  68.483   0.446   8.605
 1229    HE2  PHE 600           HE2      PHE 600  66.667   0.544   4.717
 1230    HZ   PHE 600           HZ       PHE 600  67.084  -0.625   6.863
 1231    H    LEU 601           HN       LEU 601  69.225   3.402   3.268
 1232    HA   LEU 601           HA       LEU 601  69.581   0.654   3.299
 1233    HB2  LEU 601           HB2      LEU 601  68.309   0.816   1.423
 1234    HB3  LEU 601           HB1      LEU 601  68.471   2.554   1.549
 1235    HG   LEU 601           HG       LEU 601  70.583   2.375   0.161
 1236   HD11  LEU 601          HD11      LEU 601  69.971  -0.486   0.459
 1237   HD12  LEU 601          HD12      LEU 601  71.454   0.286  -0.095
 1238   HD13  LEU 601          HD13      LEU 601  70.153  -0.028  -1.233
 1239   HD21  LEU 601          HD21      LEU 601  68.060   1.299  -1.120
 1240   HD22  LEU 601          HD22      LEU 601  69.360   2.169  -1.934
 1241   HD23  LEU 601          HD23      LEU 601  68.351   2.998  -0.752
 1242    H    LYS 602           HN       LYS 602  71.751   3.078   1.873
 1243    HA   LYS 602           HA       LYS 602  73.585   1.256   0.712
 1244    HB2  LYS 602           HB2      LYS 602  73.500   3.814   0.488
 1245    HB3  LYS 602           HB1      LYS 602  74.398   3.859   2.000
 1246    HG2  LYS 602           HG2      LYS 602  76.264   2.769   1.061
 1247    HG3  LYS 602           HG1      LYS 602  75.360   2.207  -0.342
 1248    HD2  LYS 602           HD2      LYS 602  75.178   4.433  -1.229
 1249    HD3  LYS 602           HD1      LYS 602  75.821   5.137   0.247
 1250    HE2  LYS 602           HE2      LYS 602  77.897   3.485  -0.389
 1251    HE3  LYS 602           HE1      LYS 602  77.262   3.807  -2.003
 1252    HZ1  LYS 602           HZ1      LYS 602  78.138   5.819  -1.948
 1253    HZ2  LYS 602           HZ2      LYS 602  78.852   5.459  -0.449
 1254    HZ3  LYS 602           HZ3      LYS 602  77.322   6.197  -0.510
 1255    H    LEU 603           HN       LEU 603  73.001   2.014   4.040
 1256    HA   LEU 603           HA       LEU 603  75.623   0.986   4.921
 1257    HB2  LEU 603           HB2      LEU 603  73.347   1.667   6.759
 1258    HB3  LEU 603           HB1      LEU 603  75.084   1.796   7.048
 1259    HG   LEU 603           HG       LEU 603  73.415   3.497   5.198
 1260   HD11  LEU 603          HD11      LEU 603  73.512   3.890   7.772
 1261   HD12  LEU 603          HD12      LEU 603  73.746   5.260   6.689
 1262   HD13  LEU 603          HD13      LEU 603  75.142   4.493   7.448
 1263   HD21  LEU 603          HD21      LEU 603  76.396   3.205   5.508
 1264   HD22  LEU 603          HD22      LEU 603  75.702   4.744   5.007
 1265   HD23  LEU 603          HD23      LEU 603  75.444   3.305   4.029
 1266    H    PHE 604           HN       PHE 604  72.218   0.092   5.639
 1267    HA   PHE 604           HA       PHE 604  73.181  -2.538   6.589
 1268    HB2  PHE 604           HB2      PHE 604  70.602  -1.010   6.717
 1269    HB3  PHE 604           HB1      PHE 604  70.526  -2.764   6.869
 1270    HD1  PHE 604           HD1      PHE 604  73.071  -0.243   8.056
 1271    HD2  PHE 604           HD2      PHE 604  70.245  -3.306   9.132
 1272    HE1  PHE 604           HE1      PHE 604  73.797  -0.089  10.416
 1273    HE2  PHE 604           HE2      PHE 604  70.976  -3.141  11.495
 1274    HZ   PHE 604           HZ       PHE 604  72.751  -1.534  12.136
 1275    H    CYS 605           HN       CYS 605  73.397  -1.872   3.700
 1276    HA   CYS 605           HA       CYS 605  72.096  -4.336   2.712
 1277    HB2  CYS 605           HB2      CYS 605  71.728  -1.860   1.033
 1278    HB3  CYS 605           HB1      CYS 605  70.819  -3.371   1.007
 1279    HG   CYS 605           HG       CYS 605  69.397  -2.587   2.922
  Start of MODEL    4
    1    H    MET   1           HT1      MET   1  90.778 -25.561  19.714
    2    HA   MET   1           HA       MET   1  89.271 -27.238  17.845
    3    HB2  MET   1           HB2      MET   1  89.979 -24.850  17.406
    4    HB3  MET   1           HB1      MET   1  91.652 -25.399  17.459
    5    HG2  MET   1           HG2      MET   1  90.897 -27.150  15.680
    6    HG3  MET   1           HG1      MET   1  89.502 -26.094  15.463
    7    HE1  MET   1           HE1      MET   1  90.029 -25.558  12.947
    8    HE2  MET   1           HE2      MET   1  91.235 -26.822  13.169
    9    HE3  MET   1           HE3      MET   1  91.683 -25.319  12.367
   10    H    ALA   2           HN       ALA   2  92.525 -26.867  17.033
   11    HA   ALA   2           HA       ALA   2  93.404 -29.411  18.277
   12    HB1  ALA   2           HB1      ALA   2  93.481 -29.013  15.278
   13    HB2  ALA   2           HB2      ALA   2  92.213 -29.935  16.088
   14    HB3  ALA   2           HB3      ALA   2  93.890 -30.474  16.176
   15    H    LEU   3           HN       LEU   3  94.233 -27.077  15.730
   16    HA   LEU   3           HA       LEU   3  96.996 -27.149  15.771
   17    HB2  LEU   3           HB2      LEU   3  95.116 -24.789  15.614
   18    HB3  LEU   3           HB1      LEU   3  96.851 -24.630  15.343
   19    HG   LEU   3           HG       LEU   3  95.081 -26.563  13.822
   20   HD11  LEU   3          HD11      LEU   3  95.431 -24.847  11.944
   21   HD12  LEU   3          HD12      LEU   3  95.926 -23.725  13.212
   22   HD13  LEU   3          HD13      LEU   3  94.297 -24.400  13.219
   23   HD21  LEU   3          HD21      LEU   3  97.984 -25.788  13.714
   24   HD22  LEU   3          HD22      LEU   3  97.173 -26.183  12.200
   25   HD23  LEU   3          HD23      LEU   3  97.234 -27.369  13.498
   26    H    ASP   4           HN       ASP   4  95.579 -24.387  17.323
   27    HA   ASP   4           HA       ASP   4  96.262 -23.207  19.231
   28    HB2  ASP   4           HB2      ASP   4  94.825 -24.935  20.214
   29    HB3  ASP   4           HB1      ASP   4  96.193 -26.046  20.248
   30    H    GLY   5           HN       GLY   5  98.359 -24.395  17.440
   31    HA2  GLY   5           HA2      GLY   5 100.590 -25.282  19.016
   32    HA3  GLY   5           HA1      GLY   5 100.688 -24.585  17.396
   33    H    ILE   6           HN       ILE   6  99.025 -22.347  18.639
   34    HA   ILE   6           HA       ILE   6 101.345 -20.772  19.683
   35    HB   ILE   6           HB       ILE   6  99.412 -18.926  18.921
   36   HG12  ILE   6          HG12      ILE   6  98.125 -20.940  17.981
   37   HG13  ILE   6          HG11      ILE   6  98.381 -19.575  16.901
   38   HG21  ILE   6          HG21      ILE   6 101.695 -20.106  17.356
   39   HG22  ILE   6          HG22      ILE   6 101.692 -18.636  18.331
   40   HG23  ILE   6          HG23      ILE   6 100.786 -18.693  16.820
   41   HD11  ILE   6          HD11      ILE   6  98.953 -22.194  16.287
   42   HD12  ILE   6          HD12      ILE   6 100.537 -21.601  16.780
   43   HD13  ILE   6          HD13      ILE   6  99.661 -20.799  15.479
   44    H    ARG   7           HN       ARG   7  98.100 -19.537  19.956
   45    HA   ARG   7           HA       ARG   7  97.791 -20.486  22.721
   46    HB2  ARG   7           HB2      ARG   7  97.532 -18.064  23.492
   47    HB3  ARG   7           HB1      ARG   7  99.168 -18.627  23.186
   48    HG2  ARG   7           HG2      ARG   7  97.825 -17.427  20.816
   49    HG3  ARG   7           HG1      ARG   7  98.131 -16.309  22.141
   50    HD2  ARG   7           HD2      ARG   7 100.490 -16.809  22.117
   51    HD3  ARG   7           HD1      ARG   7 100.247 -18.124  20.972
   52    HE   ARG   7           HE       ARG   7  99.241 -15.804  19.734
   53   HH11  ARG   7          HH11      ARG   7 100.531 -14.637  18.292
   54   HH12  ARG   7          HH12      ARG   7 102.255 -14.788  18.375
   55   HH21  ARG   7          HH21      ARG   7 102.196 -17.032  21.018
   56   HH22  ARG   7          HH22      ARG   7 103.197 -16.143  19.919
   57    H    MET   8           HN       MET   8  96.330 -17.471  21.778
   58    HA   MET   8           HA       MET   8  93.918 -18.848  20.763
   59    HB2  MET   8           HB2      MET   8  92.902 -17.026  22.719
   60    HB3  MET   8           HB1      MET   8  92.786 -18.772  22.711
   61    HG2  MET   8           HG2      MET   8  94.850 -19.024  23.905
   62    HG3  MET   8           HG1      MET   8  95.239 -17.321  23.770
   63    HE1  MET   8           HE1      MET   8  95.452 -18.891  26.173
   64    HE2  MET   8           HE2      MET   8  93.986 -19.849  26.359
   65    HE3  MET   8           HE3      MET   8  94.327 -18.545  27.493
   66    HA   PRO   9           HA       PRO   9  93.266 -13.972  20.071
   67    HB2  PRO   9           HB2      PRO   9  96.218 -13.422  20.375
   68    HB3  PRO   9           HB1      PRO   9  94.849 -12.301  20.561
   69    HG2  PRO   9           HG2      PRO   9  95.998 -13.310  22.692
   70    HG3  PRO   9           HG1      PRO   9  94.229 -13.215  22.591
   71    HD2  PRO   9           HD2      PRO   9  95.978 -15.625  22.358
   72    HD3  PRO   9           HD1      PRO   9  94.349 -15.464  23.006
   73    H    ASP  10           HN       ASP  10  96.086 -15.856  19.389
   74    HA   ASP  10           HA       ASP  10  95.806 -15.348  16.439
   75    HB2  ASP  10           HB2      ASP  10  97.982 -14.631  17.662
   76    HB3  ASP  10           HB1      ASP  10  98.318 -16.356  17.787
   77    H    GLY  11           HN       GLY  11  95.941 -17.617  19.030
   78    HA2  GLY  11           HA2      GLY  11  96.139 -19.954  17.238
   79    HA3  GLY  11           HA1      GLY  11  96.040 -19.995  18.992
   80    H    CYS  12           HN       CYS  12  93.702 -17.878  17.915
   81    HA   CYS  12           HA       CYS  12  91.671 -19.791  17.119
   82    HB2  CYS  12           HB2      CYS  12  91.745 -20.465  19.424
   83    HB3  CYS  12           HB1      CYS  12  91.721 -18.788  19.968
   84    HG   CYS  12           HG       CYS  12  89.262 -19.558  18.306
   85    H    TYR  13           HN       TYR  13  92.539 -16.542  18.167
   86    HA   TYR  13           HA       TYR  13  91.537 -14.486  17.779
   87    HB2  TYR  13           HB2      TYR  13  90.474 -16.069  15.420
   88    HB3  TYR  13           HB1      TYR  13  90.249 -14.332  15.616
   89    HD1  TYR  13           HD1      TYR  13  92.661 -17.012  14.917
   90    HD2  TYR  13           HD2      TYR  13  92.152 -12.787  15.503
   91    HE1  TYR  13           HE1      TYR  13  94.916 -16.608  13.965
   92    HE2  TYR  13           HE2      TYR  13  94.406 -12.383  14.551
   93    HH   TYR  13           HH       TYR  13  95.950 -13.905  12.775
   94    H    ALA  14           HN       ALA  14  88.698 -14.945  16.279
   95    HA   ALA  14           HA       ALA  14  87.087 -16.121  18.350
   96    HB1  ALA  14           HB1      ALA  14  86.264 -14.240  19.492
   97    HB2  ALA  14           HB2      ALA  14  86.816 -13.124  18.244
   98    HB3  ALA  14           HB3      ALA  14  87.982 -13.875  19.332
   99    H    ASP  15           HN       ASP  15  87.235 -13.777  15.707
  100    HA   ASP  15           HA       ASP  15  84.987 -15.146  14.414
  101    HB2  ASP  15           HB2      ASP  15  83.969 -13.458  16.006
  102    HB3  ASP  15           HB1      ASP  15  84.747 -12.204  15.040
  103    H    GLY  16           HN       GLY  16  87.901 -13.849  14.167
  104    HA2  GLY  16           HA2      GLY  16  89.161 -13.391  12.206
  105    HA3  GLY  16           HA1      GLY  16  87.658 -13.405  11.278
  106    H    THR  17           HN       THR  17  88.441 -11.523  14.169
  107    HA   THR  17           HA       THR  17  87.410  -9.112  12.895
  108    HB   THR  17           HB       THR  17  88.209  -8.070  15.105
  109    HG1  THR  17           HG1      THR  17  88.448 -10.761  15.896
  110   HG21  THR  17          HG21      THR  17  86.336  -8.968  16.327
  111   HG22  THR  17          HG22      THR  17  86.345 -10.440  15.356
  112   HG23  THR  17          HG23      THR  17  85.877  -8.904  14.626
  113    H    TRP  18           HN       TRP  18  88.582  -7.637  11.862
  114    HA   TRP  18           HA       TRP  18  91.423  -7.216  12.400
  115    HB2  TRP  18           HB2      TRP  18  91.582  -7.343   9.677
  116    HB3  TRP  18           HB1      TRP  18  92.016  -8.672  10.732
  117    HD1  TRP  18           HD1      TRP  18  88.640  -7.414   9.278
  118    HE1  TRP  18           HE1      TRP  18  87.387  -9.461   8.322
  119    HE3  TRP  18           HE3      TRP  18  92.031 -11.086  10.318
  120    HZ2  TRP  18           HZ2      TRP  18  87.776 -12.275   8.041
  121    HZ3  TRP  18           HZ3      TRP  18  91.565 -13.440   9.694
  122    HH2  TRP  18           HH2      TRP  18  89.444 -14.038   8.558
  123    H    GLU  19           HN       GLU  19  91.953  -5.067  12.000
  124    HA   GLU  19           HA       GLU  19  89.727  -3.340  11.108
  125    HB2  GLU  19           HB2      GLU  19  91.825  -1.616  11.717
  126    HB3  GLU  19           HB1      GLU  19  90.553  -2.096  12.833
  127    HG2  GLU  19           HG2      GLU  19  92.799  -2.452  13.792
  128    HG3  GLU  19           HG1      GLU  19  91.902  -3.959  13.617
  129    H    LEU  20           HN       LEU  20  89.611  -2.338   9.243
  130    HA   LEU  20           HA       LEU  20  91.674  -2.890   7.230
  131    HB2  LEU  20           HB2      LEU  20  88.862  -2.408   7.214
  132    HB3  LEU  20           HB1      LEU  20  89.566  -1.043   6.364
  133    HG   LEU  20           HG       LEU  20  89.106  -2.671   4.708
  134   HD11  LEU  20          HD11      LEU  20  91.111  -2.769   3.652
  135   HD12  LEU  20          HD12      LEU  20  91.957  -3.455   5.033
  136   HD13  LEU  20          HD13      LEU  20  91.621  -1.722   4.974
  137   HD21  LEU  20          HD21      LEU  20  88.676  -4.641   5.939
  138   HD22  LEU  20          HD22      LEU  20  90.272  -4.633   6.683
  139   HD23  LEU  20          HD23      LEU  20  90.098  -5.039   4.979
  140    H    SER  21           HN       SER  21  93.177  -1.377   6.581
  141    HA   SER  21           HA       SER  21  93.421   1.047   8.198
  142    HB2  SER  21           HB2      SER  21  95.293  -0.486   7.091
  143    HB3  SER  21           HB1      SER  21  95.053   0.604   5.730
  144    HG   SER  21           HG       SER  21  95.162   2.219   7.675
  145    H    VAL  22           HN       VAL  22  93.152   3.163   7.470
  146    HA   VAL  22           HA       VAL  22  92.082   3.521   4.722
  147    HB   VAL  22           HB       VAL  22  90.674   4.268   7.284
  148   HG11  VAL  22          HG11      VAL  22  89.089   5.542   5.785
  149   HG12  VAL  22          HG12      VAL  22  90.307   5.449   4.511
  150   HG13  VAL  22          HG13      VAL  22  90.651   6.325   6.007
  151   HG21  VAL  22          HG21      VAL  22  89.813   2.957   4.689
  152   HG22  VAL  22          HG22      VAL  22  88.786   3.204   6.106
  153   HG23  VAL  22          HG23      VAL  22  90.166   2.106   6.198
  154    H    HIS  23           HN       HIS  23  93.580   4.789   3.874
  155    HA   HIS  23           HA       HIS  23  94.914   6.902   5.413
  156    HB2  HIS  23           HB2      HIS  23  95.047   5.823   2.613
  157    HB3  HIS  23           HB1      HIS  23  95.806   7.370   2.984
  158    HD1  HIS  23           HD1      HIS  23  98.124   6.100   2.479
  159    HD2  HIS  23           HD2      HIS  23  96.061   4.789   5.856
  160    HE1  HIS  23           HE1      HIS  23  99.775   4.754   3.849
  161    H    VAL  24           HN       VAL  24  93.493   8.598   5.892
  162    HA   VAL  24           HA       VAL  24  91.456   9.379   3.963
  163    HB   VAL  24           HB       VAL  24  92.390  11.197   6.186
  164   HG11  VAL  24          HG11      VAL  24  89.920  11.555   6.364
  165   HG12  VAL  24          HG12      VAL  24  89.694  10.438   5.026
  166   HG13  VAL  24          HG13      VAL  24  90.549  11.952   4.764
  167   HG21  VAL  24          HG21      VAL  24  90.844   8.605   6.483
  168   HG22  VAL  24          HG22      VAL  24  90.894   9.862   7.719
  169   HG23  VAL  24          HG23      VAL  24  92.374   9.023   7.254
  170    H    THR  25           HN       THR  25  92.131  10.252   2.059
  171    HA   THR  25           HA       THR  25  94.618  11.797   1.928
  172    HB   THR  25           HB       THR  25  94.494  11.483  -0.343
  173    HG1  THR  25           HG1      THR  25  92.883  12.933  -0.728
  174   HG21  THR  25          HG21      THR  25  92.179   9.656   0.330
  175   HG22  THR  25          HG22      THR  25  93.852   9.270   0.729
  176   HG23  THR  25          HG23      THR  25  93.367   9.457  -0.956
  177    H    ASP  26           HN       ASP  26  91.232  12.451   2.295
  178    HA   ASP  26           HA       ASP  26  91.422  15.249   1.463
  179    HB2  ASP  26           HB2      ASP  26  89.288  13.906   1.380
  180    HB3  ASP  26           HB1      ASP  26  89.276  13.916   3.144
  181    H    LEU  27           HN       LEU  27  92.424  13.482   4.120
  182    HA   LEU  27           HA       LEU  27  92.614  15.949   5.813
  183    HB2  LEU  27           HB2      LEU  27  91.369  13.362   6.400
  184    HB3  LEU  27           HB1      LEU  27  92.592  13.748   7.588
  185    HG   LEU  27           HG       LEU  27  90.392  15.672   6.773
  186   HD11  LEU  27          HD11      LEU  27  90.515  13.756   9.122
  187   HD12  LEU  27          HD12      LEU  27  89.421  13.629   7.744
  188   HD13  LEU  27          HD13      LEU  27  89.270  14.981   8.868
  189   HD21  LEU  27          HD21      LEU  27  92.093  16.926   7.829
  190   HD22  LEU  27          HD22      LEU  27  92.516  15.615   8.926
  191   HD23  LEU  27          HD23      LEU  27  91.027  16.524   9.172
  192    H    ASN  28           HN       ASN  28  94.058  13.124   4.470
  193    HA   ASN  28           HA       ASN  28  96.320  12.566   4.244
  194    HB2  ASN  28           HB2      ASN  28  96.655  15.131   4.543
  195    HB3  ASN  28           HB1      ASN  28  97.111  14.733   6.193
  196   HD21  ASN  28          HD21      ASN  28  98.105  12.039   5.090
  197   HD22  ASN  28          HD22      ASN  28  99.639  12.402   4.471
  198    H    ARG  29           HN       ARG  29  94.404  12.037   6.727
  199    HA   ARG  29           HA       ARG  29  96.479  11.128   8.635
  200    HB2  ARG  29           HB2      ARG  29  93.466  11.108   8.834
  201    HB3  ARG  29           HB1      ARG  29  94.589  10.655  10.117
  202    HG2  ARG  29           HG2      ARG  29  95.508  12.892  10.182
  203    HG3  ARG  29           HG1      ARG  29  94.545  13.370   8.791
  204    HD2  ARG  29           HD2      ARG  29  93.292  14.188  10.607
  205    HD3  ARG  29           HD1      ARG  29  92.502  12.659  10.229
  206    HE   ARG  29           HE       ARG  29  94.184  13.213  12.603
  207   HH11  ARG  29          HH11      ARG  29  94.061  11.647  14.215
  208   HH12  ARG  29          HH12      ARG  29  93.273  10.140  13.890
  209   HH21  ARG  29          HH21      ARG  29  92.470  10.949  10.620
  210   HH22  ARG  29          HH22      ARG  29  92.376   9.748  11.861
  211    H    ASP  30           HN       ASP  30  95.610   8.989   9.704
  212    HA   ASP  30           HA       ASP  30  94.781   7.022   7.650
  213    HB2  ASP  30           HB2      ASP  30  97.215   6.835   9.437
  214    HB3  ASP  30           HB1      ASP  30  96.476   5.426   8.674
  215    H    VAL  31           HN       VAL  31  93.006   6.132   8.414
  216    HA   VAL  31           HA       VAL  31  92.733   5.766  11.385
  217    HB   VAL  31           HB       VAL  31  90.532   6.027   9.327
  218   HG11  VAL  31          HG11      VAL  31  90.622   5.948  12.351
  219   HG12  VAL  31          HG12      VAL  31  89.796   4.827  11.271
  220   HG13  VAL  31          HG13      VAL  31  89.206   6.480  11.445
  221   HG21  VAL  31          HG21      VAL  31  91.856   8.127   9.530
  222   HG22  VAL  31          HG22      VAL  31  91.621   8.093  11.277
  223   HG23  VAL  31          HG23      VAL  31  90.239   8.316  10.206
  224    H    THR  32           HN       THR  32  91.584   3.879  12.059
  225    HA   THR  32           HA       THR  32  91.511   1.640  10.076
  226    HB   THR  32           HB       THR  32  92.245   0.571  12.635
  227    HG1  THR  32           HG1      THR  32  94.259   1.738  12.864
  228   HG21  THR  32          HG21      THR  32  94.110  -0.329  11.503
  229   HG22  THR  32          HG22      THR  32  94.192   1.028  10.379
  230   HG23  THR  32          HG23      THR  32  92.895  -0.159  10.236
  231    H    LEU  33           HN       LEU  33  89.648   0.535  10.199
  232    HA   LEU  33           HA       LEU  33  87.794   1.004  12.506
  233    HB2  LEU  33           HB2      LEU  33  87.435   0.726   9.535
  234    HB3  LEU  33           HB1      LEU  33  86.127   0.221  10.582
  235    HG   LEU  33           HG       LEU  33  86.062   2.632   9.701
  236   HD11  LEU  33          HD11      LEU  33  84.962   3.407  11.620
  237   HD12  LEU  33          HD12      LEU  33  86.026   2.523  12.713
  238   HD13  LEU  33          HD13      LEU  33  84.826   1.656  11.754
  239   HD21  LEU  33          HD21      LEU  33  87.451   4.268  10.710
  240   HD22  LEU  33          HD22      LEU  33  88.548   2.973  10.236
  241   HD23  LEU  33          HD23      LEU  33  88.050   3.145  11.916
  242    H    ARG  34           HN       ARG  34  87.652  -0.846  13.741
  243    HA   ARG  34           HA       ARG  34  88.590  -3.365  12.908
  244    HB2  ARG  34           HB2      ARG  34  88.248  -2.715  15.297
  245    HB3  ARG  34           HB1      ARG  34  86.513  -2.889  15.033
  246    HG2  ARG  34           HG2      ARG  34  88.453  -5.113  14.314
  247    HG3  ARG  34           HG1      ARG  34  87.816  -4.951  15.913
  248    HD2  ARG  34           HD2      ARG  34  85.538  -4.774  14.301
  249    HD3  ARG  34           HD1      ARG  34  86.519  -6.029  13.576
  250    HE   ARG  34           HE       ARG  34  86.157  -7.361  15.493
  251   HH11  ARG  34          HH11      ARG  34  85.162  -7.766  17.479
  252   HH12  ARG  34          HH12      ARG  34  84.432  -6.458  18.348
  253   HH21  ARG  34          HH21      ARG  34  85.249  -4.072  15.967
  254   HH22  ARG  34          HH22      ARG  34  84.483  -4.365  17.493
  255    H    VAL  35           HN       VAL  35  87.584  -4.987  11.946
  256    HA   VAL  35           HA       VAL  35  84.706  -4.927  11.385
  257    HB   VAL  35           HB       VAL  35  85.203  -4.990   8.889
  258   HG11  VAL  35          HG11      VAL  35  84.948  -2.661   8.649
  259   HG12  VAL  35          HG12      VAL  35  85.946  -2.318  10.060
  260   HG13  VAL  35          HG13      VAL  35  84.318  -2.965  10.265
  261   HG21  VAL  35          HG21      VAL  35  87.590  -5.365   8.982
  262   HG22  VAL  35          HG22      VAL  35  87.826  -3.847   9.841
  263   HG23  VAL  35          HG23      VAL  35  87.270  -3.836   8.171
  264    H    THR  36           HN       THR  36  84.413  -6.683   9.484
  265    HA   THR  36           HA       THR  36  86.271  -8.963   9.924
  266    HB   THR  36           HB       THR  36  84.209 -10.444  10.103
  267    HG1  THR  36           HG1      THR  36  82.533  -8.900  11.218
  268   HG21  THR  36          HG21      THR  36  85.500 -10.159  12.058
  269   HG22  THR  36          HG22      THR  36  83.842  -9.815  12.547
  270   HG23  THR  36          HG23      THR  36  84.970  -8.491  12.262
  271    H    GLY  37           HN       GLY  37  85.548 -10.737   8.259
  272    HA2  GLY  37           HA2      GLY  37  85.316  -9.360   5.699
  273    HA3  GLY  37           HA1      GLY  37  85.557 -11.088   5.913
  274    H    GLU  38           HN       GLU  38  83.069  -8.841   7.060
  275    HA   GLU  38           HA       GLU  38  81.024 -10.123   5.389
  276    HB2  GLU  38           HB2      GLU  38  79.582 -10.569   7.420
  277    HB3  GLU  38           HB1      GLU  38  80.976 -11.635   7.255
  278    HG2  GLU  38           HG2      GLU  38  82.185 -10.521   8.946
  279    HG3  GLU  38           HG1      GLU  38  81.140  -9.102   8.883
  280    H    VAL  39           HN       VAL  39  82.351  -7.389   6.730
  281    HA   VAL  39           HA       VAL  39  79.798  -6.003   7.224
  282    HB   VAL  39           HB       VAL  39  81.421  -5.127   8.630
  283   HG11  VAL  39          HG11      VAL  39  83.442  -6.070   8.107
  284   HG12  VAL  39          HG12      VAL  39  83.734  -4.459   7.439
  285   HG13  VAL  39          HG13      VAL  39  83.265  -5.780   6.376
  286   HG21  VAL  39          HG21      VAL  39  81.832  -2.883   7.971
  287   HG22  VAL  39          HG22      VAL  39  80.366  -3.343   7.104
  288   HG23  VAL  39          HG23      VAL  39  81.918  -3.317   6.264
  289    H    HIS  40           HN       HIS  40  79.059  -4.286   5.883
  290    HA   HIS  40           HA       HIS  40  79.752  -4.681   3.033
  291    HB2  HIS  40           HB2      HIS  40  77.766  -2.581   3.780
  292    HB3  HIS  40           HB1      HIS  40  77.673  -3.841   2.549
  293    HD1  HIS  40           HD1      HIS  40  76.195  -5.771   3.089
  294    HD2  HIS  40           HD2      HIS  40  77.407  -3.753   6.530
  295    HE1  HIS  40           HE1      HIS  40  74.986  -6.867   5.025
  296    H    ILE  41           HN       ILE  41  80.707  -3.103   1.740
  297    HA   ILE  41           HA       ILE  41  82.657  -1.385   2.753
  298    HB   ILE  41           HB       ILE  41  80.990  -0.702   0.317
  299   HG12  ILE  41          HG12      ILE  41  83.340  -2.609   0.513
  300   HG13  ILE  41          HG11      ILE  41  81.660  -3.078   0.280
  301   HG21  ILE  41          HG21      ILE  41  82.754   0.914   1.220
  302   HG22  ILE  41          HG22      ILE  41  82.953   0.405  -0.455
  303   HG23  ILE  41          HG23      ILE  41  83.950  -0.316   0.806
  304   HD11  ILE  41          HD11      ILE  41  82.411  -1.068  -1.681
  305   HD12  ILE  41          HD12      ILE  41  81.778  -2.692  -1.926
  306   HD13  ILE  41          HD13      ILE  41  83.511  -2.446  -1.733
  307    H    GLY  42           HN       GLY  42  79.454  -0.399   1.631
  308    HA2  GLY  42           HA2      GLY  42  79.550   2.258   2.459
  309    HA3  GLY  42           HA1      GLY  42  78.060   1.325   2.326
  310    H    GLY  43           HN       GLY  43  79.534  -0.573   4.275
  311    HA2  GLY  43           HA2      GLY  43  78.274   0.499   6.679
  312    HA3  GLY  43           HA1      GLY  43  79.169  -1.017   6.556
  313    H    VAL  44           HN       VAL  44  81.463   0.449   5.288
  314    HA   VAL  44           HA       VAL  44  82.845   1.120   7.785
  315    HB   VAL  44           HB       VAL  44  83.592   0.859   4.870
  316   HG11  VAL  44          HG11      VAL  44  84.854   2.816   5.429
  317   HG12  VAL  44          HG12      VAL  44  85.973   1.466   5.619
  318   HG13  VAL  44          HG13      VAL  44  85.230   2.202   7.039
  319   HG21  VAL  44          HG21      VAL  44  84.695  -0.348   7.426
  320   HG22  VAL  44          HG22      VAL  44  85.178  -0.781   5.786
  321   HG23  VAL  44          HG23      VAL  44  83.541  -1.127   6.344
  322    H    MET  45           HN       MET  45  82.176   3.002   4.739
  323    HA   MET  45           HA       MET  45  83.143   5.446   5.760
  324    HB2  MET  45           HB2      MET  45  81.266   6.516   4.245
  325    HB3  MET  45           HB1      MET  45  82.621   5.681   3.509
  326    HG2  MET  45           HG2      MET  45  80.930   4.665   2.343
  327    HG3  MET  45           HG1      MET  45  80.919   3.588   3.725
  328    HE1  MET  45           HE1      MET  45  77.503   5.223   1.945
  329    HE2  MET  45           HE2      MET  45  77.686   3.576   2.516
  330    HE3  MET  45           HE3      MET  45  78.936   4.283   1.503
  331    H    LEU  46           HN       LEU  46  80.342   3.663   6.651
  332    HA   LEU  46           HA       LEU  46  78.893   5.864   7.894
  333    HB2  LEU  46           HB2      LEU  46  78.056   3.460   7.224
  334    HB3  LEU  46           HB1      LEU  46  78.697   2.984   8.795
  335    HG   LEU  46           HG       LEU  46  76.669   5.190   8.325
  336   HD11  LEU  46          HD11      LEU  46  75.481   3.183   7.997
  337   HD12  LEU  46          HD12      LEU  46  75.236   3.514   9.708
  338   HD13  LEU  46          HD13      LEU  46  76.424   2.312   9.204
  339   HD21  LEU  46          HD21      LEU  46  76.484   4.858  10.913
  340   HD22  LEU  46          HD22      LEU  46  77.812   5.808  10.261
  341   HD23  LEU  46          HD23      LEU  46  78.092   4.143  10.767
  342    H    LYS  47           HN       LYS  47  80.802   3.163   9.270
  343    HA   LYS  47           HA       LYS  47  80.937   4.213  11.919
  344    HB2  LYS  47           HB2      LYS  47  83.058   2.522  10.574
  345    HB3  LYS  47           HB1      LYS  47  82.694   2.594  12.295
  346    HG2  LYS  47           HG2      LYS  47  80.649   1.412  12.022
  347    HG3  LYS  47           HG1      LYS  47  80.637   1.677  10.283
  348    HD2  LYS  47           HD2      LYS  47  82.771   0.288  10.160
  349    HD3  LYS  47           HD1      LYS  47  82.493  -0.133  11.848
  350    HE2  LYS  47           HE2      LYS  47  80.369  -0.560   9.741
  351    HE3  LYS  47           HE1      LYS  47  81.611  -1.774  10.062
  352    HZ1  LYS  47           HZ1      LYS  47  80.861  -1.350  12.518
  353    HZ2  LYS  47           HZ2      LYS  47  80.000  -2.419  11.518
  354    HZ3  LYS  47           HZ3      LYS  47  79.421  -0.843  11.779
  355    H    LEU  48           HN       LEU  48  83.378   4.338   9.312
  356    HA   LEU  48           HA       LEU  48  85.412   5.695  10.558
  357    HB2  LEU  48           HB2      LEU  48  85.519   4.931   8.240
  358    HB3  LEU  48           HB1      LEU  48  84.344   6.148   7.760
  359    HG   LEU  48           HG       LEU  48  85.979   7.926   8.456
  360   HD11  LEU  48          HD11      LEU  48  87.364   6.725  10.047
  361   HD12  LEU  48          HD12      LEU  48  88.371   7.164   8.671
  362   HD13  LEU  48          HD13      LEU  48  87.774   5.516   8.829
  363   HD21  LEU  48          HD21      LEU  48  85.838   7.256   6.130
  364   HD22  LEU  48          HD22      LEU  48  86.866   5.857   6.437
  365   HD23  LEU  48          HD23      LEU  48  87.540   7.483   6.544
  366    H    VAL  49           HN       VAL  49  82.679   7.369   8.915
  367    HA   VAL  49           HA       VAL  49  83.480   9.978   9.814
  368    HB   VAL  49           HB       VAL  49  80.765   8.935   8.974
  369   HG11  VAL  49          HG11      VAL  49  80.361  10.931  10.218
  370   HG12  VAL  49          HG12      VAL  49  80.369  11.425   8.525
  371   HG13  VAL  49          HG13      VAL  49  81.781  11.726   9.538
  372   HG21  VAL  49          HG21      VAL  49  81.303   9.801   6.808
  373   HG22  VAL  49          HG22      VAL  49  82.724   8.890   7.324
  374   HG23  VAL  49          HG23      VAL  49  82.719  10.652   7.426
  375    H    GLU  50           HN       GLU  50  81.129   7.631  11.135
  376    HA   GLU  50           HA       GLU  50  79.972   9.092  13.186
  377    HB2  GLU  50           HB2      GLU  50  80.936   6.231  13.130
  378    HB3  GLU  50           HB1      GLU  50  80.116   6.886  14.541
  379    HG2  GLU  50           HG2      GLU  50  78.978   7.055  11.751
  380    HG3  GLU  50           HG1      GLU  50  78.616   5.725  12.850
  381    H    LYS  51           HN       LYS  51  83.225   7.708  13.154
  382    HA   LYS  51           HA       LYS  51  83.824   8.339  15.883
  383    HB2  LYS  51           HB2      LYS  51  85.676   7.979  13.527
  384    HB3  LYS  51           HB1      LYS  51  86.153   7.963  15.227
  385    HG2  LYS  51           HG2      LYS  51  84.451   6.109  15.572
  386    HG3  LYS  51           HG1      LYS  51  84.313   6.021  13.818
  387    HD2  LYS  51           HD2      LYS  51  86.746   5.477  15.530
  388    HD3  LYS  51           HD1      LYS  51  85.912   4.377  14.443
  389    HE2  LYS  51           HE2      LYS  51  87.841   5.036  13.238
  390    HE3  LYS  51           HE1      LYS  51  86.549   6.025  12.566
  391    HZ1  LYS  51           HZ1      LYS  51  87.776   7.216  14.858
  392    HZ2  LYS  51           HZ2      LYS  51  87.501   7.871  13.315
  393    HZ3  LYS  51           HZ3      LYS  51  88.890   6.938  13.610
  394    H    LEU  52           HN       LEU  52  84.611  10.087  12.832
  395    HA   LEU  52           HA       LEU  52  85.885  12.249  14.190
  396    HB2  LEU  52           HB2      LEU  52  85.482  11.473  11.535
  397    HB3  LEU  52           HB1      LEU  52  84.554  12.960  11.653
  398    HG   LEU  52           HG       LEU  52  86.683  13.929  12.809
  399   HD11  LEU  52          HD11      LEU  52  87.878  11.824  13.116
  400   HD12  LEU  52          HD12      LEU  52  88.781  12.841  11.994
  401   HD13  LEU  52          HD13      LEU  52  87.808  11.502  11.385
  402   HD21  LEU  52          HD21      LEU  52  87.740  14.315  10.518
  403   HD22  LEU  52          HD22      LEU  52  86.042  14.754  10.669
  404   HD23  LEU  52          HD23      LEU  52  86.494  13.246   9.873
  405    H    ASP  53           HN       ASP  53  82.751  12.342  12.526
  406    HA   ASP  53           HA       ASP  53  80.686  13.156  13.223
  407    HB2  ASP  53           HB2      ASP  53  81.707  12.434  15.524
  408    HB3  ASP  53           HB1      ASP  53  81.849  14.159  15.785
  409    H    VAL  54           HN       VAL  54  80.910  14.701  11.630
  410    HA   VAL  54           HA       VAL  54  80.857  17.416  12.567
  411    HB   VAL  54           HB       VAL  54  83.213  17.251  12.687
  412   HG11  VAL  54          HG11      VAL  54  83.683  15.237  11.578
  413   HG12  VAL  54          HG12      VAL  54  84.487  16.470  10.598
  414   HG13  VAL  54          HG13      VAL  54  82.949  15.790  10.068
  415   HG21  VAL  54          HG21      VAL  54  83.961  18.853  11.024
  416   HG22  VAL  54          HG22      VAL  54  82.302  19.260  11.460
  417   HG23  VAL  54          HG23      VAL  54  82.636  18.423   9.947
  418    H    LYS  55           HN       LYS  55  79.818  18.706  11.106
  419    HA   LYS  55           HA       LYS  55  78.468  17.430   8.927
  420    HB2  LYS  55           HB2      LYS  55  78.757  20.335   9.702
  421    HB3  LYS  55           HB1      LYS  55  77.758  19.791   8.354
  422    HG2  LYS  55           HG2      LYS  55  76.731  18.157  10.203
  423    HG3  LYS  55           HG1      LYS  55  77.348  19.381  11.307
  424    HD2  LYS  55           HD2      LYS  55  76.101  21.119  10.053
  425    HD3  LYS  55           HD1      LYS  55  75.461  19.864   8.990
  426    HE2  LYS  55           HE2      LYS  55  73.755  20.137  10.594
  427    HE3  LYS  55           HE1      LYS  55  74.642  18.728  11.177
  428    HZ1  LYS  55           HZ1      LYS  55  75.025  21.526  12.098
  429    HZ2  LYS  55           HZ2      LYS  55  75.900  20.178  12.649
  430    HZ3  LYS  55           HZ3      LYS  55  74.234  20.299  12.959
  431    H    LYS  56           HN       LYS  56  81.365  17.212   8.619
  432    HA   LYS  56           HA       LYS  56  82.021  19.100   6.473
  433    HB2  LYS  56           HB2      LYS  56  83.772  18.094   7.961
  434    HB3  LYS  56           HB1      LYS  56  83.483  16.544   7.184
  435    HG2  LYS  56           HG2      LYS  56  83.950  17.752   4.965
  436    HG3  LYS  56           HG1      LYS  56  84.549  19.090   5.942
  437    HD2  LYS  56           HD2      LYS  56  85.596  16.247   5.951
  438    HD3  LYS  56           HD1      LYS  56  86.414  17.659   5.292
  439    HE2  LYS  56           HE2      LYS  56  85.836  17.021   8.185
  440    HE3  LYS  56           HE1      LYS  56  87.391  17.361   7.429
  441    HZ1  LYS  56           HZ1      LYS  56  85.236  19.219   8.159
  442    HZ2  LYS  56           HZ2      LYS  56  86.270  19.613   6.870
  443    HZ3  LYS  56           HZ3      LYS  56  86.906  19.352   8.424
  444    H    ASP  57           HN       ASP  57  82.071  18.651   4.285
  445    HA   ASP  57           HA       ASP  57  80.039  17.029   3.205
  446    HB2  ASP  57           HB2      ASP  57  82.565  17.648   1.673
  447    HB3  ASP  57           HB1      ASP  57  80.903  17.592   1.087
  448    H    TRP  58           HN       TRP  58  80.078  14.877   3.949
  449    HA   TRP  58           HA       TRP  58  82.500  13.253   3.310
  450    HB2  TRP  58           HB2      TRP  58  80.154  12.764   5.151
  451    HB3  TRP  58           HB1      TRP  58  81.387  11.568   4.801
  452    HD1  TRP  58           HD1      TRP  58  80.559  13.889   7.342
  453    HE1  TRP  58           HE1      TRP  58  82.604  14.695   8.677
  454    HE3  TRP  58           HE3      TRP  58  84.344  12.397   4.212
  455    HZ2  TRP  58           HZ2      TRP  58  85.437  14.733   8.445
  456    HZ3  TRP  58           HZ3      TRP  58  86.697  12.846   4.809
  457    HH2  TRP  58           HH2      TRP  58  87.253  14.005   6.927
  458    H    SER  59           HN       SER  59  79.095  13.626   2.726
  459    HA   SER  59           HA       SER  59  78.293  11.223   1.651
  460    HB2  SER  59           HB2      SER  59  76.574  12.406   0.640
  461    HB3  SER  59           HB1      SER  59  77.182  13.663   1.712
  462    HG   SER  59           HG       SER  59  78.415  14.455  -0.007
  463    H    ASP  60           HN       ASP  60  80.239  13.691  -0.005
  464    HA   ASP  60           HA       ASP  60  80.422  12.169  -2.472
  465    HB2  ASP  60           HB2      ASP  60  80.664  14.570  -2.568
  466    HB3  ASP  60           HB1      ASP  60  81.969  14.536  -1.383
  467    H    HIS  61           HN       HIS  61  82.010  12.013   0.565
  468    HA   HIS  61           HA       HIS  61  84.483  10.838  -0.485
  469    HB2  HIS  61           HB2      HIS  61  83.457  11.136   2.345
  470    HB3  HIS  61           HB1      HIS  61  85.069  10.590   1.894
  471    HD1  HIS  61           HD1      HIS  61  83.072  13.464   0.405
  472    HD2  HIS  61           HD2      HIS  61  86.635  12.806   2.465
  473    HE1  HIS  61           HE1      HIS  61  84.287  15.686   0.464
  474    H    ALA  62           HN       ALA  62  84.823   8.785  -0.858
  475    HA   ALA  62           HA       ALA  62  83.174   6.700   0.491
  476    HB1  ALA  62           HB1      ALA  62  82.652   5.615  -1.566
  477    HB2  ALA  62           HB2      ALA  62  83.797   6.608  -2.470
  478    HB3  ALA  62           HB3      ALA  62  82.305   7.320  -1.857
  479    H    LEU  63           HN       LEU  63  84.297   4.438  -0.190
  480    HA   LEU  63           HA       LEU  63  87.193   4.869   0.345
  481    HB2  LEU  63           HB2      LEU  63  85.541   2.324   0.374
  482    HB3  LEU  63           HB1      LEU  63  87.236   2.432   0.813
  483    HG   LEU  63           HG       LEU  63  85.797   2.406   2.788
  484   HD11  LEU  63          HD11      LEU  63  86.895   4.099   3.971
  485   HD12  LEU  63          HD12      LEU  63  86.872   5.208   2.603
  486   HD13  LEU  63          HD13      LEU  63  87.960   3.819   2.595
  487   HD21  LEU  63          HD21      LEU  63  84.716   5.132   2.139
  488   HD22  LEU  63          HD22      LEU  63  84.065   3.887   3.202
  489   HD23  LEU  63          HD23      LEU  63  83.919   3.710   1.457
  490    H    TRP  64           HN       TRP  64  88.823   4.082  -0.964
  491    HA   TRP  64           HA       TRP  64  88.050   2.911  -3.620
  492    HB2  TRP  64           HB2      TRP  64  88.832   4.788  -4.646
  493    HB3  TRP  64           HB1      TRP  64  89.143   5.507  -3.087
  494    HD1  TRP  64           HD1      TRP  64  91.681   4.176  -2.059
  495    HE1  TRP  64           HE1      TRP  64  93.913   4.315  -3.326
  496    HE3  TRP  64           HE3      TRP  64  89.969   5.308  -6.734
  497    HZ2  TRP  64           HZ2      TRP  64  94.859   4.879  -5.963
  498    HZ3  TRP  64           HZ3      TRP  64  91.561   5.664  -8.600
  499    HH2  TRP  64           HH2      TRP  64  94.002   5.452  -8.221
  500    H    TRP  65           HN       TRP  65  89.649   1.442  -4.487
  501    HA   TRP  65           HA       TRP  65  91.530   0.401  -2.395
  502    HB2  TRP  65           HB2      TRP  65  89.604  -1.065  -3.286
  503    HB3  TRP  65           HB1      TRP  65  90.519  -1.143  -4.788
  504    HD1  TRP  65           HD1      TRP  65  93.229  -1.010  -2.525
  505    HE1  TRP  65           HE1      TRP  65  94.027  -3.326  -1.756
  506    HE3  TRP  65           HE3      TRP  65  89.182  -3.826  -3.865
  507    HZ2  TRP  65           HZ2      TRP  65  93.085  -6.025  -1.717
  508    HZ3  TRP  65           HZ3      TRP  65  89.166  -6.266  -3.449
  509    HH2  TRP  65           HH2      TRP  65  91.108  -7.370  -2.379
  510    H    GLU  66           HN       GLU  66  93.376   1.644  -2.978
  511    HA   GLU  66           HA       GLU  66  94.237   2.216  -5.602
  512    HB2  GLU  66           HB2      GLU  66  96.544   2.368  -4.582
  513    HB3  GLU  66           HB1      GLU  66  95.301   3.323  -3.785
  514    HG2  GLU  66           HG2      GLU  66  94.986   1.510  -2.128
  515    HG3  GLU  66           HG1      GLU  66  96.266   0.597  -2.916
  516    H    LYS  67           HN       LYS  67  94.423  -0.818  -3.863
  517    HA   LYS  67           HA       LYS  67  96.540  -1.935  -5.497
  518    HB2  LYS  67           HB2      LYS  67  94.261  -3.479  -4.231
  519    HB3  LYS  67           HB1      LYS  67  95.847  -4.098  -4.672
  520    HG2  LYS  67           HG2      LYS  67  95.287  -2.042  -2.519
  521    HG3  LYS  67           HG1      LYS  67  95.702  -3.731  -2.249
  522    HD2  LYS  67           HD2      LYS  67  97.827  -3.220  -3.637
  523    HD3  LYS  67           HD1      LYS  67  97.428  -1.525  -3.358
  524    HE2  LYS  67           HE2      LYS  67  98.784  -1.938  -1.511
  525    HE3  LYS  67           HE1      LYS  67  97.203  -2.336  -0.831
  526    HZ1  LYS  67           HZ1      LYS  67  98.437  -4.529  -2.218
  527    HZ2  LYS  67           HZ2      LYS  67  97.743  -4.475  -0.668
  528    HZ3  LYS  67           HZ3      LYS  67  99.354  -3.985  -0.899
  529    H    LYS  68           HN       LYS  68  93.441  -0.901  -6.035
  530    HA   LYS  68           HA       LYS  68  93.216  -2.368  -8.621
  531    HB2  LYS  68           HB2      LYS  68  90.753  -1.585  -7.076
  532    HB3  LYS  68           HB1      LYS  68  90.960  -2.870  -8.261
  533    HG2  LYS  68           HG2      LYS  68  92.313  -2.971  -5.544
  534    HG3  LYS  68           HG1      LYS  68  90.695  -3.583  -5.813
  535    HD2  LYS  68           HD2      LYS  68  91.431  -5.218  -7.360
  536    HD3  LYS  68           HD1      LYS  68  93.001  -4.438  -7.552
  537    HE2  LYS  68           HE2      LYS  68  93.821  -5.300  -5.568
  538    HE3  LYS  68           HE1      LYS  68  92.238  -5.359  -4.798
  539    HZ1  LYS  68           HZ1      LYS  68  92.720  -7.082  -7.117
  540    HZ2  LYS  68           HZ2      LYS  68  91.743  -7.346  -5.752
  541    HZ3  LYS  68           HZ3      LYS  68  93.429  -7.520  -5.640
  542    H    ARG  69           HN       ARG  69  93.246   0.583  -6.902
  543    HA   ARG  69           HA       ARG  69  92.755   2.785  -7.541
  544    HB2  ARG  69           HB2      ARG  69  93.384   1.472 -10.202
  545    HB3  ARG  69           HB1      ARG  69  92.951   3.173 -10.100
  546    HG2  ARG  69           HG2      ARG  69  95.281   3.285  -9.980
  547    HG3  ARG  69           HG1      ARG  69  94.854   3.273  -8.274
  548    HD2  ARG  69           HD2      ARG  69  96.526   1.638  -8.377
  549    HD3  ARG  69           HD1      ARG  69  95.060   0.673  -8.510
  550    HE   ARG  69           HE       ARG  69  95.991   1.461 -11.121
  551   HH11  ARG  69          HH11      ARG  69  96.948  -0.147 -12.391
  552   HH12  ARG  69          HH12      ARG  69  97.511  -1.603 -11.640
  553   HH21  ARG  69          HH21      ARG  69  96.558  -0.640  -8.448
  554   HH22  ARG  69          HH22      ARG  69  97.291  -1.882  -9.408
  555    H    THR  70           HN       THR  70  90.587   1.265  -6.920
  556    HA   THR  70           HA       THR  70  88.545   1.910  -9.032
  557    HB   THR  70           HB       THR  70  88.982  -0.511  -8.255
  558    HG1  THR  70           HG1      THR  70  86.832  -0.950  -8.502
  559   HG21  THR  70          HG21      THR  70  87.216   0.202  -5.940
  560   HG22  THR  70          HG22      THR  70  88.970   0.294  -5.781
  561   HG23  THR  70          HG23      THR  70  88.201  -1.242  -6.180
  562    H    TRP  71           HN       TRP  71  86.292   1.820  -7.612
  563    HA   TRP  71           HA       TRP  71  86.606   3.673  -5.304
  564    HB2  TRP  71           HB2      TRP  71  84.403   4.714  -6.155
  565    HB3  TRP  71           HB1      TRP  71  85.893   5.204  -6.933
  566    HD1  TRP  71           HD1      TRP  71  84.654   1.773  -7.929
  567    HE1  TRP  71           HE1      TRP  71  83.666   1.879 -10.260
  568    HE3  TRP  71           HE3      TRP  71  84.565   6.833  -8.631
  569    HZ2  TRP  71           HZ2      TRP  71  82.938   3.822 -12.232
  570    HZ3  TRP  71           HZ3      TRP  71  83.721   7.781 -10.759
  571    HH2  TRP  71           HH2      TRP  71  82.907   6.282 -12.561
  572    H    LEU  72           HN       LEU  72  86.210   2.108  -3.827
  573    HA   LEU  72           HA       LEU  72  84.400  -0.029  -4.166
  574    HB2  LEU  72           HB2      LEU  72  85.187   1.243  -1.553
  575    HB3  LEU  72           HB1      LEU  72  84.651  -0.413  -1.795
  576    HG   LEU  72           HG       LEU  72  87.067   0.624  -3.264
  577   HD11  LEU  72          HD11      LEU  72  88.385  -0.471  -1.342
  578   HD12  LEU  72          HD12      LEU  72  86.907  -0.276  -0.399
  579   HD13  LEU  72          HD13      LEU  72  87.719   1.138  -1.069
  580   HD21  LEU  72          HD21      LEU  72  87.378  -1.540  -3.866
  581   HD22  LEU  72          HD22      LEU  72  85.702  -1.781  -3.383
  582   HD23  LEU  72          HD23      LEU  72  87.003  -2.154  -2.252
  583    H    LEU  73           HN       LEU  73  82.567   0.887  -5.065
  584    HA   LEU  73           HA       LEU  73  80.721   2.236  -3.126
  585    HB2  LEU  73           HB2      LEU  73  79.568   3.204  -5.134
  586    HB3  LEU  73           HB1      LEU  73  81.208   3.795  -4.905
  587    HG   LEU  73           HG       LEU  73  81.727   1.668  -6.552
  588   HD11  LEU  73          HD11      LEU  73  79.101   1.416  -6.662
  589   HD12  LEU  73          HD12      LEU  73  80.048   1.283  -8.145
  590   HD13  LEU  73          HD13      LEU  73  79.195   2.779  -7.769
  591   HD21  LEU  73          HD21      LEU  73  82.375   4.079  -6.870
  592   HD22  LEU  73          HD22      LEU  73  80.795   4.371  -7.576
  593   HD23  LEU  73          HD23      LEU  73  81.924   3.272  -8.364
  594    H    LYS  74           HN       LYS  74  81.414  -0.664  -4.230
  595    HA   LYS  74           HA       LYS  74  78.708  -1.501  -5.099
  596    HB2  LYS  74           HB2      LYS  74  81.411  -2.809  -4.970
  597    HB3  LYS  74           HB1      LYS  74  79.982  -3.826  -5.003
  598    HG2  LYS  74           HG2      LYS  74  80.823  -3.457  -7.281
  599    HG3  LYS  74           HG1      LYS  74  79.231  -2.739  -7.078
  600    HD2  LYS  74           HD2      LYS  74  80.738  -1.207  -8.278
  601    HD3  LYS  74           HD1      LYS  74  80.258  -0.540  -6.726
  602    HE2  LYS  74           HE2      LYS  74  82.781  -0.450  -7.429
  603    HE3  LYS  74           HE1      LYS  74  82.361  -0.871  -5.771
  604    HZ1  LYS  74           HZ1      LYS  74  83.925  -2.455  -6.525
  605    HZ2  LYS  74           HZ2      LYS  74  83.083  -2.713  -7.978
  606    HZ3  LYS  74           HZ3      LYS  74  82.423  -3.240  -6.505
  607    H    THR  75           HN       THR  75  78.008  -0.725  -2.798
  608    HA   THR  75           HA       THR  75  78.735  -2.195  -0.465
  609    HB   THR  75           HB       THR  75  75.952  -1.118  -0.956
  610    HG1  THR  75           HG1      THR  75  78.026   0.229  -1.511
  611   HG21  THR  75          HG21      THR  75  76.006  -0.638   1.394
  612   HG22  THR  75          HG22      THR  75  77.737  -0.959   1.482
  613   HG23  THR  75          HG23      THR  75  76.606  -2.281   1.200
  614    H    HIS  76           HN       HIS  76  77.278  -3.270  -3.259
  615    HA   HIS  76           HA       HIS  76  75.231  -5.009  -2.386
  616    HB2  HIS  76           HB2      HIS  76  77.135  -5.194  -4.722
  617    HB3  HIS  76           HB1      HIS  76  75.782  -6.301  -4.491
  618    HD1  HIS  76           HD1      HIS  76  76.580  -3.177  -6.072
  619    HD2  HIS  76           HD2      HIS  76  73.209  -4.694  -4.146
  620    HE1  HIS  76           HE1      HIS  76  74.629  -1.735  -6.801
  621    H    TRP  77           HN       TRP  77  78.592  -6.057  -3.176
  622    HA   TRP  77           HA       TRP  77  78.077  -8.540  -1.682
  623    HB2  TRP  77           HB2      TRP  77  80.519  -8.985  -2.475
  624    HB3  TRP  77           HB1      TRP  77  79.226  -9.009  -3.647
  625    HD1  TRP  77           HD1      TRP  77  79.272  -7.278  -5.535
  626    HE1  TRP  77           HE1      TRP  77  80.954  -5.476  -6.251
  627    HE3  TRP  77           HE3      TRP  77  82.292  -7.169  -1.429
  628    HZ2  TRP  77           HZ2      TRP  77  83.278  -4.152  -5.233
  629    HZ3  TRP  77           HZ3      TRP  77  84.227  -5.632  -1.321
  630    HH2  TRP  77           HH2      TRP  77  84.722  -4.119  -3.220
  631    H    THR  78           HN       THR  78  80.784  -9.007  -0.727
  632    HA   THR  78           HA       THR  78  81.114  -6.890   1.341
  633    HB   THR  78           HB       THR  78  81.401  -9.658   2.383
  634    HG1  THR  78           HG1      THR  78  78.922  -8.724   1.387
  635   HG21  THR  78          HG21      THR  78  81.349  -7.969   4.014
  636   HG22  THR  78          HG22      THR  78  79.736  -8.682   4.079
  637   HG23  THR  78          HG23      THR  78  79.974  -7.141   3.263
  638    H    LEU  79           HN       LEU  79  83.116  -7.197   2.551
  639    HA   LEU  79           HA       LEU  79  85.481  -7.122   1.186
  640    HB2  LEU  79           HB2      LEU  79  84.788  -8.158   3.911
  641    HB3  LEU  79           HB1      LEU  79  86.461  -8.232   3.374
  642    HG   LEU  79           HG       LEU  79  86.422  -5.784   3.004
  643   HD11  LEU  79          HD11      LEU  79  84.079  -5.419   2.516
  644   HD12  LEU  79          HD12      LEU  79  84.451  -4.546   4.004
  645   HD13  LEU  79          HD13      LEU  79  83.609  -6.091   4.076
  646   HD21  LEU  79          HD21      LEU  79  85.390  -6.533   5.759
  647   HD22  LEU  79          HD22      LEU  79  86.473  -5.198   5.355
  648   HD23  LEU  79          HD23      LEU  79  87.035  -6.866   5.215
  649    H    ASP  80           HN       ASP  80  84.498 -10.027   2.943
  650    HA   ASP  80           HA       ASP  80  86.298 -11.895   2.011
  651    HB2  ASP  80           HB2      ASP  80  84.485 -12.286   3.663
  652    HB3  ASP  80           HB1      ASP  80  83.325 -12.346   2.334
  653    H    LYS  81           HN       LYS  81  83.172 -11.164   0.532
  654    HA   LYS  81           HA       LYS  81  83.194 -12.851  -1.632
  655    HB2  LYS  81           HB2      LYS  81  82.458  -9.963  -1.975
  656    HB3  LYS  81           HB1      LYS  81  81.691 -11.375  -2.695
  657    HG2  LYS  81           HG2      LYS  81  81.569 -10.474   0.185
  658    HG3  LYS  81           HG1      LYS  81  80.231 -10.630  -0.945
  659    HD2  LYS  81           HD2      LYS  81  80.704 -13.097  -1.045
  660    HD3  LYS  81           HD1      LYS  81  81.845 -12.869   0.275
  661    HE2  LYS  81           HE2      LYS  81  80.155 -12.205   1.787
  662    HE3  LYS  81           HE1      LYS  81  78.994 -11.906   0.495
  663    HZ1  LYS  81           HZ1      LYS  81  79.937 -14.481   1.577
  664    HZ2  LYS  81           HZ2      LYS  81  79.301 -14.391   0.004
  665    HZ3  LYS  81           HZ3      LYS  81  78.347 -13.944   1.337
  666    H    TYR  82           HN       TYR  82  84.595  -9.575  -1.630
  667    HA   TYR  82           HA       TYR  82  85.886 -10.047  -4.201
  668    HB2  TYR  82           HB2      TYR  82  85.231  -7.773  -2.941
  669    HB3  TYR  82           HB1      TYR  82  86.885  -7.898  -2.352
  670    HD1  TYR  82           HD1      TYR  82  84.948  -6.526  -4.904
  671    HD2  TYR  82           HD2      TYR  82  88.608  -8.698  -4.324
  672    HE1  TYR  82           HE1      TYR  82  85.794  -5.684  -7.078
  673    HE2  TYR  82           HE2      TYR  82  89.452  -7.857  -6.496
  674    HH   TYR  82           HH       TYR  82  87.647  -6.675  -8.836
  675    H    GLY  83           HN       GLY  83  86.978 -10.005  -0.812
  676    HA2  GLY  83           HA2      GLY  83  88.624 -11.813  -0.203
  677    HA3  GLY  83           HA1      GLY  83  89.492 -11.419  -1.687
  678    H    ILE  84           HN       ILE  84  88.150  -8.696  -0.197
  679    HA   ILE  84           HA       ILE  84  90.670  -7.452   0.286
  680    HB   ILE  84           HB       ILE  84  87.908  -6.855   1.385
  681   HG12  ILE  84          HG12      ILE  84  89.360  -5.227  -0.700
  682   HG13  ILE  84          HG11      ILE  84  88.571  -6.728  -1.187
  683   HG21  ILE  84          HG21      ILE  84  90.508  -5.319   1.533
  684   HG22  ILE  84          HG22      ILE  84  89.463  -5.804   2.866
  685   HG23  ILE  84          HG23      ILE  84  88.941  -4.544   1.750
  686   HD11  ILE  84          HD11      ILE  84  86.439  -5.942  -0.587
  687   HD12  ILE  84          HD12      ILE  84  87.204  -4.519  -1.292
  688   HD13  ILE  84          HD13      ILE  84  87.094  -4.683   0.461
  689    H    GLN  85           HN       GLN  85  91.511  -6.807   2.459
  690    HA   GLN  85           HA       GLN  85  90.603  -8.301   4.789
  691    HB2  GLN  85           HB2      GLN  85  92.200  -9.785   3.177
  692    HB3  GLN  85           HB1      GLN  85  93.445  -8.941   4.088
  693    HG2  GLN  85           HG2      GLN  85  93.126 -10.766   5.492
  694    HG3  GLN  85           HG1      GLN  85  91.927  -9.667   6.173
  695   HE21  GLN  85          HE21      GLN  85  89.884  -9.834   4.286
  696   HE22  GLN  85          HE22      GLN  85  89.271 -11.409   4.244
  697    H    ALA  86           HN       ALA  86  92.798  -8.121   6.380
  698    HA   ALA  86           HA       ALA  86  92.958  -5.299   6.937
  699    HB1  ALA  86           HB1      ALA  86  93.690  -6.079   8.958
  700    HB2  ALA  86           HB2      ALA  86  95.029  -6.955   8.209
  701    HB3  ALA  86           HB3      ALA  86  93.435  -7.696   8.304
  702    H    ASP  87           HN       ASP  87  94.796  -7.447   4.959
  703    HA   ASP  87           HA       ASP  87  97.235  -5.834   4.993
  704    HB2  ASP  87           HB2      ASP  87  97.847  -7.327   3.045
  705    HB3  ASP  87           HB1      ASP  87  97.472  -8.187   4.541
  706    H    ALA  88           HN       ALA  88  94.205  -5.527   3.594
  707    HA   ALA  88           HA       ALA  88  95.170  -4.135   1.158
  708    HB1  ALA  88           HB1      ALA  88  92.776  -5.540   1.957
  709    HB2  ALA  88           HB2      ALA  88  93.194  -4.941   0.352
  710    HB3  ALA  88           HB3      ALA  88  92.328  -3.900   1.478
  711    H    LYS  89           HN       LYS  89  95.792  -2.018   1.498
  712    HA   LYS  89           HA       LYS  89  94.501  -0.484   3.693
  713    HB2  LYS  89           HB2      LYS  89  96.655   0.618   1.901
  714    HB3  LYS  89           HB1      LYS  89  96.277   1.036   3.570
  715    HG2  LYS  89           HG2      LYS  89  97.371  -1.661   2.718
  716    HG3  LYS  89           HG1      LYS  89  98.360  -0.330   3.282
  717    HD2  LYS  89           HD2      LYS  89  97.502  -0.418   5.467
  718    HD3  LYS  89           HD1      LYS  89  96.075  -1.318   4.970
  719    HE2  LYS  89           HE2      LYS  89  97.657  -2.790   6.132
  720    HE3  LYS  89           HE1      LYS  89  97.457  -3.265   4.445
  721    HZ1  LYS  89           HZ1      LYS  89  99.597  -2.903   4.062
  722    HZ2  LYS  89           HZ2      LYS  89  99.820  -2.671   5.730
  723    HZ3  LYS  89           HZ3      LYS  89  99.523  -1.340   4.717
  724    H    LEU  90           HN       LEU  90  92.756   0.572   3.262
  725    HA   LEU  90           HA       LEU  90  92.180   1.508   0.500
  726    HB2  LEU  90           HB2      LEU  90  90.269   1.688   2.817
  727    HB3  LEU  90           HB1      LEU  90  89.910   1.569   1.095
  728    HG   LEU  90           HG       LEU  90  91.093  -0.596   2.839
  729   HD11  LEU  90          HD11      LEU  90  88.417  -0.291   1.450
  730   HD12  LEU  90          HD12      LEU  90  88.702  -0.330   3.190
  731   HD13  LEU  90          HD13      LEU  90  88.970  -1.779   2.220
  732   HD21  LEU  90          HD21      LEU  90  90.582  -0.426  -0.137
  733   HD22  LEU  90          HD22      LEU  90  90.738  -1.970   0.703
  734   HD23  LEU  90          HD23      LEU  90  92.089  -0.838   0.683
  735    H    GLN  91           HN       GLN  91  90.853   3.658   0.586
  736    HA   GLN  91           HA       GLN  91  92.149   5.635   2.410
  737    HB2  GLN  91           HB2      GLN  91  91.567   6.150  -0.523
  738    HB3  GLN  91           HB1      GLN  91  92.472   7.178   0.583
  739    HG2  GLN  91           HG2      GLN  91  94.376   5.822   0.499
  740    HG3  GLN  91           HG1      GLN  91  93.476   4.396   0.030
  741   HE21  GLN  91          HE21      GLN  91  92.497   7.160  -1.679
  742   HE22  GLN  91          HE22      GLN  91  93.339   6.844  -3.110
  743    H    PHE  92           HN       PHE  92  90.805   7.734   2.328
  744    HA   PHE  92           HA       PHE  92  87.947   7.206   1.662
  745    HB2  PHE  92           HB2      PHE  92  88.232   6.793   4.061
  746    HB3  PHE  92           HB1      PHE  92  89.001   8.351   4.269
  747    HD1  PHE  92           HD1      PHE  92  87.581   9.684   5.556
  748    HD2  PHE  92           HD2      PHE  92  85.859   7.305   2.411
  749    HE1  PHE  92           HE1      PHE  92  85.367  10.659   6.022
  750    HE2  PHE  92           HE2      PHE  92  83.651   8.306   2.872
  751    HZ   PHE  92           HZ       PHE  92  83.398   9.983   4.678
  752    H    THR  93           HN       THR  93  87.906   8.527  -0.075
  753    HA   THR  93           HA       THR  93  88.444  11.435   0.416
  754    HB   THR  93           HB       THR  93  90.442  11.063  -0.680
  755    HG1  THR  93           HG1      THR  93  89.980  10.972  -3.082
  756   HG21  THR  93          HG21      THR  93  90.777   9.148  -2.278
  757   HG22  THR  93          HG22      THR  93  89.118   8.650  -1.947
  758   HG23  THR  93          HG23      THR  93  90.314   8.647  -0.652
  759    HA   PRO  94           HA       PRO  94  84.842  12.499  -1.948
  760    HB2  PRO  94           HB2      PRO  94  86.014  14.161  -3.932
  761    HB3  PRO  94           HB1      PRO  94  85.394  14.681  -2.355
  762    HG2  PRO  94           HG2      PRO  94  88.190  14.070  -3.177
  763    HG3  PRO  94           HG1      PRO  94  87.585  15.295  -2.046
  764    HD2  PRO  94           HD2      PRO  94  88.762  13.083  -1.133
  765    HD3  PRO  94           HD1      PRO  94  87.345  13.751  -0.297
  766    H    TYR 541           HT1      TYR 541  57.812  42.735  16.515
  767    HA   TYR 541           HA       TYR 541  56.915  40.913  17.621
  768    HB2  TYR 541           HB2      TYR 541  54.449  42.584  18.182
  769    HB3  TYR 541           HB1      TYR 541  54.818  40.980  18.817
  770    HD1  TYR 541           HD1      TYR 541  56.760  40.677  20.387
  771    HD2  TYR 541           HD2      TYR 541  55.352  44.554  19.190
  772    HE1  TYR 541           HE1      TYR 541  57.974  41.704  22.289
  773    HE2  TYR 541           HE2      TYR 541  56.566  45.583  21.093
  774    HH   TYR 541           HH       TYR 541  57.375  44.568  23.519
  775    H    HIS 542           HN       HIS 542  56.915  40.084  15.496
  776    HA   HIS 542           HA       HIS 542  55.092  40.825  13.444
  777    HB2  HIS 542           HB2      HIS 542  56.254  38.055  13.764
  778    HB3  HIS 542           HB1      HIS 542  55.898  38.930  12.279
  779    HD1  HIS 542           HD1      HIS 542  58.121  39.460  15.342
  780    HD2  HIS 542           HD2      HIS 542  58.154  40.098  11.223
  781    HE1  HIS 542           HE1      HIS 542  60.387  40.446  14.788
  782    H    GLU 543           HN       GLU 543  53.802  38.556  12.585
  783    HA   GLU 543           HA       GLU 543  52.079  37.630  14.838
  784    HB2  GLU 543           HB2      GLU 543  50.074  38.076  13.315
  785    HB3  GLU 543           HB1      GLU 543  50.830  39.502  14.028
  786    HG2  GLU 543           HG2      GLU 543  51.940  40.064  12.006
  787    HG3  GLU 543           HG1      GLU 543  51.646  38.471  11.307
  788    H    ARG 544           HN       ARG 544  53.921  36.857  12.198
  789    HA   ARG 544           HA       ARG 544  52.214  34.698  11.155
  790    HB2  ARG 544           HB2      ARG 544  55.095  35.462  10.580
  791    HB3  ARG 544           HB1      ARG 544  54.235  34.161   9.776
  792    HG2  ARG 544           HG2      ARG 544  53.796  35.838   8.245
  793    HG3  ARG 544           HG1      ARG 544  52.437  36.119   9.331
  794    HD2  ARG 544           HD2      ARG 544  53.359  38.262   9.125
  795    HD3  ARG 544           HD1      ARG 544  54.117  37.670  10.602
  796    HE   ARG 544           HE       ARG 544  55.880  36.903   8.613
  797   HH11  ARG 544          HH11      ARG 544  57.586  38.212   7.922
  798   HH12  ARG 544          HH12      ARG 544  57.476  39.930   8.118
  799   HH21  ARG 544          HH21      ARG 544  54.336  39.827   9.587
  800   HH22  ARG 544          HH22      ARG 544  55.637  40.844   9.063
  801    H    ARG 545           HN       ARG 545  51.954  33.053  12.651
  802    HA   ARG 545           HA       ARG 545  54.167  32.208  14.365
  803    HB2  ARG 545           HB2      ARG 545  51.385  31.090  13.890
  804    HB3  ARG 545           HB1      ARG 545  52.526  30.416  15.038
  805    HG2  ARG 545           HG2      ARG 545  51.393  31.832  16.476
  806    HG3  ARG 545           HG1      ARG 545  52.618  32.956  15.902
  807    HD2  ARG 545           HD2      ARG 545  50.647  34.186  15.606
  808    HD3  ARG 545           HD1      ARG 545  50.863  33.476  14.009
  809    HE   ARG 545           HE       ARG 545  49.317  31.614  15.363
  810   HH11  ARG 545          HH11      ARG 545  47.057  31.676  15.360
  811   HH12  ARG 545          HH12      ARG 545  46.246  33.178  15.066
  812   HH21  ARG 545          HH21      ARG 545  49.177  34.994  14.698
  813   HH22  ARG 545          HH22      ARG 545  47.446  35.056  14.691
  814    H    GLY 546           HN       GLY 546  53.792  29.405  14.284
  815    HA2  GLY 546           HA2      GLY 546  54.063  28.425  11.564
  816    HA3  GLY 546           HA1      GLY 546  55.624  28.552  12.373
  817    H    SER 547           HN       SER 547  56.191  26.991  13.855
  818    HA   SER 547           HA       SER 547  54.268  25.285  15.191
  819    HB2  SER 547           HB2      SER 547  55.574  24.384  12.647
  820    HB3  SER 547           HB1      SER 547  55.395  23.204  13.943
  821    HG   SER 547           HG       SER 547  53.424  24.640  12.525
  822    H    LEU 548           HN       LEU 548  55.358  24.986  17.109
  823    HA   LEU 548           HA       LEU 548  58.106  25.544  17.411
  824    HB2  LEU 548           HB2      LEU 548  55.963  24.382  19.081
  825    HB3  LEU 548           HB1      LEU 548  57.579  23.864  19.540
  826    HG   LEU 548           HG       LEU 548  58.245  26.332  19.516
  827   HD11  LEU 548          HD11      LEU 548  56.555  27.358  18.237
  828   HD12  LEU 548          HD12      LEU 548  56.210  27.862  19.886
  829   HD13  LEU 548          HD13      LEU 548  55.265  26.574  19.143
  830   HD21  LEU 548          HD21      LEU 548  57.572  24.936  21.572
  831   HD22  LEU 548          HD22      LEU 548  56.033  25.791  21.482
  832   HD23  LEU 548          HD23      LEU 548  57.532  26.692  21.724
  833    H    CYS 549           HN       CYS 549  59.952  24.348  17.206
  834    HA   CYS 549           HA       CYS 549  59.674  21.688  15.970
  835    HB2  CYS 549           HB2      CYS 549  61.440  22.924  15.012
  836    HB3  CYS 549           HB1      CYS 549  61.937  23.593  16.555
  837    H    SER 550           HN       SER 550  59.039  20.251  17.461
  838    HA   SER 550           HA       SER 550  59.408  20.260  20.203
  839    HB2  SER 550           HB2      SER 550  57.933  18.640  19.437
  840    HB3  SER 550           HB1      SER 550  59.058  18.039  18.223
  841    HG   SER 550           HG       SER 550  60.146  16.950  19.749
  842    H    GLY 551           HN       GLY 551  61.073  20.149  21.458
  843    HA2  GLY 551           HA2      GLY 551  63.154  19.013  22.202
  844    HA3  GLY 551           HA1      GLY 551  63.621  18.889  20.501
  845    H    CYS 552           HN       CYS 552  62.625  21.451  19.782
  846    HA   CYS 552           HA       CYS 552  64.740  23.211  20.945
  847    HB2  CYS 552           HB2      CYS 552  63.309  22.999  18.312
  848    HB3  CYS 552           HB1      CYS 552  63.954  24.557  18.800
  849    H    GLN 553           HN       GLN 553  61.348  22.838  20.154
  850    HA   GLN 553           HA       GLN 553  59.486  24.042  20.709
  851    HB2  GLN 553           HB2      GLN 553  61.140  24.630  23.149
  852    HB3  GLN 553           HB1      GLN 553  59.419  24.994  22.998
  853    HG2  GLN 553           HG2      GLN 553  60.601  22.248  22.578
  854    HG3  GLN 553           HG1      GLN 553  59.889  22.777  24.090
  855   HE21  GLN 553          HE21      GLN 553  59.169  22.065  20.697
  856   HE22  GLN 553          HE22      GLN 553  57.499  21.839  20.908
  857    H    LYS 554           HN       LYS 554  60.611  25.218  18.884
  858    HA   LYS 554           HA       LYS 554  60.351  28.112  19.447
  859    HB2  LYS 554           HB2      LYS 554  62.593  26.858  17.839
  860    HB3  LYS 554           HB1      LYS 554  62.249  28.582  17.873
  861    HG2  LYS 554           HG2      LYS 554  62.920  26.913  20.310
  862    HG3  LYS 554           HG1      LYS 554  64.074  27.919  19.443
  863    HD2  LYS 554           HD2      LYS 554  62.268  29.817  19.855
  864    HD3  LYS 554           HD1      LYS 554  61.741  28.745  21.151
  865    HE2  LYS 554           HE2      LYS 554  64.119  28.705  21.984
  866    HE3  LYS 554           HE1      LYS 554  64.496  29.947  20.790
  867    HZ1  LYS 554           HZ1      LYS 554  63.679  30.486  23.259
  868    HZ2  LYS 554           HZ2      LYS 554  62.179  30.455  22.462
  869    HZ3  LYS 554           HZ3      LYS 554  63.399  31.516  21.941
  870    HA   PRO 555           HA       PRO 555  57.392  27.295  16.104
  871    HB2  PRO 555           HB2      PRO 555  57.981  30.093  15.321
  872    HB3  PRO 555           HB1      PRO 555  56.424  29.311  15.613
  873    HG2  PRO 555           HG2      PRO 555  57.613  31.026  17.404
  874    HG3  PRO 555           HG1      PRO 555  56.483  29.754  17.880
  875    HD2  PRO 555           HD2      PRO 555  59.389  29.908  18.373
  876    HD3  PRO 555           HD1      PRO 555  58.191  28.818  19.112
  877    H    ILE 556           HN       ILE 556  57.665  26.437  14.182
  878    HA   ILE 556           HA       ILE 556  60.217  26.780  12.724
  879    HB   ILE 556           HB       ILE 556  57.845  24.909  12.408
  880   HG12  ILE 556          HG12      ILE 556  60.673  24.083  13.060
  881   HG13  ILE 556          HG11      ILE 556  59.660  24.706  14.345
  882   HG21  ILE 556          HG21      ILE 556  60.402  25.180  10.819
  883   HG22  ILE 556          HG22      ILE 556  58.744  25.224  10.219
  884   HG23  ILE 556          HG23      ILE 556  59.426  23.715  10.825
  885   HD11  ILE 556          HD11      ILE 556  59.719  22.085  13.666
  886   HD12  ILE 556          HD12      ILE 556  58.417  22.616  12.607
  887   HD13  ILE 556          HD13      ILE 556  58.291  22.850  14.350
  888    H    THR 557           HN       THR 557  60.003  28.781  11.657
  889    HA   THR 557           HA       THR 557  57.510  29.294  10.110
  890    HB   THR 557           HB       THR 557  58.106  31.561  10.149
  891    HG1  THR 557           HG1      THR 557  60.716  30.922  11.003
  892   HG21  THR 557          HG21      THR 557  59.409  30.513  12.665
  893   HG22  THR 557          HG22      THR 557  57.664  30.456  12.411
  894   HG23  THR 557          HG23      THR 557  58.501  32.011  12.462
  895    H    GLY 558           HN       GLY 558  57.832  27.911   8.373
  896    HA2  GLY 558           HA2      GLY 558  58.781  28.803   5.985
  897    HA3  GLY 558           HA1      GLY 558  60.227  28.072   6.697
  898    H    ARG 559           HN       ARG 559  60.337  25.866   6.900
  899    HA   ARG 559           HA       ARG 559  58.088  24.253   5.759
  900    HB2  ARG 559           HB2      ARG 559  61.090  24.041   5.576
  901    HB3  ARG 559           HB1      ARG 559  60.128  22.565   5.484
  902    HG2  ARG 559           HG2      ARG 559  59.398  24.935   3.778
  903    HG3  ARG 559           HG1      ARG 559  60.716  23.889   3.281
  904    HD2  ARG 559           HD2      ARG 559  59.327  22.033   2.999
  905    HD3  ARG 559           HD1      ARG 559  58.085  22.648   4.081
  906    HE   ARG 559           HE       ARG 559  58.250  23.016   1.220
  907   HH11  ARG 559          HH11      ARG 559  57.113  24.615   0.141
  908   HH12  ARG 559          HH12      ARG 559  56.400  25.913   1.039
  909   HH21  ARG 559          HH21      ARG 559  57.486  24.744   4.113
  910   HH22  ARG 559          HH22      ARG 559  56.610  25.986   3.281
  911    H    CYS 560           HN       CYS 560  57.594  22.300   6.952
  912    HA   CYS 560           HA       CYS 560  59.030  21.953   9.524
  913    HB2  CYS 560           HB2      CYS 560  56.942  21.899  10.812
  914    HB3  CYS 560           HB1      CYS 560  57.208  23.482  10.078
  915    HG   CYS 560           HG       CYS 560  55.126  23.198   8.768
  916    H    ILE 561           HN       ILE 561  59.430  19.966   9.924
  917    HA   ILE 561           HA       ILE 561  58.048  17.830   8.424
  918    HB   ILE 561           HB       ILE 561  60.419  17.813  10.312
  919   HG12  ILE 561          HG12      ILE 561  60.112  17.668   7.320
  920   HG13  ILE 561          HG11      ILE 561  60.821  18.992   8.226
  921   HG21  ILE 561          HG21      ILE 561  59.502  15.607   8.462
  922   HG22  ILE 561          HG22      ILE 561  59.110  15.619  10.184
  923   HG23  ILE 561          HG23      ILE 561  60.789  15.531   9.660
  924   HD11  ILE 561          HD11      ILE 561  62.662  17.704   7.404
  925   HD12  ILE 561          HD12      ILE 561  61.897  16.185   7.892
  926   HD13  ILE 561          HD13      ILE 561  62.510  17.305   9.117
  927    H    THR 562           HN       THR 562  56.939  16.235   9.448
  928    HA   THR 562           HA       THR 562  56.238  16.663  12.328
  929    HB   THR 562           HB       THR 562  54.374  15.450  10.293
  930    HG1  THR 562           HG1      THR 562  54.798  18.124  11.052
  931   HG21  THR 562          HG21      THR 562  52.715  15.792  12.004
  932   HG22  THR 562          HG22      THR 562  53.842  16.738  12.977
  933   HG23  THR 562          HG23      THR 562  54.099  15.005  12.768
  934    H    ALA 563           HN       ALA 563  56.039  14.871  13.571
  935    HA   ALA 563           HA       ALA 563  56.963  12.285  12.387
  936    HB1  ALA 563           HB1      ALA 563  58.298  11.926  14.327
  937    HB2  ALA 563           HB2      ALA 563  57.538  13.274  15.176
  938    HB3  ALA 563           HB3      ALA 563  58.623  13.589  13.819
  939    H    MET 564           HN       MET 564  56.596  11.662  15.463
  940    HA   MET 564           HA       MET 564  54.110  10.264  15.207
  941    HB2  MET 564           HB2      MET 564  55.286  11.063  17.857
  942    HB3  MET 564           HB1      MET 564  54.527   9.539  17.392
  943    HG2  MET 564           HG2      MET 564  56.528   9.272  15.765
  944    HG3  MET 564           HG1      MET 564  57.281  10.552  16.713
  945    HE1  MET 564           HE1      MET 564  57.173   6.728  16.435
  946    HE2  MET 564           HE2      MET 564  55.516   7.297  16.616
  947    HE3  MET 564           HE3      MET 564  56.234   6.284  17.867
  948    H    ALA 565           HN       ALA 565  54.168  13.171  14.769
  949    HA   ALA 565           HA       ALA 565  52.212  14.609  14.856
  950    HB1  ALA 565           HB1      ALA 565  52.097  13.986  17.821
  951    HB2  ALA 565           HB2      ALA 565  51.089  13.155  16.628
  952    HB3  ALA 565           HB3      ALA 565  50.930  14.892  16.863
  953    H    LYS 566           HN       LYS 566  55.144  14.178  16.346
  954    HA   LYS 566           HA       LYS 566  55.352  16.829  17.585
  955    HB2  LYS 566           HB2      LYS 566  57.546  14.864  16.870
  956    HB3  LYS 566           HB1      LYS 566  57.652  16.188  18.016
  957    HG2  LYS 566           HG2      LYS 566  55.742  13.853  18.306
  958    HG3  LYS 566           HG1      LYS 566  57.318  13.930  19.075
  959    HD2  LYS 566           HD2      LYS 566  56.217  14.919  20.825
  960    HD3  LYS 566           HD1      LYS 566  56.233  16.372  19.830
  961    HE2  LYS 566           HE2      LYS 566  53.964  16.177  20.363
  962    HE3  LYS 566           HE1      LYS 566  54.026  15.351  18.806
  963    HZ1  LYS 566           HZ1      LYS 566  53.681  13.353  19.748
  964    HZ2  LYS 566           HZ2      LYS 566  52.979  14.273  20.992
  965    HZ3  LYS 566           HZ3      LYS 566  54.577  13.716  21.142
  966    H    LYS 567           HN       LYS 567  56.591  18.565  16.690
  967    HA   LYS 567           HA       LYS 567  56.839  18.443  13.722
  968    HB2  LYS 567           HB2      LYS 567  57.295  20.914  15.353
  969    HB3  LYS 567           HB1      LYS 567  56.656  20.776  13.728
  970    HG2  LYS 567           HG2      LYS 567  55.228  19.969  16.286
  971    HG3  LYS 567           HG1      LYS 567  54.862  21.374  15.296
  972    HD2  LYS 567           HD2      LYS 567  54.639  18.485  14.349
  973    HD3  LYS 567           HD1      LYS 567  53.292  19.503  14.857
  974    HE2  LYS 567           HE2      LYS 567  54.138  21.180  13.068
  975    HE3  LYS 567           HE1      LYS 567  55.047  19.813  12.431
  976    HZ1  LYS 567           HZ1      LYS 567  52.194  19.483  13.033
  977    HZ2  LYS 567           HZ2      LYS 567  53.154  18.679  11.885
  978    HZ3  LYS 567           HZ3      LYS 567  52.649  20.277  11.605
  979    H    PHE 568           HN       PHE 568  58.899  19.815  12.936
  980    HA   PHE 568           HA       PHE 568  61.183  19.549  14.760
  981    HB2  PHE 568           HB2      PHE 568  60.432  17.329  13.072
  982    HB3  PHE 568           HB1      PHE 568  61.962  17.954  12.478
  983    HD1  PHE 568           HD1      PHE 568  60.544  15.671  14.721
  984    HD2  PHE 568           HD2      PHE 568  63.664  18.617  14.491
  985    HE1  PHE 568           HE1      PHE 568  61.733  14.558  16.591
  986    HE2  PHE 568           HE2      PHE 568  64.853  17.502  16.361
  987    HZ   PHE 568           HZ       PHE 568  63.887  15.473  17.411
  988    H    HIS 569           HN       HIS 569  62.823  20.878  14.135
  989    HA   HIS 569           HA       HIS 569  62.441  22.779  12.061
  990    HB2  HIS 569           HB2      HIS 569  64.779  21.848  13.665
  991    HB3  HIS 569           HB1      HIS 569  65.105  22.852  12.266
  992    HD2  HIS 569           HD2      HIS 569  63.230  25.330  12.470
  993    HE1  HIS 569           HE1      HIS 569  63.920  25.398  16.633
  994    HA   PRO 570           HA       PRO 570  62.927  19.678   8.740
  995    HB2  PRO 570           HB2      PRO 570  63.775  22.118   7.226
  996    HB3  PRO 570           HB1      PRO 570  62.599  20.869   6.780
  997    HG2  PRO 570           HG2      PRO 570  61.822  23.317   7.664
  998    HG3  PRO 570           HG1      PRO 570  60.886  21.857   7.992
  999    HD2  PRO 570           HD2      PRO 570  62.506  23.486   9.866
 1000    HD3  PRO 570           HD1      PRO 570  61.182  22.343  10.212
 1001    H    GLU 571           HN       GLU 571  65.344  21.605  10.185
 1002    HA   GLU 571           HA       GLU 571  67.539  20.277   8.658
 1003    HB2  GLU 571           HB2      GLU 571  67.970  22.452  10.695
 1004    HB3  GLU 571           HB1      GLU 571  68.915  22.065   9.260
 1005    HG2  GLU 571           HG2      GLU 571  66.846  22.738   7.908
 1006    HG3  GLU 571           HG1      GLU 571  66.231  23.421   9.416
 1007    H    HIS 572           HN       HIS 572  66.675  21.164  12.012
 1008    HA   HIS 572           HA       HIS 572  68.639  19.552  13.264
 1009    HB2  HIS 572           HB2      HIS 572  65.861  20.022  14.384
 1010    HB3  HIS 572           HB1      HIS 572  67.340  19.718  15.292
 1011    HD2  HIS 572           HD2      HIS 572  68.994  21.893  13.116
 1012    HE1  HIS 572           HE1      HIS 572  66.762  24.739  15.278
 1013    H    PHE 573           HN       PHE 573  66.200  18.528  11.264
 1014    HA   PHE 573           HA       PHE 573  66.329  15.750  12.384
 1015    HB2  PHE 573           HB2      PHE 573  64.066  16.956  12.551
 1016    HB3  PHE 573           HB1      PHE 573  64.023  16.868  10.795
 1017    HD1  PHE 573           HD1      PHE 573  63.369  14.872   9.691
 1018    HD2  PHE 573           HD2      PHE 573  64.372  14.782  13.867
 1019    HE1  PHE 573           HE1      PHE 573  62.573  12.528   9.832
 1020    HE2  PHE 573           HE2      PHE 573  63.575  12.438  14.008
 1021    HZ   PHE 573           HZ       PHE 573  62.676  11.311  11.991
 1022    H    VAL 574           HN       VAL 574  68.273  16.511  10.725
 1023    HA   VAL 574           HA       VAL 574  67.530  15.935   7.941
 1024    HB   VAL 574           HB       VAL 574  69.997  16.266   7.526
 1025   HG11  VAL 574          HG11      VAL 574  67.991  18.190   7.911
 1026   HG12  VAL 574          HG12      VAL 574  69.547  18.450   7.142
 1027   HG13  VAL 574          HG13      VAL 574  69.356  18.810   8.834
 1028   HG21  VAL 574          HG21      VAL 574  70.771  15.654   9.764
 1029   HG22  VAL 574          HG22      VAL 574  69.934  17.050  10.459
 1030   HG23  VAL 574          HG23      VAL 574  71.294  17.289   9.366
 1031    H    CYS 575           HN       CYS 575  69.292  14.421   6.834
 1032    HA   CYS 575           HA       CYS 575  69.129  11.805   8.156
 1033    HB2  CYS 575           HB2      CYS 575  69.009  11.259   5.957
 1034    HB3  CYS 575           HB1      CYS 575  69.619  12.839   5.478
 1035    H    ALA 576           HN       ALA 576  70.927  10.659   9.101
 1036    HA   ALA 576           HA       ALA 576  73.285  12.460   9.566
 1037    HB1  ALA 576           HB1      ALA 576  72.042  11.053  11.385
 1038    HB2  ALA 576           HB2      ALA 576  73.808  11.063  11.395
 1039    HB3  ALA 576           HB3      ALA 576  72.938   9.685  10.720
 1040    H    PHE 577           HN       PHE 577  73.815  12.179   7.271
 1041    HA   PHE 577           HA       PHE 577  76.015  10.295   6.931
 1042    HB2  PHE 577           HB2      PHE 577  74.256   8.932   5.878
 1043    HB3  PHE 577           HB1      PHE 577  73.687  10.322   4.968
 1044    HD1  PHE 577           HD1      PHE 577  76.772   8.252   5.491
 1045    HD2  PHE 577           HD2      PHE 577  74.503  10.715   2.807
 1046    HE1  PHE 577           HE1      PHE 577  78.332   7.688   3.657
 1047    HE2  PHE 577           HE2      PHE 577  76.062  10.147   0.971
 1048    HZ   PHE 577           HZ       PHE 577  77.979   8.635   1.395
 1049    H    CYS 578           HN       CYS 578  73.777  12.431   5.415
 1050    HA   CYS 578           HA       CYS 578  75.851  14.475   4.787
 1051    HB2  CYS 578           HB2      CYS 578  74.514  15.035   2.761
 1052    HB3  CYS 578           HB1      CYS 578  75.089  13.372   2.680
 1053    H    LEU 579           HN       LEU 579  75.141  15.122   6.946
 1054    HA   LEU 579           HA       LEU 579  72.574  15.593   7.853
 1055    HB2  LEU 579           HB2      LEU 579  74.926  17.378   8.483
 1056    HB3  LEU 579           HB1      LEU 579  73.550  17.011   9.510
 1057    HG   LEU 579           HG       LEU 579  74.457  14.465   8.996
 1058   HD11  LEU 579          HD11      LEU 579  77.064  15.797   9.567
 1059   HD12  LEU 579          HD12      LEU 579  76.516  15.842   7.893
 1060   HD13  LEU 579          HD13      LEU 579  76.725  14.298   8.712
 1061   HD21  LEU 579          HD21      LEU 579  73.930  15.214  11.218
 1062   HD22  LEU 579          HD22      LEU 579  75.256  16.376  11.210
 1063   HD23  LEU 579          HD23      LEU 579  75.600  14.647  11.257
 1064    H    LYS 580           HN       LYS 580  73.167  16.936   4.961
 1065    HA   LYS 580           HA       LYS 580  72.493  19.713   5.699
 1066    HB2  LYS 580           HB2      LYS 580  72.969  20.293   3.518
 1067    HB3  LYS 580           HB1      LYS 580  73.900  18.811   3.641
 1068    HG2  LYS 580           HG2      LYS 580  71.088  18.937   2.474
 1069    HG3  LYS 580           HG1      LYS 580  72.562  19.019   1.525
 1070    HD2  LYS 580           HD2      LYS 580  73.180  16.815   2.019
 1071    HD3  LYS 580           HD1      LYS 580  72.147  16.747   3.437
 1072    HE2  LYS 580           HE2      LYS 580  71.324  15.489   1.358
 1073    HE3  LYS 580           HE1      LYS 580  70.177  16.569   2.150
 1074    HZ1  LYS 580           HZ1      LYS 580  71.824  17.198  -0.239
 1075    HZ2  LYS 580           HZ2      LYS 580  70.804  18.301   0.555
 1076    HZ3  LYS 580           HZ3      LYS 580  70.148  16.936  -0.215
 1077    H    GLN 581           HN       GLN 581  70.595  16.954   4.289
 1078    HA   GLN 581           HA       GLN 581  68.230  18.282   5.311
 1079    HB2  GLN 581           HB2      GLN 581  68.652  19.520   3.199
 1080    HB3  GLN 581           HB1      GLN 581  68.341  18.028   2.315
 1081    HG2  GLN 581           HG2      GLN 581  66.266  19.198   2.355
 1082    HG3  GLN 581           HG1      GLN 581  66.096  17.951   3.571
 1083   HE21  GLN 581          HE21      GLN 581  66.573  18.699   5.900
 1084   HE22  GLN 581          HE22      GLN 581  66.182  20.294   6.290
 1085    H    LEU 582           HN       LEU 582  66.452  17.032   5.526
 1086    HA   LEU 582           HA       LEU 582  66.389  14.358   4.234
 1087    HB2  LEU 582           HB2      LEU 582  67.294  14.275   6.593
 1088    HB3  LEU 582           HB1      LEU 582  65.717  14.807   7.145
 1089    HG   LEU 582           HG       LEU 582  64.700  12.793   6.160
 1090   HD11  LEU 582          HD11      LEU 582  65.848  11.927   4.380
 1091   HD12  LEU 582          HD12      LEU 582  66.716  11.006   5.606
 1092   HD13  LEU 582          HD13      LEU 582  67.401  12.498   4.973
 1093   HD21  LEU 582          HD21      LEU 582  65.241  12.476   8.409
 1094   HD22  LEU 582          HD22      LEU 582  66.976  12.546   8.120
 1095   HD23  LEU 582          HD23      LEU 582  66.062  11.115   7.649
 1096    H    ASN 583           HN       ASN 583  64.095  13.392   4.587
 1097    HA   ASN 583           HA       ASN 583  61.985  15.448   4.952
 1098    HB2  ASN 583           HB2      ASN 583  62.654  14.097   2.336
 1099    HB3  ASN 583           HB1      ASN 583  60.990  14.556   2.679
 1100   HD21  ASN 583          HD21      ASN 583  62.247  15.799   0.561
 1101   HD22  ASN 583          HD22      ASN 583  62.599  17.408   0.952
 1102    H    LYS 584           HN       LYS 584  60.242  14.541   5.903
 1103    HA   LYS 584           HA       LYS 584  60.165  11.943   6.929
 1104    HB2  LYS 584           HB2      LYS 584  57.657  12.352   7.034
 1105    HB3  LYS 584           HB1      LYS 584  58.660  13.618   7.749
 1106    HG2  LYS 584           HG2      LYS 584  58.325  15.096   5.955
 1107    HG3  LYS 584           HG1      LYS 584  57.863  13.807   4.838
 1108    HD2  LYS 584           HD2      LYS 584  55.889  15.098   5.500
 1109    HD3  LYS 584           HD1      LYS 584  55.792  13.458   6.137
 1110    HE2  LYS 584           HE2      LYS 584  56.400  14.158   8.329
 1111    HE3  LYS 584           HE1      LYS 584  56.926  15.739   7.752
 1112    HZ1  LYS 584           HZ1      LYS 584  54.375  15.651   6.918
 1113    HZ2  LYS 584           HZ2      LYS 584  54.887  16.376   8.367
 1114    HZ3  LYS 584           HZ3      LYS 584  54.271  14.792   8.376
 1115    H    GLY 585           HN       GLY 585  59.576  13.014   3.710
 1116    HA2  GLY 585           HA2      GLY 585  58.007  10.648   2.952
 1117    HA3  GLY 585           HA1      GLY 585  58.529  11.944   1.878
 1118    H    THR 586           HN       THR 586  61.264  11.650   3.129
 1119    HA   THR 586           HA       THR 586  62.130   9.095   1.839
 1120    HB   THR 586           HB       THR 586  63.701  10.151   0.487
 1121    HG1  THR 586           HG1      THR 586  63.815  11.842   2.632
 1122   HG21  THR 586          HG21      THR 586  62.638  12.026  -0.618
 1123   HG22  THR 586          HG22      THR 586  61.675  12.383   0.819
 1124   HG23  THR 586          HG23      THR 586  61.370  10.911  -0.103
 1125    H    PHE 587           HN       PHE 587  61.745  10.063   4.657
 1126    HA   PHE 587           HA       PHE 587  64.545  10.186   5.626
 1127    HB2  PHE 587           HB2      PHE 587  63.743  10.828   7.712
 1128    HB3  PHE 587           HB1      PHE 587  62.601  11.567   6.616
 1129    HD1  PHE 587           HD1      PHE 587  60.752   9.441   5.884
 1130    HD2  PHE 587           HD2      PHE 587  62.638  10.190   9.669
 1131    HE1  PHE 587           HE1      PHE 587  58.905   8.266   7.034
 1132    HE2  PHE 587           HE2      PHE 587  60.789   9.009  10.819
 1133    HZ   PHE 587           HZ       PHE 587  58.922   8.047   9.502
 1134    H    LYS 588           HN       LYS 588  65.558   8.344   5.645
 1135    HA   LYS 588           HA       LYS 588  64.203   5.846   6.533
 1136    HB2  LYS 588           HB2      LYS 588  65.925   6.451   4.377
 1137    HB3  LYS 588           HB1      LYS 588  66.947   5.641   5.517
 1138    HG2  LYS 588           HG2      LYS 588  65.886   4.126   3.817
 1139    HG3  LYS 588           HG1      LYS 588  65.632   3.656   5.484
 1140    HD2  LYS 588           HD2      LYS 588  63.645   3.561   3.776
 1141    HD3  LYS 588           HD1      LYS 588  63.353   4.125   5.402
 1142    HE2  LYS 588           HE2      LYS 588  63.030   6.328   4.707
 1143    HE3  LYS 588           HE1      LYS 588  64.069   6.142   3.312
 1144    HZ1  LYS 588           HZ1      LYS 588  61.786   4.422   3.256
 1145    HZ2  LYS 588           HZ2      LYS 588  62.391   5.461   2.056
 1146    HZ3  LYS 588           HZ3      LYS 588  61.375   6.067   3.276
 1147    H    GLU 589           HN       GLU 589  65.642   4.441   7.977
 1148    HA   GLU 589           HA       GLU 589  67.612   5.961   9.571
 1149    HB2  GLU 589           HB2      GLU 589  65.771   6.699  10.801
 1150    HB3  GLU 589           HB1      GLU 589  64.885   5.194  10.593
 1151    HG2  GLU 589           HG2      GLU 589  66.275   4.065  12.188
 1152    HG3  GLU 589           HG1      GLU 589  67.445   5.389  12.216
 1153    H    GLN 590           HN       GLN 590  68.728   4.691  11.053
 1154    HA   GLN 590           HA       GLN 590  68.371   1.805  11.151
 1155    HB2  GLN 590           HB2      GLN 590  69.774   2.491   8.997
 1156    HB3  GLN 590           HB1      GLN 590  71.068   2.731  10.161
 1157    HG2  GLN 590           HG2      GLN 590  71.420   0.484   9.722
 1158    HG3  GLN 590           HG1      GLN 590  70.236   0.317  11.014
 1159   HE21  GLN 590          HE21      GLN 590  70.923  -0.783   7.942
 1160   HE22  GLN 590          HE22      GLN 590  69.357  -1.197   7.436
 1161    H    ASN 591           HN       ASN 591  69.501   0.997  12.994
 1162    HA   ASN 591           HA       ASN 591  70.262   1.259  15.188
 1163    HB2  ASN 591           HB2      ASN 591  72.493   2.901  14.985
 1164    HB3  ASN 591           HB1      ASN 591  72.492   1.172  14.706
 1165   HD21  ASN 591          HD21      ASN 591  71.515   0.748  12.295
 1166   HD22  ASN 591          HD22      ASN 591  72.289   1.653  11.091
 1167    H    ASP 592           HN       ASP 592  68.338   3.338  14.114
 1168    HA   ASP 592           HA       ASP 592  67.170   5.070  15.209
 1169    HB2  ASP 592           HB2      ASP 592  69.506   5.596  17.029
 1170    HB3  ASP 592           HB1      ASP 592  67.786   5.827  17.333
 1171    H    LYS 593           HN       LYS 593  70.105   5.264  13.649
 1172    HA   LYS 593           HA       LYS 593  70.414   8.170  13.819
 1173    HB2  LYS 593           HB2      LYS 593  71.796   6.153  12.067
 1174    HB3  LYS 593           HB1      LYS 593  72.306   7.807  12.369
 1175    HG2  LYS 593           HG2      LYS 593  72.226   7.028  14.908
 1176    HG3  LYS 593           HG1      LYS 593  72.400   5.426  14.197
 1177    HD2  LYS 593           HD2      LYS 593  74.450   6.092  13.067
 1178    HD3  LYS 593           HD1      LYS 593  74.254   7.758  13.616
 1179    HE2  LYS 593           HE2      LYS 593  74.430   5.450  15.562
 1180    HE3  LYS 593           HE1      LYS 593  75.869   6.276  14.965
 1181    HZ1  LYS 593           HZ1      LYS 593  75.207   7.310  16.984
 1182    HZ2  LYS 593           HZ2      LYS 593  73.601   7.476  16.455
 1183    HZ3  LYS 593           HZ3      LYS 593  74.838   8.384  15.725
 1184    HA   PRO 594           HA       PRO 594  67.309   8.547  10.456
 1185    HB2  PRO 594           HB2      PRO 594  68.648  11.198  10.194
 1186    HB3  PRO 594           HB1      PRO 594  66.929  10.826  10.319
 1187    HG2  PRO 594           HG2      PRO 594  68.343  11.888  12.369
 1188    HG3  PRO 594           HG1      PRO 594  66.995  10.770  12.637
 1189    HD2  PRO 594           HD2      PRO 594  69.918  10.285  12.960
 1190    HD3  PRO 594           HD1      PRO 594  68.543   9.453  13.725
 1191    H    TYR 595           HN       TYR 595  67.469   8.912   8.059
 1192    HA   TYR 595           HA       TYR 595  70.075   9.191   6.790
 1193    HB2  TYR 595           HB2      TYR 595  68.868   6.453   7.156
 1194    HB3  TYR 595           HB1      TYR 595  69.885   6.799   5.769
 1195    HD1  TYR 595           HD1      TYR 595  72.158   8.139   6.491
 1196    HD2  TYR 595           HD2      TYR 595  69.937   5.389   8.930
 1197    HE1  TYR 595           HE1      TYR 595  74.215   7.598   7.773
 1198    HE2  TYR 595           HE2      TYR 595  71.989   4.867  10.208
 1199    HH   TYR 595           HH       TYR 595  74.988   5.469   9.205
 1200    H    CYS 596           HN       CYS 596  69.752   9.632   4.562
 1201    HA   CYS 596           HA       CYS 596  66.976   9.670   3.583
 1202    HB2  CYS 596           HB2      CYS 596  69.420   9.867   1.808
 1203    HB3  CYS 596           HB1      CYS 596  67.824  10.546   1.546
 1204    H    GLN 597           HN       GLN 597  66.255   8.142   1.891
 1205    HA   GLN 597           HA       GLN 597  67.094   5.489   2.388
 1206    HB2  GLN 597           HB2      GLN 597  65.007   5.591   1.339
 1207    HB3  GLN 597           HB1      GLN 597  65.516   6.838   0.237
 1208    HG2  GLN 597           HG2      GLN 597  65.392   5.030  -1.222
 1209    HG3  GLN 597           HG1      GLN 597  67.066   4.899  -0.720
 1210   HE21  GLN 597          HE21      GLN 597  66.366   3.968   1.999
 1211   HE22  GLN 597          HE22      GLN 597  65.849   2.380   1.829
 1212    H    ASN 598           HN       ASN 598  67.842   7.553  -0.414
 1213    HA   ASN 598           HA       ASN 598  69.731   5.991  -1.703
 1214    HB2  ASN 598           HB2      ASN 598  70.359   8.903  -1.319
 1215    HB3  ASN 598           HB1      ASN 598  70.409   7.937  -2.787
 1216   HD21  ASN 598          HD21      ASN 598  67.989   6.894  -3.100
 1217   HD22  ASN 598          HD22      ASN 598  66.773   8.071  -3.116
 1218    H    CYS 599           HN       CYS 599  70.074   7.691   1.336
 1219    HA   CYS 599           HA       CYS 599  72.968   7.185   1.444
 1220    HB2  CYS 599           HB2      CYS 599  71.030   8.196   3.550
 1221    HB3  CYS 599           HB1      CYS 599  72.783   8.161   3.705
 1222    H    PHE 600           HN       PHE 600  70.274   6.305   3.631
 1223    HA   PHE 600           HA       PHE 600  71.447   4.266   5.084
 1224    HB2  PHE 600           HB2      PHE 600  69.292   4.589   5.831
 1225    HB3  PHE 600           HB1      PHE 600  68.699   4.950   4.219
 1226    HD1  PHE 600           HD1      PHE 600  69.227   2.344   6.737
 1227    HD2  PHE 600           HD2      PHE 600  67.997   3.129   2.707
 1228    HE1  PHE 600           HE1      PHE 600  68.209   0.088   6.612
 1229    HE2  PHE 600           HE2      PHE 600  66.982   0.872   2.573
 1230    HZ   PHE 600           HZ       PHE 600  67.087  -0.650   4.527
 1231    H    LEU 601           HN       LEU 601  69.633   3.781   2.063
 1232    HA   LEU 601           HA       LEU 601  70.134   1.056   1.761
 1233    HB2  LEU 601           HB2      LEU 601  68.956   1.387  -0.157
 1234    HB3  LEU 601           HB1      LEU 601  68.910   3.083   0.294
 1235    HG   LEU 601           HG       LEU 601  71.067   3.395  -1.009
 1236   HD11  LEU 601          HD11      LEU 601  70.969   1.289  -2.850
 1237   HD12  LEU 601          HD12      LEU 601  70.764   0.479  -1.305
 1238   HD13  LEU 601          HD13      LEU 601  72.175   1.488  -1.589
 1239   HD21  LEU 601          HD21      LEU 601  68.770   3.895  -1.883
 1240   HD22  LEU 601          HD22      LEU 601  68.740   2.287  -2.597
 1241   HD23  LEU 601          HD23      LEU 601  69.921   3.474  -3.147
 1242    H    LYS 602           HN       LYS 602  72.189   3.785   0.739
 1243    HA   LYS 602           HA       LYS 602  74.136   2.107  -0.499
 1244    HB2  LYS 602           HB2      LYS 602  73.823   4.783  -0.402
 1245    HB3  LYS 602           HB1      LYS 602  75.076   4.643   0.796
 1246    HG2  LYS 602           HG2      LYS 602  75.522   3.180  -1.779
 1247    HG3  LYS 602           HG1      LYS 602  75.594   4.932  -1.849
 1248    HD2  LYS 602           HD2      LYS 602  77.383   5.038  -0.333
 1249    HD3  LYS 602           HD1      LYS 602  77.095   3.402   0.251
 1250    HE2  LYS 602           HE2      LYS 602  77.998   2.421  -1.696
 1251    HE3  LYS 602           HE1      LYS 602  77.838   3.916  -2.616
 1252    HZ1  LYS 602           HZ1      LYS 602  80.101   3.722  -2.075
 1253    HZ2  LYS 602           HZ2      LYS 602  79.773   3.305  -0.461
 1254    HZ3  LYS 602           HZ3      LYS 602  79.486   4.888  -1.009
 1255    H    LEU 603           HN       LEU 603  73.516   2.673   2.888
 1256    HA   LEU 603           HA       LEU 603  76.245   1.822   3.650
 1257    HB2  LEU 603           HB2      LEU 603  74.104   2.036   5.722
 1258    HB3  LEU 603           HB1      LEU 603  75.789   2.541   5.786
 1259    HG   LEU 603           HG       LEU 603  73.579   3.906   4.260
 1260   HD11  LEU 603          HD11      LEU 603  75.171   5.001   6.568
 1261   HD12  LEU 603          HD12      LEU 603  73.675   4.099   6.819
 1262   HD13  LEU 603          HD13      LEU 603  73.654   5.605   5.902
 1263   HD21  LEU 603          HD21      LEU 603  75.434   5.708   4.065
 1264   HD22  LEU 603          HD22      LEU 603  75.550   4.305   3.013
 1265   HD23  LEU 603          HD23      LEU 603  76.547   4.398   4.458
 1266    H    PHE 604           HN       PHE 604  72.956   0.571   4.383
 1267    HA   PHE 604           HA       PHE 604  74.207  -2.052   5.056
 1268    HB2  PHE 604           HB2      PHE 604  71.297  -1.497   5.526
 1269    HB3  PHE 604           HB1      PHE 604  72.447  -2.399   6.516
 1270    HD1  PHE 604           HD1      PHE 604  74.078  -1.188   7.968
 1271    HD2  PHE 604           HD2      PHE 604  71.071   0.890   5.715
 1272    HE1  PHE 604           HE1      PHE 604  74.456   0.843   9.336
 1273    HE2  PHE 604           HE2      PHE 604  71.452   2.923   7.085
 1274    HZ   PHE 604           HZ       PHE 604  73.140   2.898   8.894
 1275    H    CYS 605           HN       CYS 605  73.736  -1.268   2.186
 1276    HA   CYS 605           HA       CYS 605  71.539  -3.119   1.410
 1277    HB2  CYS 605           HB2      CYS 605  71.545  -1.199   0.036
 1278    HB3  CYS 605           HB1      CYS 605  73.303  -1.207  -0.127
 1279    HG   CYS 605           HG       CYS 605  72.050  -3.716  -1.316
  Start of MODEL    5
    1    H    MET   1           HT1      MET   1  92.374 -17.966   6.620
    2    HA   MET   1           HA       MET   1  91.831 -20.297   7.804
    3    HB2  MET   1           HB2      MET   1  93.865 -19.223   6.381
    4    HB3  MET   1           HB1      MET   1  94.675 -19.455   7.930
    5    HG2  MET   1           HG2      MET   1  94.967 -21.511   6.852
    6    HG3  MET   1           HG1      MET   1  93.596 -21.832   7.879
    7    HE1  MET   1           HE1      MET   1  93.572 -23.960   6.030
    8    HE2  MET   1           HE2      MET   1  94.816 -23.136   5.094
    9    HE3  MET   1           HE3      MET   1  93.342 -23.683   4.298
   10    H    ALA   2           HN       ALA   2  94.338 -20.562   9.457
   11    HA   ALA   2           HA       ALA   2  93.650 -19.101  11.939
   12    HB1  ALA   2           HB1      ALA   2  93.314 -21.078  13.256
   13    HB2  ALA   2           HB2      ALA   2  93.798 -22.123  11.920
   14    HB3  ALA   2           HB3      ALA   2  92.269 -21.245  11.844
   15    H    LEU   3           HN       LEU   3  95.616 -21.672  10.486
   16    HA   LEU   3           HA       LEU   3  97.812 -21.778  12.165
   17    HB2  LEU   3           HB2      LEU   3  97.621 -21.789   9.151
   18    HB3  LEU   3           HB1      LEU   3  99.150 -22.074   9.976
   19    HG   LEU   3           HG       LEU   3  96.615 -23.654  10.499
   20   HD11  LEU   3          HD11      LEU   3  97.828 -25.461   9.206
   21   HD12  LEU   3          HD12      LEU   3  98.981 -24.226   8.698
   22   HD13  LEU   3          HD13      LEU   3  97.285 -24.095   8.232
   23   HD21  LEU   3          HD21      LEU   3  97.891 -24.063  12.380
   24   HD22  LEU   3          HD22      LEU   3  99.416 -23.719  11.568
   25   HD23  LEU   3          HD23      LEU   3  98.611 -25.267  11.317
   26    H    ASP   4           HN       ASP   4  98.027 -19.964   9.213
   27    HA   ASP   4           HA       ASP   4  99.024 -17.983   8.643
   28    HB2  ASP   4           HB2      ASP   4  97.350 -16.894   9.953
   29    HB3  ASP   4           HB1      ASP   4  98.168 -17.312  11.450
   30    H    GLY   5           HN       GLY   5 100.267 -20.021  10.942
   31    HA2  GLY   5           HA2      GLY   5 102.737 -20.386  10.771
   32    HA3  GLY   5           HA1      GLY   5 102.909 -18.637  10.867
   33    H    ILE   6           HN       ILE   6 100.485 -18.954  12.759
   34    HA   ILE   6           HA       ILE   6 102.099 -19.499  15.229
   35    HB   ILE   6           HB       ILE   6 100.031 -17.871  16.066
   36   HG12  ILE   6          HG12      ILE   6  99.455 -17.705  13.532
   37   HG13  ILE   6          HG11      ILE   6  99.512 -16.227  14.465
   38   HG21  ILE   6          HG21      ILE   6 102.796 -17.197  15.100
   39   HG22  ILE   6          HG22      ILE   6 102.229 -17.399  16.758
   40   HG23  ILE   6          HG23      ILE   6 101.738 -15.985  15.825
   41   HD11  ILE   6          HD11      ILE   6 102.095 -17.012  13.222
   42   HD12  ILE   6          HD12      ILE   6 101.327 -15.431  13.332
   43   HD13  ILE   6          HD13      ILE   6 100.810 -16.577  12.100
   44    H    ARG   7           HN       ARG   7  98.740 -18.965  15.785
   45    HA   ARG   7           HA       ARG   7  97.959 -21.733  15.388
   46    HB2  ARG   7           HB2      ARG   7  97.500 -22.046  17.871
   47    HB3  ARG   7           HB1      ARG   7  99.172 -22.138  17.355
   48    HG2  ARG   7           HG2      ARG   7  98.292 -19.410  18.119
   49    HG3  ARG   7           HG1      ARG   7  98.293 -20.583  19.439
   50    HD2  ARG   7           HD2      ARG   7 100.647 -21.152  18.884
   51    HD3  ARG   7           HD1      ARG   7 100.619 -19.908  17.640
   52    HE   ARG   7           HE       ARG   7  99.812 -18.762  20.134
   53   HH11  ARG   7          HH11      ARG   7 101.305 -17.473  21.234
   54   HH12  ARG   7          HH12      ARG   7 102.990 -17.611  20.860
   55   HH21  ARG   7          HH21      ARG   7 102.525 -20.053  18.442
   56   HH22  ARG   7          HH22      ARG   7 103.682 -19.074  19.280
   57    H    MET   8           HN       MET   8  96.626 -19.910  18.105
   58    HA   MET   8           HA       MET   8  94.341 -19.088  16.352
   59    HB2  MET   8           HB2      MET   8  93.407 -19.885  19.015
   60    HB3  MET   8           HB1      MET   8  92.831 -20.368  17.432
   61    HG2  MET   8           HG2      MET   8  94.835 -21.912  17.267
   62    HG3  MET   8           HG1      MET   8  95.139 -21.589  18.967
   63    HE1  MET   8           HE1      MET   8  92.581 -23.345  20.943
   64    HE2  MET   8           HE2      MET   8  93.168 -21.694  20.756
   65    HE3  MET   8           HE3      MET   8  94.311 -23.035  20.739
   66    HA   PRO   9           HA       PRO   9  94.219 -16.100  20.204
   67    HB2  PRO   9           HB2      PRO   9  97.063 -16.465  21.108
   68    HB3  PRO   9           HB1      PRO   9  95.618 -16.081  22.073
   69    HG2  PRO   9           HG2      PRO   9  96.565 -18.506  22.151
   70    HG3  PRO   9           HG1      PRO   9  94.817 -18.265  21.935
   71    HD2  PRO   9           HD2      PRO   9  96.867 -18.907  19.839
   72    HD3  PRO   9           HD1      PRO   9  95.299 -19.663  20.117
   73    H    ASP  10           HN       ASP  10  97.021 -16.787  18.291
   74    HA   ASP  10           HA       ASP  10  97.239 -13.911  17.462
   75    HB2  ASP  10           HB2      ASP  10  99.234 -14.939  18.715
   76    HB3  ASP  10           HB1      ASP  10  99.457 -15.960  17.297
   77    H    GLY  11           HN       GLY  11  97.005 -17.255  16.576
   78    HA2  GLY  11           HA2      GLY  11  97.370 -16.745  13.710
   79    HA3  GLY  11           HA1      GLY  11  96.939 -18.285  14.451
   80    H    CYS  12           HN       CYS  12  94.950 -16.023  15.802
   81    HA   CYS  12           HA       CYS  12  92.987 -15.815  13.636
   82    HB2  CYS  12           HB2      CYS  12  92.462 -18.064  14.306
   83    HB3  CYS  12           HB1      CYS  12  92.533 -17.633  16.014
   84    HG   CYS  12           HG       CYS  12  90.212 -16.907  14.081
   85    H    TYR  13           HN       TYR  13  93.789 -15.411  17.051
   86    HA   TYR  13           HA       TYR  13  93.476 -13.546  18.426
   87    HB2  TYR  13           HB2      TYR  13  93.361 -12.391  15.970
   88    HB3  TYR  13           HB1      TYR  13  91.697 -12.130  16.473
   89    HD1  TYR  13           HD1      TYR  13  95.130 -11.068  16.844
   90    HD2  TYR  13           HD2      TYR  13  91.265 -10.983  18.717
   91    HE1  TYR  13           HE1      TYR  13  95.862  -9.175  18.269
   92    HE2  TYR  13           HE2      TYR  13  91.997  -9.089  20.141
   93    HH   TYR  13           HH       TYR  13  95.270  -8.154  20.410
   94    H    ALA  14           HN       ALA  14  90.847 -14.895  16.556
   95    HA   ALA  14           HA       ALA  14  89.301 -15.746  18.714
   96    HB1  ALA  14           HB1      ALA  14  87.478 -13.786  18.396
   97    HB2  ALA  14           HB2      ALA  14  88.938 -12.865  18.031
   98    HB3  ALA  14           HB3      ALA  14  88.771 -13.667  19.590
   99    H    ASP  15           HN       ASP  15  89.058 -14.148  15.558
  100    HA   ASP  15           HA       ASP  15  87.693 -16.508  14.498
  101    HB2  ASP  15           HB2      ASP  15  85.913 -15.058  15.605
  102    HB3  ASP  15           HB1      ASP  15  86.257 -13.861  14.356
  103    H    GLY  16           HN       GLY  16  89.904 -14.231  14.117
  104    HA2  GLY  16           HA2      GLY  16  91.194 -14.011  12.064
  105    HA3  GLY  16           HA1      GLY  16  89.713 -14.276  11.137
  106    H    THR  17           HN       THR  17  90.121 -12.137  13.912
  107    HA   THR  17           HA       THR  17  88.859  -9.952  12.487
  108    HB   THR  17           HB       THR  17  89.765  -8.722  14.694
  109    HG1  THR  17           HG1      THR  17  89.740 -11.447  15.449
  110   HG21  THR  17          HG21      THR  17  87.803  -9.856  15.942
  111   HG22  THR  17          HG22      THR  17  87.538 -10.734  14.436
  112   HG23  THR  17          HG23      THR  17  87.442  -8.972  14.460
  113    H    TRP  18           HN       TRP  18  89.846  -8.606  11.176
  114    HA   TRP  18           HA       TRP  18  92.723  -7.917  11.576
  115    HB2  TRP  18           HB2      TRP  18  92.429  -7.774   8.844
  116    HB3  TRP  18           HB1      TRP  18  93.120  -9.152   9.685
  117    HD1  TRP  18           HD1      TRP  18  89.550  -7.957   8.739
  118    HE1  TRP  18           HE1      TRP  18  88.210 -10.018   7.966
  119    HE3  TRP  18           HE3      TRP  18  93.074 -11.596   9.388
  120    HZ2  TRP  18           HZ2      TRP  18  88.583 -12.836   7.660
  121    HZ3  TRP  18           HZ3      TRP  18  92.556 -13.957   8.847
  122    HH2  TRP  18           HH2      TRP  18  90.316 -14.582   7.985
  123    H    GLU  19           HN       GLU  19  92.904  -5.719  11.749
  124    HA   GLU  19           HA       GLU  19  90.574  -4.070  11.158
  125    HB2  GLU  19           HB2      GLU  19  92.655  -2.267  11.667
  126    HB3  GLU  19           HB1      GLU  19  91.514  -2.880  12.856
  127    HG2  GLU  19           HG2      GLU  19  93.869  -3.177  13.551
  128    HG3  GLU  19           HG1      GLU  19  92.999  -4.705  13.407
  129    H    LEU  20           HN       LEU  20  90.161  -3.007   9.328
  130    HA   LEU  20           HA       LEU  20  92.086  -3.247   7.127
  131    HB2  LEU  20           HB2      LEU  20  89.253  -3.045   7.346
  132    HB3  LEU  20           HB1      LEU  20  89.759  -1.581   6.516
  133    HG   LEU  20           HG       LEU  20  89.323  -3.261   4.849
  134   HD11  LEU  20          HD11      LEU  20  92.292  -3.470   4.856
  135   HD12  LEU  20          HD12      LEU  20  91.623  -1.840   4.914
  136   HD13  LEU  20          HD13      LEU  20  91.191  -2.924   3.594
  137   HD21  LEU  20          HD21      LEU  20  91.432  -5.112   5.948
  138   HD22  LEU  20          HD22      LEU  20  90.057  -5.480   4.918
  139   HD23  LEU  20          HD23      LEU  20  89.806  -5.168   6.629
  140    H    SER  21           HN       SER  21  93.388  -1.610   6.440
  141    HA   SER  21           HA       SER  21  93.586   0.759   8.129
  142    HB2  SER  21           HB2      SER  21  95.462  -0.595   6.829
  143    HB3  SER  21           HB1      SER  21  95.053   0.522   5.528
  144    HG   SER  21           HG       SER  21  96.704   1.065   7.327
  145    H    VAL  22           HN       VAL  22  93.159   2.862   7.559
  146    HA   VAL  22           HA       VAL  22  91.861   3.343   4.927
  147    HB   VAL  22           HB       VAL  22  90.692   3.980   7.639
  148   HG11  VAL  22          HG11      VAL  22  90.166   5.309   4.963
  149   HG12  VAL  22          HG12      VAL  22  90.541   6.090   6.502
  150   HG13  VAL  22          HG13      VAL  22  88.976   5.311   6.268
  151   HG21  VAL  22          HG21      VAL  22  88.701   2.962   6.600
  152   HG22  VAL  22          HG22      VAL  22  90.081   1.863   6.501
  153   HG23  VAL  22          HG23      VAL  22  89.584   2.791   5.079
  154    H    HIS  23           HN       HIS  23  93.460   4.550   4.091
  155    HA   HIS  23           HA       HIS  23  94.878   6.603   5.612
  156    HB2  HIS  23           HB2      HIS  23  94.787   5.664   2.763
  157    HB3  HIS  23           HB1      HIS  23  95.619   7.166   3.158
  158    HD1  HIS  23           HD1      HIS  23  98.058   6.635   3.224
  159    HD2  HIS  23           HD2      HIS  23  95.794   3.641   5.038
  160    HE1  HIS  23           HE1      HIS  23  99.708   4.953   4.152
  161    H    VAL  24           HN       VAL  24  93.496   8.312   6.252
  162    HA   VAL  24           HA       VAL  24  91.364   9.150   4.462
  163    HB   VAL  24           HB       VAL  24  92.475  10.782   6.748
  164   HG11  VAL  24          HG11      VAL  24  89.796  10.505   5.370
  165   HG12  VAL  24          HG12      VAL  24  90.814  11.929   5.438
  166   HG13  VAL  24          HG13      VAL  24  89.994  11.360   6.895
  167   HG21  VAL  24          HG21      VAL  24  90.813   9.557   8.177
  168   HG22  VAL  24          HG22      VAL  24  92.145   8.539   7.629
  169   HG23  VAL  24          HG23      VAL  24  90.570   8.424   6.849
  170    H    THR  25           HN       THR  25  91.710  10.315   2.665
  171    HA   THR  25           HA       THR  25  94.255  11.754   2.338
  172    HB   THR  25           HB       THR  25  93.814  11.682   0.072
  173    HG1  THR  25           HG1      THR  25  92.016  12.434  -0.725
  174   HG21  THR  25          HG21      THR  25  93.414   9.366   1.080
  175   HG22  THR  25          HG22      THR  25  92.721   9.635  -0.519
  176   HG23  THR  25          HG23      THR  25  91.691   9.696   0.910
  177    H    ASP  26           HN       ASP  26  90.950  12.505   3.153
  178    HA   ASP  26           HA       ASP  26  91.212  15.356   2.509
  179    HB2  ASP  26           HB2      ASP  26  89.140  14.271   4.413
  180    HB3  ASP  26           HB1      ASP  26  88.993  15.570   3.229
  181    H    LEU  27           HN       LEU  27  92.341  13.318   4.905
  182    HA   LEU  27           HA       LEU  27  92.826  15.609   6.784
  183    HB2  LEU  27           HB2      LEU  27  91.729  12.885   7.274
  184    HB3  LEU  27           HB1      LEU  27  92.879  13.443   8.456
  185    HG   LEU  27           HG       LEU  27  90.590  15.216   7.605
  186   HD11  LEU  27          HD11      LEU  27  89.379  14.270   9.644
  187   HD12  LEU  27          HD12      LEU  27  90.526  12.930   9.588
  188   HD13  LEU  27          HD13      LEU  27  89.435  13.214   8.231
  189   HD21  LEU  27          HD21      LEU  27  90.978  16.279   9.694
  190   HD22  LEU  27          HD22      LEU  27  92.590  15.947   9.056
  191   HD23  LEU  27          HD23      LEU  27  91.909  14.911  10.308
  192    H    ASN  28           HN       ASN  28  93.959  12.815   5.109
  193    HA   ASN  28           HA       ASN  28  96.142  12.139   4.593
  194    HB2  ASN  28           HB2      ASN  28  96.669  14.665   4.928
  195    HB3  ASN  28           HB1      ASN  28  97.274  14.186   6.509
  196   HD21  ASN  28          HD21      ASN  28  97.985  11.479   5.245
  197   HD22  ASN  28          HD22      ASN  28  99.459  11.772   4.466
  198    H    ARG  29           HN       ARG  29  94.489  11.650   7.249
  199    HA   ARG  29           HA       ARG  29  96.669  10.571   8.924
  200    HB2  ARG  29           HB2      ARG  29  93.674  10.666   9.315
  201    HB3  ARG  29           HB1      ARG  29  94.829  10.049  10.497
  202    HG2  ARG  29           HG2      ARG  29  95.895  12.213  10.673
  203    HG3  ARG  29           HG1      ARG  29  94.904  12.854   9.373
  204    HD2  ARG  29           HD2      ARG  29  93.713  13.619  11.227
  205    HD3  ARG  29           HD1      ARG  29  92.904  12.075  10.939
  206    HE   ARG  29           HE       ARG  29  95.161  11.767  12.728
  207   HH11  ARG  29          HH11      ARG  29  94.667  11.362  14.900
  208   HH12  ARG  29          HH12      ARG  29  93.071  11.691  15.485
  209   HH21  ARG  29          HH21      ARG  29  91.897  12.829  12.428
  210   HH22  ARG  29          HH22      ARG  29  91.502  12.520  14.086
  211    H    ASP  30           HN       ASP  30  95.815   8.387   9.948
  212    HA   ASP  30           HA       ASP  30  94.781   6.576   7.846
  213    HB2  ASP  30           HB2      ASP  30  97.255   6.052   9.511
  214    HB3  ASP  30           HB1      ASP  30  96.487   4.907   8.411
  215    H    VAL  31           HN       VAL  31  93.014   5.778   8.690
  216    HA   VAL  31           HA       VAL  31  92.941   5.188  11.631
  217    HB   VAL  31           HB       VAL  31  90.610   5.424   9.710
  218   HG11  VAL  31          HG11      VAL  31  90.887   5.374  12.729
  219   HG12  VAL  31          HG12      VAL  31  90.117   4.153  11.716
  220   HG13  VAL  31          HG13      VAL  31  89.387   5.751  11.882
  221   HG21  VAL  31          HG21      VAL  31  91.820   7.578   9.822
  222   HG22  VAL  31          HG22      VAL  31  91.820   7.501  11.584
  223   HG23  VAL  31          HG23      VAL  31  90.301   7.692  10.710
  224    H    THR  32           HN       THR  32  91.918   3.192  12.262
  225    HA   THR  32           HA       THR  32  91.854   1.087  10.143
  226    HB   THR  32           HB       THR  32  92.811  -0.097  12.587
  227    HG1  THR  32           HG1      THR  32  94.819   1.183  12.631
  228   HG21  THR  32          HG21      THR  32  94.611  -0.849  11.262
  229   HG22  THR  32          HG22      THR  32  94.552   0.572  10.219
  230   HG23  THR  32          HG23      THR  32  93.295  -0.660  10.103
  231    H    LEU  33           HN       LEU  33  90.206  -0.385  10.403
  232    HA   LEU  33           HA       LEU  33  88.410  -0.046  12.774
  233    HB2  LEU  33           HB2      LEU  33  87.934  -0.171   9.837
  234    HB3  LEU  33           HB1      LEU  33  86.765  -1.016  10.830
  235    HG   LEU  33           HG       LEU  33  86.237   1.414  10.236
  236   HD11  LEU  33          HD11      LEU  33  85.204   1.830  12.355
  237   HD12  LEU  33          HD12      LEU  33  86.351   0.789  13.185
  238   HD13  LEU  33          HD13      LEU  33  85.176   0.090  12.083
  239   HD21  LEU  33          HD21      LEU  33  88.112   2.129  12.494
  240   HD22  LEU  33          HD22      LEU  33  87.347   3.175  11.314
  241   HD23  LEU  33          HD23      LEU  33  88.669   2.124  10.818
  242    H    ARG  34           HN       ARG  34  88.638  -1.801  14.019
  243    HA   ARG  34           HA       ARG  34  89.633  -4.328  13.194
  244    HB2  ARG  34           HB2      ARG  34  89.499  -3.459  15.576
  245    HB3  ARG  34           HB1      ARG  34  87.775  -3.812  15.523
  246    HG2  ARG  34           HG2      ARG  34  88.807  -5.733  16.512
  247    HG3  ARG  34           HG1      ARG  34  88.380  -6.185  14.865
  248    HD2  ARG  34           HD2      ARG  34  90.591  -6.188  14.143
  249    HD3  ARG  34           HD1      ARG  34  91.123  -5.071  15.399
  250    HE   ARG  34           HE       ARG  34  90.348  -7.311  16.817
  251   HH11  ARG  34          HH11      ARG  34  91.754  -9.021  17.280
  252   HH12  ARG  34          HH12      ARG  34  93.123  -9.300  16.256
  253   HH21  ARG  34          HH21      ARG  34  92.403  -6.658  14.128
  254   HH22  ARG  34          HH22      ARG  34  93.489  -7.964  14.470
  255    H    VAL  35           HN       VAL  35  88.599  -5.413  11.591
  256    HA   VAL  35           HA       VAL  35  85.677  -5.971  11.932
  257    HB   VAL  35           HB       VAL  35  85.508  -5.840   9.430
  258   HG11  VAL  35          HG11      VAL  35  86.251  -3.400  11.053
  259   HG12  VAL  35          HG12      VAL  35  84.633  -3.997  10.670
  260   HG13  VAL  35          HG13      VAL  35  85.632  -3.284   9.404
  261   HG21  VAL  35          HG21      VAL  35  87.844  -6.068   8.833
  262   HG22  VAL  35          HG22      VAL  35  88.262  -4.621   9.746
  263   HG23  VAL  35          HG23      VAL  35  87.283  -4.489   8.288
  264    H    THR  36           HN       THR  36  85.269  -7.594   9.836
  265    HA   THR  36           HA       THR  36  87.372  -9.695   9.852
  266    HB   THR  36           HB       THR  36  85.357 -11.353  10.140
  267    HG1  THR  36           HG1      THR  36  83.965 -10.119  11.806
  268   HG21  THR  36          HG21      THR  36  86.551  -9.734  12.386
  269   HG22  THR  36          HG22      THR  36  87.100 -11.294  11.770
  270   HG23  THR  36          HG23      THR  36  85.577 -11.179  12.650
  271    H    GLY  37           HN       GLY  37  86.589 -11.441   8.174
  272    HA2  GLY  37           HA2      GLY  37  85.923  -9.975   5.755
  273    HA3  GLY  37           HA1      GLY  37  86.292 -11.690   5.840
  274    H    GLU  38           HN       GLU  38  83.845  -9.790   7.548
  275    HA   GLU  38           HA       GLU  38  81.689 -11.169   6.053
  276    HB2  GLU  38           HB2      GLU  38  80.614 -11.982   8.018
  277    HB3  GLU  38           HB1      GLU  38  82.292 -12.495   8.137
  278    HG2  GLU  38           HG2      GLU  38  82.062 -11.595  10.264
  279    HG3  GLU  38           HG1      GLU  38  82.522 -10.128   9.400
  280    H    VAL  39           HN       VAL  39  83.009  -8.358   7.145
  281    HA   VAL  39           HA       VAL  39  80.489  -7.081   7.972
  282    HB   VAL  39           HB       VAL  39  81.783  -5.202   8.540
  283   HG11  VAL  39          HG11      VAL  39  82.198  -7.432   9.777
  284   HG12  VAL  39          HG12      VAL  39  83.332  -6.114  10.052
  285   HG13  VAL  39          HG13      VAL  39  83.757  -7.431   8.954
  286   HG21  VAL  39          HG21      VAL  39  84.191  -4.990   7.805
  287   HG22  VAL  39          HG22      VAL  39  83.031  -4.829   6.500
  288   HG23  VAL  39          HG23      VAL  39  83.915  -6.343   6.713
  289    H    HIS  40           HN       HIS  40  79.248  -5.808   6.659
  290    HA   HIS  40           HA       HIS  40  79.838  -5.826   3.790
  291    HB2  HIS  40           HB2      HIS  40  77.643  -4.144   4.980
  292    HB3  HIS  40           HB1      HIS  40  77.652  -5.081   3.485
  293    HD1  HIS  40           HD1      HIS  40  77.553  -7.753   3.789
  294    HD2  HIS  40           HD2      HIS  40  76.633  -5.516   7.184
  295    HE1  HIS  40           HE1      HIS  40  76.397  -9.333   5.396
  296    H    ILE  41           HN       ILE  41  80.316  -3.953   2.523
  297    HA   ILE  41           HA       ILE  41  82.154  -2.096   3.500
  298    HB   ILE  41           HB       ILE  41  80.094  -1.461   1.375
  299   HG12  ILE  41          HG12      ILE  41  82.719  -2.967   1.146
  300   HG13  ILE  41          HG11      ILE  41  81.106  -3.650   0.956
  301   HG21  ILE  41          HG21      ILE  41  81.828  -0.016   0.464
  302   HG22  ILE  41          HG22      ILE  41  82.968  -0.554   1.700
  303   HG23  ILE  41          HG23      ILE  41  81.560   0.409   2.159
  304   HD11  ILE  41          HD11      ILE  41  82.698  -2.064  -0.945
  305   HD12  ILE  41          HD12      ILE  41  81.010  -1.564  -0.829
  306   HD13  ILE  41          HD13      ILE  41  81.416  -3.227  -1.247
  307    H    GLY  42           HN       GLY  42  78.703  -1.439   2.946
  308    HA2  GLY  42           HA2      GLY  42  78.614   1.081   4.135
  309    HA3  GLY  42           HA1      GLY  42  77.235  -0.006   4.075
  310    H    GLY  43           HN       GLY  43  79.248  -1.904   5.505
  311    HA2  GLY  43           HA2      GLY  43  78.286  -1.268   8.206
  312    HA3  GLY  43           HA1      GLY  43  79.236  -2.679   7.736
  313    H    VAL  44           HN       VAL  44  81.218  -0.933   6.338
  314    HA   VAL  44           HA       VAL  44  82.914  -0.423   8.672
  315    HB   VAL  44           HB       VAL  44  83.266  -0.375   5.672
  316   HG11  VAL  44          HG11      VAL  44  85.697   0.315   6.159
  317   HG12  VAL  44          HG12      VAL  44  85.110   0.884   7.722
  318   HG13  VAL  44          HG13      VAL  44  84.491   1.600   6.234
  319   HG21  VAL  44          HG21      VAL  44  84.973  -1.669   7.809
  320   HG22  VAL  44          HG22      VAL  44  84.870  -2.083   6.097
  321   HG23  VAL  44          HG23      VAL  44  83.519  -2.439   7.172
  322    H    MET  45           HN       MET  45  81.738   1.640   5.938
  323    HA   MET  45           HA       MET  45  82.692   4.084   6.920
  324    HB2  MET  45           HB2      MET  45  80.460   5.012   5.849
  325    HB3  MET  45           HB1      MET  45  81.703   4.311   4.827
  326    HG2  MET  45           HG2      MET  45  80.177   2.823   4.044
  327    HG3  MET  45           HG1      MET  45  80.031   2.130   5.641
  328    HE1  MET  45           HE1      MET  45  77.495   2.704   3.174
  329    HE2  MET  45           HE2      MET  45  78.659   3.991   2.870
  330    HE3  MET  45           HE3      MET  45  77.002   4.394   3.318
  331    H    LEU  46           HN       LEU  46  79.746   2.326   7.866
  332    HA   LEU  46           HA       LEU  46  78.608   4.283   9.572
  333    HB2  LEU  46           HB2      LEU  46  77.628   2.031   8.947
  334    HB3  LEU  46           HB1      LEU  46  78.710   1.300  10.126
  335    HG   LEU  46           HG       LEU  46  77.094   3.595  11.162
  336   HD11  LEU  46          HD11      LEU  46  75.828   1.061  10.132
  337   HD12  LEU  46          HD12      LEU  46  75.273   2.728   9.979
  338   HD13  LEU  46          HD13      LEU  46  75.146   1.899  11.528
  339   HD21  LEU  46          HD21      LEU  46  78.592   2.166  12.573
  340   HD22  LEU  46          HD22      LEU  46  77.562   0.781  12.211
  341   HD23  LEU  46          HD23      LEU  46  76.916   2.146  13.122
  342    H    LYS  47           HN       LYS  47  80.795   1.619  10.570
  343    HA   LYS  47           HA       LYS  47  81.222   2.549  13.219
  344    HB2  LYS  47           HB2      LYS  47  83.195   1.069  11.470
  345    HB3  LYS  47           HB1      LYS  47  83.166   1.085  13.234
  346    HG2  LYS  47           HG2      LYS  47  81.015  -0.061  13.239
  347    HG3  LYS  47           HG1      LYS  47  80.942   0.030  11.479
  348    HD2  LYS  47           HD2      LYS  47  83.025  -1.320  11.341
  349    HD3  LYS  47           HD1      LYS  47  83.013  -1.475  13.098
  350    HE2  LYS  47           HE2      LYS  47  80.654  -2.310  11.405
  351    HE3  LYS  47           HE1      LYS  47  81.983  -3.414  11.767
  352    HZ1  LYS  47           HZ1      LYS  47  80.356  -1.974  13.795
  353    HZ2  LYS  47           HZ2      LYS  47  81.592  -3.096  14.112
  354    HZ3  LYS  47           HZ3      LYS  47  80.153  -3.602  13.362
  355    H    LEU  48           HN       LEU  48  83.442   2.904  10.434
  356    HA   LEU  48           HA       LEU  48  85.406   4.456  11.577
  357    HB2  LEU  48           HB2      LEU  48  85.497   3.677   9.256
  358    HB3  LEU  48           HB1      LEU  48  84.176   4.748   8.814
  359    HG   LEU  48           HG       LEU  48  85.684   6.701   9.472
  360   HD11  LEU  48          HD11      LEU  48  88.116   6.207   9.473
  361   HD12  LEU  48          HD12      LEU  48  87.746   4.485   9.476
  362   HD13  LEU  48          HD13      LEU  48  87.300   5.486  10.859
  363   HD21  LEU  48          HD21      LEU  48  86.439   4.789   7.256
  364   HD22  LEU  48          HD22      LEU  48  87.114   6.415   7.391
  365   HD23  LEU  48          HD23      LEU  48  85.379   6.196   7.147
  366    H    VAL  49           HN       VAL  49  82.265   5.669  10.387
  367    HA   VAL  49           HA       VAL  49  82.919   8.424  11.066
  368    HB   VAL  49           HB       VAL  49  80.235   7.116  10.563
  369   HG11  VAL  49          HG11      VAL  49  79.810   9.080  11.824
  370   HG12  VAL  49          HG12      VAL  49  79.570   9.558  10.143
  371   HG13  VAL  49          HG13      VAL  49  81.063   9.990  10.978
  372   HG21  VAL  49          HG21      VAL  49  82.387   8.039   8.789
  373   HG22  VAL  49          HG22      VAL  49  80.882   8.892   8.464
  374   HG23  VAL  49          HG23      VAL  49  80.931   7.136   8.383
  375    H    GLU  50           HN       GLU  50  81.016   5.835  12.630
  376    HA   GLU  50           HA       GLU  50  79.955   7.201  14.807
  377    HB2  GLU  50           HB2      GLU  50  81.172   4.441  14.620
  378    HB3  GLU  50           HB1      GLU  50  80.473   5.030  16.126
  379    HG2  GLU  50           HG2      GLU  50  78.970   5.022  13.492
  380    HG3  GLU  50           HG1      GLU  50  78.878   3.714  14.671
  381    H    LYS  51           HN       LYS  51  83.294   6.129  14.344
  382    HA   LYS  51           HA       LYS  51  84.240   6.920  16.943
  383    HB2  LYS  51           HB2      LYS  51  85.690   6.646  14.292
  384    HB3  LYS  51           HB1      LYS  51  86.474   6.801  15.865
  385    HG2  LYS  51           HG2      LYS  51  85.546   4.738  16.633
  386    HG3  LYS  51           HG1      LYS  51  84.469   4.628  15.247
  387    HD2  LYS  51           HD2      LYS  51  86.307   4.283  13.739
  388    HD3  LYS  51           HD1      LYS  51  87.474   4.584  15.027
  389    HE2  LYS  51           HE2      LYS  51  87.258   2.187  14.772
  390    HE3  LYS  51           HE1      LYS  51  86.485   2.663  16.277
  391    HZ1  LYS  51           HZ1      LYS  51  85.264   1.132  14.552
  392    HZ2  LYS  51           HZ2      LYS  51  84.828   2.633  13.885
  393    HZ3  LYS  51           HZ3      LYS  51  84.423   2.265  15.491
  394    H    LEU  52           HN       LEU  52  84.621   8.514  13.747
  395    HA   LEU  52           HA       LEU  52  85.583  10.970  14.844
  396    HB2  LEU  52           HB2      LEU  52  84.660   9.897  12.224
  397    HB3  LEU  52           HB1      LEU  52  84.592  11.629  12.405
  398    HG   LEU  52           HG       LEU  52  86.716  10.872  11.413
  399   HD11  LEU  52          HD11      LEU  52  87.568  11.872  14.098
  400   HD12  LEU  52          HD12      LEU  52  86.418  12.864  13.202
  401   HD13  LEU  52          HD13      LEU  52  87.977  12.461  12.489
  402   HD21  LEU  52          HD21      LEU  52  87.379   9.667  14.104
  403   HD22  LEU  52          HD22      LEU  52  88.241   9.474  12.578
  404   HD23  LEU  52          HD23      LEU  52  86.673   8.701  12.808
  405    H    ASP  53           HN       ASP  53  82.540  10.336  13.169
  406    HA   ASP  53           HA       ASP  53  80.354  10.969  13.645
  407    HB2  ASP  53           HB2      ASP  53  81.368  10.707  16.079
  408    HB3  ASP  53           HB1      ASP  53  81.199  12.454  16.077
  409    H    VAL  54           HN       VAL  54  82.909  13.134  14.097
  410    HA   VAL  54           HA       VAL  54  82.316  15.690  14.028
  411    HB   VAL  54           HB       VAL  54  84.446  14.714  13.295
  412   HG11  VAL  54          HG11      VAL  54  83.348  14.507  10.504
  413   HG12  VAL  54          HG12      VAL  54  83.088  13.171  11.627
  414   HG13  VAL  54          HG13      VAL  54  84.731  13.682  11.218
  415   HG21  VAL  54          HG21      VAL  54  83.286  16.768  11.370
  416   HG22  VAL  54          HG22      VAL  54  85.003  16.437  11.579
  417   HG23  VAL  54          HG23      VAL  54  84.069  17.116  12.909
  418    H    LYS  55           HN       LYS  55  80.965  17.149  13.027
  419    HA   LYS  55           HA       LYS  55  78.930  16.164  11.251
  420    HB2  LYS  55           HB2      LYS  55  78.540  18.020  12.811
  421    HB3  LYS  55           HB1      LYS  55  79.642  19.018  11.869
  422    HG2  LYS  55           HG2      LYS  55  78.080  19.421  10.254
  423    HG3  LYS  55           HG1      LYS  55  77.611  17.739  10.166
  424    HD2  LYS  55           HD2      LYS  55  76.033  17.955  11.893
  425    HD3  LYS  55           HD1      LYS  55  76.728  19.435  12.470
  426    HE2  LYS  55           HE2      LYS  55  76.037  20.551  10.339
  427    HE3  LYS  55           HE1      LYS  55  75.227  19.052   9.879
  428    HZ1  LYS  55           HZ1      LYS  55  74.051  19.275  12.112
  429    HZ2  LYS  55           HZ2      LYS  55  73.567  20.318  10.861
  430    HZ3  LYS  55           HZ3      LYS  55  74.581  20.885  12.101
  431    H    LYS  56           HN       LYS  56  81.565  15.716  10.171
  432    HA   LYS  56           HA       LYS  56  81.871  17.666   7.985
  433    HB2  LYS  56           HB2      LYS  56  83.788  16.394   9.131
  434    HB3  LYS  56           HB1      LYS  56  83.243  14.974   8.247
  435    HG2  LYS  56           HG2      LYS  56  84.024  15.759   6.220
  436    HG3  LYS  56           HG1      LYS  56  83.661  17.438   6.599
  437    HD2  LYS  56           HD2      LYS  56  86.064  17.200   6.488
  438    HD3  LYS  56           HD1      LYS  56  85.626  17.444   8.176
  439    HE2  LYS  56           HE2      LYS  56  86.086  14.723   6.916
  440    HE3  LYS  56           HE1      LYS  56  87.308  15.607   7.833
  441    HZ1  LYS  56           HZ1      LYS  56  86.387  14.340   9.468
  442    HZ2  LYS  56           HZ2      LYS  56  84.841  14.327   8.765
  443    HZ3  LYS  56           HZ3      LYS  56  85.392  15.708   9.587
  444    H    ASP  57           HN       ASP  57  81.959  16.694   5.669
  445    HA   ASP  57           HA       ASP  57  79.418  15.331   5.202
  446    HB2  ASP  57           HB2      ASP  57  81.557  15.947   3.157
  447    HB3  ASP  57           HB1      ASP  57  79.827  15.759   2.891
  448    H    TRP  58           HN       TRP  58  79.204  13.142   5.125
  449    HA   TRP  58           HA       TRP  58  81.627  11.473   4.551
  450    HB2  TRP  58           HB2      TRP  58  79.248  10.983   6.341
  451    HB3  TRP  58           HB1      TRP  58  80.381   9.729   5.881
  452    HD1  TRP  58           HD1      TRP  58  80.042  12.808   8.068
  453    HE1  TRP  58           HE1      TRP  58  82.061  12.918   9.677
  454    HE3  TRP  58           HE3      TRP  58  82.929   9.081   6.110
  455    HZ2  TRP  58           HZ2      TRP  58  84.566  11.600  10.066
  456    HZ3  TRP  58           HZ3      TRP  58  85.120   8.525   7.122
  457    HH2  TRP  58           HH2      TRP  58  85.942   9.779   9.097
  458    H    SER  59           HN       SER  59  78.053  11.520   4.312
  459    HA   SER  59           HA       SER  59  77.602   9.279   2.759
  460    HB2  SER  59           HB2      SER  59  75.755  10.708   1.646
  461    HB3  SER  59           HB1      SER  59  75.694  10.508   3.391
  462    HG   SER  59           HG       SER  59  76.266  12.742   1.848
  463    H    ASP  60           HN       ASP  60  78.297  12.530   1.400
  464    HA   ASP  60           HA       ASP  60  78.512  11.695  -1.295
  465    HB2  ASP  60           HB2      ASP  60  78.501  14.047  -0.836
  466    HB3  ASP  60           HB1      ASP  60  79.888  13.913   0.242
  467    H    HIS  61           HN       HIS  61  80.757  11.474   1.391
  468    HA   HIS  61           HA       HIS  61  82.970  10.551  -0.273
  469    HB2  HIS  61           HB2      HIS  61  82.682  10.446   2.735
  470    HB3  HIS  61           HB1      HIS  61  84.167  10.337   1.807
  471    HD1  HIS  61           HD1      HIS  61  85.431  12.466   1.853
  472    HD2  HIS  61           HD2      HIS  61  81.318  13.138   1.917
  473    HE1  HIS  61           HE1      HIS  61  85.117  14.978   1.903
  474    H    ALA  62           HN       ALA  62  84.049   8.487   0.341
  475    HA   ALA  62           HA       ALA  62  82.539   6.321   1.509
  476    HB1  ALA  62           HB1      ALA  62  82.668   6.574  -1.504
  477    HB2  ALA  62           HB2      ALA  62  81.255   6.257  -0.497
  478    HB3  ALA  62           HB3      ALA  62  82.482   5.009  -0.713
  479    H    LEU  63           HN       LEU  63  83.836   4.145   0.790
  480    HA   LEU  63           HA       LEU  63  86.703   4.874   1.114
  481    HB2  LEU  63           HB2      LEU  63  85.359   2.161   1.294
  482    HB3  LEU  63           HB1      LEU  63  87.042   2.503   1.664
  483    HG   LEU  63           HG       LEU  63  85.742   2.376   3.709
  484   HD11  LEU  63          HD11      LEU  63  87.607   4.150   3.309
  485   HD12  LEU  63          HD12      LEU  63  86.599   4.285   4.747
  486   HD13  LEU  63          HD13      LEU  63  86.280   5.313   3.352
  487   HD21  LEU  63          HD21      LEU  63  83.614   3.307   2.387
  488   HD22  LEU  63          HD22      LEU  63  84.169   4.842   3.059
  489   HD23  LEU  63          HD23      LEU  63  83.775   3.501   4.130
  490    H    TRP  64           HN       TRP  64  88.309   4.114  -0.314
  491    HA   TRP  64           HA       TRP  64  87.320   3.011  -2.936
  492    HB2  TRP  64           HB2      TRP  64  87.977   4.946  -3.938
  493    HB3  TRP  64           HB1      TRP  64  88.398   5.598  -2.379
  494    HD1  TRP  64           HD1      TRP  64  91.049   4.286  -1.630
  495    HE1  TRP  64           HE1      TRP  64  93.161   4.552  -3.069
  496    HE3  TRP  64           HE3      TRP  64  88.926   5.612  -6.082
  497    HZ2  TRP  64           HZ2      TRP  64  93.872   5.280  -5.739
  498    HZ3  TRP  64           HZ3      TRP  64  90.348   6.111  -8.049
  499    HH2  TRP  64           HH2      TRP  64  92.816   5.951  -7.883
  500    H    TRP  65           HN       TRP  65  88.827   1.621  -4.028
  501    HA   TRP  65           HA       TRP  65  90.955   0.513  -2.225
  502    HB2  TRP  65           HB2      TRP  65  88.992  -0.977  -2.957
  503    HB3  TRP  65           HB1      TRP  65  89.695  -0.920  -4.570
  504    HD1  TRP  65           HD1      TRP  65  92.674  -0.813  -2.635
  505    HE1  TRP  65           HE1      TRP  65  93.654  -3.134  -2.168
  506    HE3  TRP  65           HE3      TRP  65  88.618  -3.734  -3.733
  507    HZ2  TRP  65           HZ2      TRP  65  92.850  -5.872  -2.248
  508    HZ3  TRP  65           HZ3      TRP  65  88.772  -6.197  -3.535
  509    HH2  TRP  65           HH2      TRP  65  90.875  -7.270  -2.790
  510    H    GLU  66           HN       GLU  66  92.679   1.859  -2.944
  511    HA   GLU  66           HA       GLU  66  93.215   2.614  -5.603
  512    HB2  GLU  66           HB2      GLU  66  95.621   2.779  -4.857
  513    HB3  GLU  66           HB1      GLU  66  94.458   3.633  -3.853
  514    HG2  GLU  66           HG2      GLU  66  94.395   1.693  -2.304
  515    HG3  GLU  66           HG1      GLU  66  95.607   0.896  -3.299
  516    H    LYS  67           HN       LYS  67  93.700  -0.523  -4.115
  517    HA   LYS  67           HA       LYS  67  95.631  -1.437  -6.077
  518    HB2  LYS  67           HB2      LYS  67  93.587  -3.161  -4.652
  519    HB3  LYS  67           HB1      LYS  67  95.134  -3.673  -5.317
  520    HG2  LYS  67           HG2      LYS  67  94.753  -1.776  -2.985
  521    HG3  LYS  67           HG1      LYS  67  95.272  -3.455  -2.875
  522    HD2  LYS  67           HD2      LYS  67  97.182  -2.747  -4.484
  523    HD3  LYS  67           HD1      LYS  67  96.751  -1.098  -4.031
  524    HE2  LYS  67           HE2      LYS  67  98.338  -1.555  -2.395
  525    HE3  LYS  67           HE1      LYS  67  96.884  -2.115  -1.563
  526    HZ1  LYS  67           HZ1      LYS  67  99.131  -3.612  -2.515
  527    HZ2  LYS  67           HZ2      LYS  67  97.655  -4.255  -3.058
  528    HZ3  LYS  67           HZ3      LYS  67  97.935  -4.051  -1.395
  529    H    LYS  68           HN       LYS  68  92.469  -0.484  -6.167
  530    HA   LYS  68           HA       LYS  68  91.970  -1.783  -8.801
  531    HB2  LYS  68           HB2      LYS  68  89.692  -1.202  -6.916
  532    HB3  LYS  68           HB1      LYS  68  89.788  -2.391  -8.211
  533    HG2  LYS  68           HG2      LYS  68  91.467  -2.632  -5.692
  534    HG3  LYS  68           HG1      LYS  68  89.848  -3.283  -5.812
  535    HD2  LYS  68           HD2      LYS  68  90.430  -4.786  -7.540
  536    HD3  LYS  68           HD1      LYS  68  91.933  -3.929  -7.883
  537    HE2  LYS  68           HE2      LYS  68  93.042  -4.880  -6.090
  538    HE3  LYS  68           HE1      LYS  68  91.581  -5.050  -5.123
  539    HZ1  LYS  68           HZ1      LYS  68  91.181  -7.061  -5.957
  540    HZ2  LYS  68           HZ2      LYS  68  92.798  -7.042  -6.478
  541    HZ3  LYS  68           HZ3      LYS  68  91.553  -6.599  -7.546
  542    H    ARG  69           HN       ARG  69  92.109   1.029  -6.868
  543    HA   ARG  69           HA       ARG  69  91.487   3.255  -7.269
  544    HB2  ARG  69           HB2      ARG  69  91.808   2.191 -10.096
  545    HB3  ARG  69           HB1      ARG  69  91.414   3.872  -9.765
  546    HG2  ARG  69           HG2      ARG  69  93.741   3.983  -9.906
  547    HG3  ARG  69           HG1      ARG  69  93.528   3.760  -8.174
  548    HD2  ARG  69           HD2      ARG  69  95.175   2.176  -8.728
  549    HD3  ARG  69           HD1      ARG  69  93.693   1.228  -8.698
  550    HE   ARG  69           HE       ARG  69  94.098   2.206 -11.348
  551   HH11  ARG  69          HH11      ARG  69  94.935   0.788 -12.899
  552   HH12  ARG  69          HH12      ARG  69  95.771  -0.640 -12.386
  553   HH21  ARG  69          HH21      ARG  69  95.372   0.020  -9.006
  554   HH22  ARG  69          HH22      ARG  69  96.020  -1.074 -10.183
  555    H    THR  70           HN       THR  70  89.447   1.581  -6.549
  556    HA   THR  70           HA       THR  70  87.174   2.274  -8.386
  557    HB   THR  70           HB       THR  70  87.746  -0.158  -7.772
  558    HG1  THR  70           HG1      THR  70  85.257  -0.148  -6.981
  559   HG21  THR  70          HG21      THR  70  86.277   0.397  -5.219
  560   HG22  THR  70          HG22      THR  70  88.032   0.561  -5.280
  561   HG23  THR  70          HG23      THR  70  87.278  -0.991  -5.645
  562    H    TRP  71           HN       TRP  71  85.082   2.138  -6.812
  563    HA   TRP  71           HA       TRP  71  85.575   3.895  -4.449
  564    HB2  TRP  71           HB2      TRP  71  83.174   4.804  -5.144
  565    HB3  TRP  71           HB1      TRP  71  84.629   5.505  -5.826
  566    HD1  TRP  71           HD1      TRP  71  83.143   2.134  -6.975
  567    HE1  TRP  71           HE1      TRP  71  82.432   2.353  -9.395
  568    HE3  TRP  71           HE3      TRP  71  84.054   7.104  -7.701
  569    HZ2  TRP  71           HZ2      TRP  71  82.296   4.354 -11.447
  570    HZ3  TRP  71           HZ3      TRP  71  83.634   8.136  -9.914
  571    HH2  TRP  71           HH2      TRP  71  82.756   6.769 -11.787
  572    H    LEU  72           HN       LEU  72  85.315   2.311  -2.962
  573    HA   LEU  72           HA       LEU  72  83.613   0.085  -3.223
  574    HB2  LEU  72           HB2      LEU  72  84.579   1.429  -0.706
  575    HB3  LEU  72           HB1      LEU  72  83.988  -0.217  -0.809
  576    HG   LEU  72           HG       LEU  72  86.287   0.802  -2.473
  577   HD11  LEU  72          HD11      LEU  72  86.393  -0.622   0.185
  578   HD12  LEU  72          HD12      LEU  72  86.879   1.045  -0.125
  579   HD13  LEU  72          HD13      LEU  72  87.784  -0.284  -0.849
  580   HD21  LEU  72          HD21      LEU  72  85.556  -1.181  -3.469
  581   HD22  LEU  72          HD22      LEU  72  85.091  -1.903  -1.926
  582   HD23  LEU  72          HD23      LEU  72  86.795  -1.770  -2.361
  583    H    LEU  73           HN       LEU  73  81.706   0.965  -4.048
  584    HA   LEU  73           HA       LEU  73  79.851   2.156  -2.018
  585    HB2  LEU  73           HB2      LEU  73  78.512   2.943  -4.002
  586    HB3  LEU  73           HB1      LEU  73  80.093   3.702  -3.863
  587    HG   LEU  73           HG       LEU  73  80.747   1.578  -5.469
  588   HD11  LEU  73          HD11      LEU  73  79.064   1.039  -7.024
  589   HD12  LEU  73          HD12      LEU  73  78.048   2.400  -6.545
  590   HD13  LEU  73          HD13      LEU  73  78.206   1.008  -5.482
  591   HD21  LEU  73          HD21      LEU  73  81.259   3.921  -5.958
  592   HD22  LEU  73          HD22      LEU  73  79.581   4.229  -6.376
  593   HD23  LEU  73          HD23      LEU  73  80.558   3.158  -7.379
  594    H    LYS  74           HN       LYS  74  80.735  -0.674  -3.299
  595    HA   LYS  74           HA       LYS  74  78.122  -1.767  -4.031
  596    HB2  LYS  74           HB2      LYS  74  80.923  -2.832  -3.780
  597    HB3  LYS  74           HB1      LYS  74  79.597  -3.985  -3.732
  598    HG2  LYS  74           HG2      LYS  74  80.405  -3.718  -6.032
  599    HG3  LYS  74           HG1      LYS  74  78.756  -3.123  -5.885
  600    HD2  LYS  74           HD2      LYS  74  80.123  -1.563  -7.202
  601    HD3  LYS  74           HD1      LYS  74  79.600  -0.816  -5.698
  602    HE2  LYS  74           HE2      LYS  74  82.112  -0.596  -6.447
  603    HE3  LYS  74           HE1      LYS  74  81.732  -0.896  -4.756
  604    HZ1  LYS  74           HZ1      LYS  74  82.377  -3.076  -4.897
  605    HZ2  LYS  74           HZ2      LYS  74  83.477  -2.349  -5.969
  606    HZ3  LYS  74           HZ3      LYS  74  82.117  -3.172  -6.570
  607    H    THR  75           HN       THR  75  77.206  -0.961  -1.861
  608    HA   THR  75           HA       THR  75  77.905  -1.843   0.671
  609    HB   THR  75           HB       THR  75  75.069  -1.847  -0.399
  610    HG1  THR  75           HG1      THR  75  76.523   0.092  -0.647
  611   HG21  THR  75          HG21      THR  75  76.179  -1.383   2.384
  612   HG22  THR  75          HG22      THR  75  75.389  -2.869   1.845
  613   HG23  THR  75          HG23      THR  75  74.475  -1.362   1.926
  614    H    HIS  76           HN       HIS  76  75.813  -3.661  -1.597
  615    HA   HIS  76           HA       HIS  76  75.476  -5.978  -0.048
  616    HB2  HIS  76           HB2      HIS  76  75.978  -6.075  -3.029
  617    HB3  HIS  76           HB1      HIS  76  74.917  -7.105  -2.067
  618    HD1  HIS  76           HD1      HIS  76  72.844  -5.742  -0.878
  619    HD2  HIS  76           HD2      HIS  76  74.677  -3.905  -4.140
  620    HE1  HIS  76           HE1      HIS  76  71.238  -3.962  -1.692
  621    H    TRP  77           HN       TRP  77  76.593  -8.170  -0.913
  622    HA   TRP  77           HA       TRP  77  78.508  -9.477  -0.769
  623    HB2  TRP  77           HB2      TRP  77  79.455  -7.107  -2.386
  624    HB3  TRP  77           HB1      TRP  77  80.564  -8.399  -1.948
  625    HD1  TRP  77           HD1      TRP  77  77.000  -9.431  -2.553
  626    HE1  TRP  77           HE1      TRP  77  76.846 -10.726  -4.771
  627    HE3  TRP  77           HE3      TRP  77  81.659  -8.520  -4.434
  628    HZ2  TRP  77           HZ2      TRP  77  78.477 -11.298  -7.053
  629    HZ3  TRP  77           HZ3      TRP  77  82.332  -9.449  -6.631
  630    HH2  TRP  77           HH2      TRP  77  80.748 -10.835  -7.942
  631    H    THR  78           HN       THR  78  80.854  -9.362   0.022
  632    HA   THR  78           HA       THR  78  81.129  -7.375   2.242
  633    HB   THR  78           HB       THR  78  82.235 -10.023   2.899
  634    HG1  THR  78           HG1      THR  78  79.490 -10.167   2.889
  635   HG21  THR  78          HG21      THR  78  80.272  -8.104   4.152
  636   HG22  THR  78          HG22      THR  78  81.833  -8.674   4.754
  637   HG23  THR  78          HG23      THR  78  80.433  -9.745   4.766
  638    H    LEU  79           HN       LEU  79  83.530  -8.307   3.219
  639    HA   LEU  79           HA       LEU  79  85.433  -7.251   1.309
  640    HB2  LEU  79           HB2      LEU  79  85.737  -8.707   3.932
  641    HB3  LEU  79           HB1      LEU  79  87.120  -8.137   3.016
  642    HG   LEU  79           HG       LEU  79  86.434  -5.841   3.269
  643   HD11  LEU  79          HD11      LEU  79  83.911  -7.038   4.414
  644   HD12  LEU  79          HD12      LEU  79  84.056  -5.961   3.022
  645   HD13  LEU  79          HD13      LEU  79  84.349  -5.349   4.647
  646   HD21  LEU  79          HD21      LEU  79  86.230  -5.723   5.832
  647   HD22  LEU  79          HD22      LEU  79  87.625  -6.596   5.196
  648   HD23  LEU  79          HD23      LEU  79  86.231  -7.489   5.807
  649    H    ASP  80           HN       ASP  80  85.077 -10.405   2.885
  650    HA   ASP  80           HA       ASP  80  86.867 -11.974   1.486
  651    HB2  ASP  80           HB2      ASP  80  85.335 -12.736   3.295
  652    HB3  ASP  80           HB1      ASP  80  84.011 -12.747   2.131
  653    H    LYS  81           HN       LYS  81  83.511 -11.345   0.513
  654    HA   LYS  81           HA       LYS  81  83.405 -12.727  -1.871
  655    HB2  LYS  81           HB2      LYS  81  82.342  -9.911  -1.727
  656    HB3  LYS  81           HB1      LYS  81  81.649 -11.308  -2.542
  657    HG2  LYS  81           HG2      LYS  81  81.813 -10.819   0.432
  658    HG3  LYS  81           HG1      LYS  81  80.357 -10.925  -0.558
  659    HD2  LYS  81           HD2      LYS  81  81.053 -13.299  -1.118
  660    HD3  LYS  81           HD1      LYS  81  82.278 -13.154   0.137
  661    HE2  LYS  81           HE2      LYS  81  80.665 -12.913   1.852
  662    HE3  LYS  81           HE1      LYS  81  79.373 -12.559   0.706
  663    HZ1  LYS  81           HZ1      LYS  81  79.173 -14.740   0.109
  664    HZ2  LYS  81           HZ2      LYS  81  79.615 -14.921   1.740
  665    HZ3  LYS  81           HZ3      LYS  81  80.773 -15.129   0.514
  666    H    TYR  82           HN       TYR  82  84.486  -9.362  -1.520
  667    HA   TYR  82           HA       TYR  82  85.475  -9.256  -4.250
  668    HB2  TYR  82           HB2      TYR  82  85.382  -7.447  -1.896
  669    HB3  TYR  82           HB1      TYR  82  86.760  -7.180  -2.956
  670    HD1  TYR  82           HD1      TYR  82  86.217  -7.116  -5.537
  671    HD2  TYR  82           HD2      TYR  82  83.329  -6.426  -2.431
  672    HE1  TYR  82           HE1      TYR  82  84.764  -5.924  -7.153
  673    HE2  TYR  82           HE2      TYR  82  81.876  -5.233  -4.050
  674    HH   TYR  82           HH       TYR  82  82.967  -4.545  -7.338
  675    H    GLY  83           HN       GLY  83  87.000  -9.746  -1.072
  676    HA2  GLY  83           HA2      GLY  83  88.875 -11.414  -1.013
  677    HA3  GLY  83           HA1      GLY  83  89.487 -10.669  -2.492
  678    H    ILE  84           HN       ILE  84  88.146  -8.333  -0.548
  679    HA   ILE  84           HA       ILE  84  90.600  -6.980  -0.062
  680    HB   ILE  84           HB       ILE  84  87.916  -6.697   1.315
  681   HG12  ILE  84          HG12      ILE  84  89.028  -4.898  -0.846
  682   HG13  ILE  84          HG11      ILE  84  88.194  -6.389  -1.274
  683   HG21  ILE  84          HG21      ILE  84  89.552  -5.605   2.671
  684   HG22  ILE  84          HG22      ILE  84  88.804  -4.335   1.709
  685   HG23  ILE  84          HG23      ILE  84  90.394  -4.957   1.265
  686   HD11  ILE  84          HD11      ILE  84  86.166  -5.681  -0.276
  687   HD12  ILE  84          HD12      ILE  84  86.764  -4.248  -1.112
  688   HD13  ILE  84          HD13      ILE  84  86.966  -4.398   0.633
  689    H    GLN  85           HN       GLN  85  91.520  -6.489   2.079
  690    HA   GLN  85           HA       GLN  85  90.922  -8.063   4.399
  691    HB2  GLN  85           HB2      GLN  85  92.141  -9.636   2.581
  692    HB3  GLN  85           HB1      GLN  85  93.578  -8.890   3.267
  693    HG2  GLN  85           HG2      GLN  85  93.360 -10.698   4.715
  694    HG3  GLN  85           HG1      GLN  85  92.380  -9.514   5.577
  695   HE21  GLN  85          HE21      GLN  85  90.060  -9.530   3.964
  696   HE22  GLN  85          HE22      GLN  85  89.323 -11.047   4.079
  697    H    ALA  86           HN       ALA  86  93.493  -8.109   5.549
  698    HA   ALA  86           HA       ALA  86  93.833  -5.339   6.279
  699    HB1  ALA  86           HB1      ALA  86  94.378  -6.992   7.918
  700    HB2  ALA  86           HB2      ALA  86  95.918  -6.288   7.432
  701    HB3  ALA  86           HB3      ALA  86  95.422  -7.854   6.786
  702    H    ASP  87           HN       ASP  87  95.444  -7.503   4.047
  703    HA   ASP  87           HA       ASP  87  97.763  -5.867   3.582
  704    HB2  ASP  87           HB2      ASP  87  97.861  -8.160   2.966
  705    HB3  ASP  87           HB1      ASP  87  96.376  -8.056   2.039
  706    H    ALA  88           HN       ALA  88  94.507  -5.575   2.779
  707    HA   ALA  88           HA       ALA  88  95.000  -3.871   0.388
  708    HB1  ALA  88           HB1      ALA  88  92.349  -3.831   0.618
  709    HB2  ALA  88           HB2      ALA  88  92.656  -5.222   1.660
  710    HB3  ALA  88           HB3      ALA  88  93.168  -5.258  -0.021
  711    H    LYS  89           HN       LYS  89  95.515  -1.760   0.936
  712    HA   LYS  89           HA       LYS  89  94.335  -0.603   3.413
  713    HB2  LYS  89           HB2      LYS  89  96.272   0.847   1.620
  714    HB3  LYS  89           HB1      LYS  89  95.995   1.050   3.348
  715    HG2  LYS  89           HG2      LYS  89  97.160  -1.471   2.142
  716    HG3  LYS  89           HG1      LYS  89  98.132  -0.136   2.719
  717    HD2  LYS  89           HD2      LYS  89  97.586  -0.489   4.958
  718    HD3  LYS  89           HD1      LYS  89  96.081  -1.309   4.567
  719    HE2  LYS  89           HE2      LYS  89  97.763  -2.911   5.375
  720    HE3  LYS  89           HE1      LYS  89  97.320  -3.223   3.696
  721    HZ1  LYS  89           HZ1      LYS  89  99.761  -1.880   4.701
  722    HZ2  LYS  89           HZ2      LYS  89  99.288  -1.838   3.070
  723    HZ3  LYS  89           HZ3      LYS  89  99.661  -3.320   3.811
  724    H    LEU  90           HN       LEU  90  92.500   0.391   3.235
  725    HA   LEU  90           HA       LEU  90  91.639   1.544   0.648
  726    HB2  LEU  90           HB2      LEU  90  89.998   1.586   3.165
  727    HB3  LEU  90           HB1      LEU  90  89.456   1.511   1.491
  728    HG   LEU  90           HG       LEU  90  90.833  -0.677   3.051
  729   HD11  LEU  90          HD11      LEU  90  88.082  -0.543   1.793
  730   HD12  LEU  90          HD12      LEU  90  88.408  -0.314   3.510
  731   HD13  LEU  90          HD13      LEU  90  88.727  -1.874   2.752
  732   HD21  LEU  90          HD21      LEU  90  90.306  -1.999   0.899
  733   HD22  LEU  90          HD22      LEU  90  91.668  -0.881   0.834
  734   HD23  LEU  90          HD23      LEU  90  90.119  -0.424   0.125
  735    H    GLN  91           HN       GLN  91  90.367   3.689   0.993
  736    HA   GLN  91           HA       GLN  91  91.844   5.547   2.809
  737    HB2  GLN  91           HB2      GLN  91  91.048   6.215  -0.038
  738    HB3  GLN  91           HB1      GLN  91  92.034   7.190   1.045
  739    HG2  GLN  91           HG2      GLN  91  93.918   5.831   0.757
  740    HG3  GLN  91           HG1      GLN  91  92.976   4.441   0.270
  741   HE21  GLN  91          HE21      GLN  91  91.886   7.287  -1.204
  742   HE22  GLN  91          HE22      GLN  91  92.625   7.057  -2.705
  743    H    PHE  92           HN       PHE  92  90.544   7.538   3.197
  744    HA   PHE  92           HA       PHE  92  87.612   7.130   2.676
  745    HB2  PHE  92           HB2      PHE  92  87.632   6.877   4.988
  746    HB3  PHE  92           HB1      PHE  92  89.082   7.842   5.182
  747    HD1  PHE  92           HD1      PHE  92  88.400   9.372   6.861
  748    HD2  PHE  92           HD2      PHE  92  85.969   8.849   3.356
  749    HE1  PHE  92           HE1      PHE  92  87.044  11.338   7.510
  750    HE2  PHE  92           HE2      PHE  92  84.616  10.823   4.017
  751    HZ   PHE  92           HZ       PHE  92  85.154  12.067   6.084
  752    H    THR  93           HN       THR  93  87.509   8.379   0.877
  753    HA   THR  93           HA       THR  93  88.103  11.296   1.209
  754    HB   THR  93           HB       THR  93  89.871  10.949  -0.219
  755    HG1  THR  93           HG1      THR  93  88.021  10.324  -2.235
  756   HG21  THR  93          HG21      THR  93  88.496   8.387  -1.064
  757   HG22  THR  93          HG22      THR  93  89.853   8.536   0.051
  758   HG23  THR  93          HG23      THR  93  90.071   8.913  -1.657
  759    HA   PRO  94           HA       PRO  94  84.204  12.442  -0.521
  760    HB2  PRO  94           HB2      PRO  94  85.146  13.529  -3.039
  761    HB3  PRO  94           HB1      PRO  94  84.653  14.412  -1.584
  762    HG2  PRO  94           HG2      PRO  94  87.363  13.674  -2.503
  763    HG3  PRO  94           HG1      PRO  94  86.852  14.997  -1.440
  764    HD2  PRO  94           HD2      PRO  94  88.164  12.862  -0.469
  765    HD3  PRO  94           HD1      PRO  94  86.883  13.652   0.472
  766    H    TYR 541           HT1      TYR 541  48.044  38.502  15.924
  767    HA   TYR 541           HA       TYR 541  49.352  39.446  14.228
  768    HB2  TYR 541           HB2      TYR 541  51.237  37.460  15.157
  769    HB3  TYR 541           HB1      TYR 541  51.030  37.236  13.425
  770    HD1  TYR 541           HD1      TYR 541  52.007  39.647  16.066
  771    HD2  TYR 541           HD2      TYR 541  51.810  38.883  11.844
  772    HE1  TYR 541           HE1      TYR 541  53.462  41.611  15.643
  773    HE2  TYR 541           HE2      TYR 541  53.266  40.846  11.420
  774    HH   TYR 541           HH       TYR 541  53.790  43.056  12.701
  775    H    HIS 542           HN       HIS 542  49.896  37.875  11.918
  776    HA   HIS 542           HA       HIS 542  47.178  37.157  11.181
  777    HB2  HIS 542           HB2      HIS 542  49.849  37.138   9.771
  778    HB3  HIS 542           HB1      HIS 542  48.412  36.465   9.011
  779    HD1  HIS 542           HD1      HIS 542  47.655  38.189   7.364
  780    HD2  HIS 542           HD2      HIS 542  48.705  39.900  11.017
  781    HE1  HIS 542           HE1      HIS 542  47.083  40.650   7.193
  782    H    GLU 543           HN       GLU 543  50.107  35.212  10.591
  783    HA   GLU 543           HA       GLU 543  49.076  32.921  12.095
  784    HB2  GLU 543           HB2      GLU 543  48.984  31.495   9.973
  785    HB3  GLU 543           HB1      GLU 543  47.657  32.641  10.182
  786    HG2  GLU 543           HG2      GLU 543  48.439  34.078   8.521
  787    HG3  GLU 543           HG1      GLU 543  50.119  33.565   8.712
  788    H    ARG 544           HN       ARG 544  51.576  34.655  11.343
  789    HA   ARG 544           HA       ARG 544  53.866  34.337  11.067
  790    HB2  ARG 544           HB2      ARG 544  52.924  31.864  12.491
  791    HB3  ARG 544           HB1      ARG 544  54.629  32.132  12.157
  792    HG2  ARG 544           HG2      ARG 544  54.194  32.990  14.370
  793    HG3  ARG 544           HG1      ARG 544  54.422  34.365  13.305
  794    HD2  ARG 544           HD2      ARG 544  52.212  35.010  13.413
  795    HD3  ARG 544           HD1      ARG 544  51.613  33.369  13.593
  796    HE   ARG 544           HE       ARG 544  52.147  35.265  15.698
  797   HH11  ARG 544          HH11      ARG 544  52.382  34.650  17.840
  798   HH12  ARG 544          HH12      ARG 544  52.660  32.984  18.225
  799   HH21  ARG 544          HH21      ARG 544  52.590  31.929  14.927
  800   HH22  ARG 544          HH22      ARG 544  52.779  31.447  16.579
  801    H    ARG 545           HN       ARG 545  54.019  34.289   8.839
  802    HA   ARG 545           HA       ARG 545  53.211  32.382   7.024
  803    HB2  ARG 545           HB2      ARG 545  55.815  33.141   6.118
  804    HB3  ARG 545           HB1      ARG 545  54.273  33.842   5.642
  805    HG2  ARG 545           HG2      ARG 545  55.697  34.713   8.168
  806    HG3  ARG 545           HG1      ARG 545  56.046  35.434   6.602
  807    HD2  ARG 545           HD2      ARG 545  53.191  35.235   7.542
  808    HD3  ARG 545           HD1      ARG 545  54.224  36.545   8.112
  809    HE   ARG 545           HE       ARG 545  54.558  36.575   5.357
  810   HH11  ARG 545          HH11      ARG 545  53.249  37.807   3.987
  811   HH12  ARG 545          HH12      ARG 545  51.657  38.254   4.504
  812   HH21  ARG 545          HH21      ARG 545  51.919  36.662   7.574
  813   HH22  ARG 545          HH22      ARG 545  50.904  37.606   6.535
  814    H    GLY 546           HN       GLY 546  56.263  32.243   8.894
  815    HA2  GLY 546           HA2      GLY 546  56.980  29.697   7.674
  816    HA3  GLY 546           HA1      GLY 546  57.809  30.468   9.024
  817    H    SER 547           HN       SER 547  57.888  28.919  10.517
  818    HA   SER 547           HA       SER 547  55.491  28.107  11.933
  819    HB2  SER 547           HB2      SER 547  56.838  26.240  10.010
  820    HB3  SER 547           HB1      SER 547  56.305  25.572  11.551
  821    HG   SER 547           HG       SER 547  54.488  25.439  10.451
  822    H    LEU 548           HN       LEU 548  56.284  28.240  14.014
  823    HA   LEU 548           HA       LEU 548  59.031  28.500  14.544
  824    HB2  LEU 548           HB2      LEU 548  56.579  28.164  16.168
  825    HB3  LEU 548           HB1      LEU 548  58.055  27.658  16.980
  826    HG   LEU 548           HG       LEU 548  59.056  29.911  16.300
  827   HD11  LEU 548          HD11      LEU 548  56.190  30.322  15.464
  828   HD12  LEU 548          HD12      LEU 548  57.659  30.638  14.548
  829   HD13  LEU 548          HD13      LEU 548  57.229  31.676  15.900
  830   HD21  LEU 548          HD21      LEU 548  56.602  30.232  18.012
  831   HD22  LEU 548          HD22      LEU 548  58.165  31.039  18.162
  832   HD23  LEU 548          HD23      LEU 548  58.012  29.330  18.569
  833    H    CYS 549           HN       CYS 549  60.676  27.104  14.941
  834    HA   CYS 549           HA       CYS 549  60.146  24.232  14.549
  835    HB2  CYS 549           HB2      CYS 549  62.155  24.917  13.510
  836    HB3  CYS 549           HB1      CYS 549  62.583  25.989  14.830
  837    H    SER 550           HN       SER 550  59.183  23.419  16.334
  838    HA   SER 550           HA       SER 550  59.335  24.341  18.949
  839    HB2  SER 550           HB2      SER 550  57.670  22.754  18.477
  840    HB3  SER 550           HB1      SER 550  58.828  21.554  17.918
  841    HG   SER 550           HG       SER 550  59.525  22.267  20.366
  842    H    GLY 551           HN       GLY 551  60.816  24.421  20.403
  843    HA2  GLY 551           HA2      GLY 551  62.630  23.351  21.724
  844    HA3  GLY 551           HA1      GLY 551  63.226  22.648  20.213
  845    H    CYS 552           HN       CYS 552  62.662  24.943  18.633
  846    HA   CYS 552           HA       CYS 552  64.887  26.749  19.480
  847    HB2  CYS 552           HB2      CYS 552  63.675  25.894  16.862
  848    HB3  CYS 552           HB1      CYS 552  64.528  27.425  16.962
  849    H    GLN 553           HN       GLN 553  61.571  26.507  18.368
  850    HA   GLN 553           HA       GLN 553  59.850  28.009  18.288
  851    HB2  GLN 553           HB2      GLN 553  61.339  29.169  20.626
  852    HB3  GLN 553           HB1      GLN 553  59.710  29.650  20.144
  853    HG2  GLN 553           HG2      GLN 553  60.513  26.803  20.744
  854    HG3  GLN 553           HG1      GLN 553  59.755  27.863  21.914
  855   HE21  GLN 553          HE21      GLN 553  59.245  26.193  18.835
  856   HE22  GLN 553          HE22      GLN 553  57.548  26.235  18.884
  857    H    LYS 554           HN       LYS 554  61.302  28.419  16.354
  858    HA   LYS 554           HA       LYS 554  61.379  31.359  15.976
  859    HB2  LYS 554           HB2      LYS 554  63.577  29.468  15.086
  860    HB3  LYS 554           HB1      LYS 554  63.472  31.165  14.636
  861    HG2  LYS 554           HG2      LYS 554  63.636  30.177  17.494
  862    HG3  LYS 554           HG1      LYS 554  65.027  30.714  16.560
  863    HD2  LYS 554           HD2      LYS 554  63.600  32.892  16.184
  864    HD3  LYS 554           HD1      LYS 554  62.700  32.325  17.588
  865    HE2  LYS 554           HE2      LYS 554  65.698  32.760  17.507
  866    HE3  LYS 554           HE1      LYS 554  64.531  33.862  18.239
  867    HZ1  LYS 554           HZ1      LYS 554  65.749  31.736  19.460
  868    HZ2  LYS 554           HZ2      LYS 554  64.174  31.182  19.144
  869    HZ3  LYS 554           HZ3      LYS 554  64.414  32.602  20.046
  870    HA   PRO 555           HA       PRO 555  58.680  29.848  12.658
  871    HB2  PRO 555           HB2      PRO 555  59.757  32.189  11.178
  872    HB3  PRO 555           HB1      PRO 555  58.073  31.699  11.427
  873    HG2  PRO 555           HG2      PRO 555  59.259  33.751  12.812
  874    HG3  PRO 555           HG1      PRO 555  57.939  32.782  13.475
  875    HD2  PRO 555           HD2      PRO 555  60.784  32.820  14.286
  876    HD3  PRO 555           HD1      PRO 555  59.387  32.139  15.154
  877    H    ILE 556           HN       ILE 556  59.020  28.400  11.137
  878    HA   ILE 556           HA       ILE 556  61.725  28.012  10.000
  879    HB   ILE 556           HB       ILE 556  59.171  26.368   9.945
  880   HG12  ILE 556          HG12      ILE 556  61.785  25.514  11.178
  881   HG13  ILE 556          HG11      ILE 556  60.760  26.613  12.075
  882   HG21  ILE 556          HG21      ILE 556  61.876  25.889   8.699
  883   HG22  ILE 556          HG22      ILE 556  60.301  25.902   7.905
  884   HG23  ILE 556          HG23      ILE 556  60.720  24.602   9.017
  885   HD11  ILE 556          HD11      ILE 556  60.520  23.903  12.202
  886   HD12  ILE 556          HD12      ILE 556  59.366  24.244  10.918
  887   HD13  ILE 556          HD13      ILE 556  59.178  25.000  12.500
  888    H    THR 557           HN       THR 557  61.894  29.578   8.359
  889    HA   THR 557           HA       THR 557  59.658  29.830   6.409
  890    HB   THR 557           HB       THR 557  60.570  31.918   5.833
  891    HG1  THR 557           HG1      THR 557  62.903  30.663   6.531
  892   HG21  THR 557          HG21      THR 557  60.767  33.035   7.945
  893   HG22  THR 557          HG22      THR 557  61.372  31.573   8.727
  894   HG23  THR 557          HG23      THR 557  59.690  31.660   8.204
  895    H    GLY 558           HN       GLY 558  59.939  27.972   5.194
  896    HA2  GLY 558           HA2      GLY 558  61.226  27.970   2.807
  897    HA3  GLY 558           HA1      GLY 558  62.492  27.364   3.885
  898    H    ARG 559           HN       ARG 559  62.281  25.338   4.776
  899    HA   ARG 559           HA       ARG 559  59.974  23.661   3.868
  900    HB2  ARG 559           HB2      ARG 559  62.927  23.143   4.162
  901    HB3  ARG 559           HB1      ARG 559  61.813  21.801   4.417
  902    HG2  ARG 559           HG2      ARG 559  61.513  23.531   1.970
  903    HG3  ARG 559           HG1      ARG 559  62.763  22.290   2.000
  904    HD2  ARG 559           HD2      ARG 559  61.196  20.540   2.217
  905    HD3  ARG 559           HD1      ARG 559  59.917  21.628   2.754
  906    HE   ARG 559           HE       ARG 559  60.498  22.505   0.192
  907   HH11  ARG 559          HH11      ARG 559  59.447  21.693  -1.637
  908   HH12  ARG 559          HH12      ARG 559  58.749  20.108  -1.586
  909   HH21  ARG 559          HH21      ARG 559  59.694  19.507   1.694
  910   HH22  ARG 559          HH22      ARG 559  58.888  18.873   0.298
  911    H    CYS 560           HN       CYS 560  59.118  22.225   5.515
  912    HA   CYS 560           HA       CYS 560  60.214  22.589   8.244
  913    HB2  CYS 560           HB2      CYS 560  57.988  23.101   9.171
  914    HB3  CYS 560           HB1      CYS 560  58.557  24.362   8.072
  915    HG   CYS 560           HG       CYS 560  56.972  22.480   6.416
  916    H    ILE 561           HN       ILE 561  60.330  20.800   9.269
  917    HA   ILE 561           HA       ILE 561  58.868  18.426   8.306
  918    HB   ILE 561           HB       ILE 561  61.018  18.829  10.407
  919   HG12  ILE 561          HG12      ILE 561  60.994  17.751   7.592
  920   HG13  ILE 561          HG11      ILE 561  61.757  19.239   8.126
  921   HG21  ILE 561          HG21      ILE 561  59.483  16.821  10.802
  922   HG22  ILE 561          HG22      ILE 561  61.180  16.432  10.545
  923   HG23  ILE 561          HG23      ILE 561  60.026  16.228   9.234
  924   HD11  ILE 561          HD11      ILE 561  63.139  17.810   9.707
  925   HD12  ILE 561          HD12      ILE 561  63.506  17.615   7.993
  926   HD13  ILE 561          HD13      ILE 561  62.529  16.403   8.831
  927    H    THR 562           HN       THR 562  57.475  17.327   9.608
  928    HA   THR 562           HA       THR 562  56.527  18.728  12.077
  929    HB   THR 562           HB       THR 562  54.779  16.971  10.371
  930    HG1  THR 562           HG1      THR 562  54.320  18.635   9.148
  931   HG21  THR 562          HG21      THR 562  53.000  17.955  11.632
  932   HG22  THR 562          HG22      THR 562  54.071  19.193  12.290
  933   HG23  THR 562          HG23      THR 562  54.245  17.513  12.804
  934    H    ALA 563           HN       ALA 563  56.033  17.483  13.822
  935    HA   ALA 563           HA       ALA 563  56.891  14.622  13.703
  936    HB1  ALA 563           HB1      ALA 563  58.499  16.187  14.819
  937    HB2  ALA 563           HB2      ALA 563  57.879  14.919  15.887
  938    HB3  ALA 563           HB3      ALA 563  57.235  16.560  15.993
  939    H    MET 564           HN       MET 564  56.129  15.071  16.728
  940    HA   MET 564           HA       MET 564  53.606  13.720  16.626
  941    HB2  MET 564           HB2      MET 564  54.532  15.325  18.996
  942    HB3  MET 564           HB1      MET 564  53.722  13.757  18.964
  943    HG2  MET 564           HG2      MET 564  55.857  12.892  17.788
  944    HG3  MET 564           HG1      MET 564  56.598  14.397  18.327
  945    HE1  MET 564           HE1      MET 564  54.420  11.408  19.418
  946    HE2  MET 564           HE2      MET 564  55.390  10.732  20.724
  947    HE3  MET 564           HE3      MET 564  56.058  10.822  19.096
  948    H    ALA 565           HN       ALA 565  53.885  16.303  15.269
  949    HA   ALA 565           HA       ALA 565  52.024  17.729  14.636
  950    HB1  ALA 565           HB1      ALA 565  50.558  18.704  16.263
  951    HB2  ALA 565           HB2      ALA 565  51.557  18.146  17.601
  952    HB3  ALA 565           HB3      ALA 565  50.632  16.985  16.639
  953    H    LYS 566           HN       LYS 566  54.747  17.758  16.544
  954    HA   LYS 566           HA       LYS 566  54.978  20.681  16.810
  955    HB2  LYS 566           HB2      LYS 566  56.613  18.277  17.511
  956    HB3  LYS 566           HB1      LYS 566  57.505  19.769  17.241
  957    HG2  LYS 566           HG2      LYS 566  56.377  20.899  18.985
  958    HG3  LYS 566           HG1      LYS 566  55.104  19.684  19.068
  959    HD2  LYS 566           HD2      LYS 566  57.946  18.820  19.563
  960    HD3  LYS 566           HD1      LYS 566  57.096  19.689  20.834
  961    HE2  LYS 566           HE2      LYS 566  55.484  18.000  21.092
  962    HE3  LYS 566           HE1      LYS 566  55.750  17.359  19.466
  963    HZ1  LYS 566           HZ1      LYS 566  57.933  16.591  20.178
  964    HZ2  LYS 566           HZ2      LYS 566  56.708  15.916  21.143
  965    HZ3  LYS 566           HZ3      LYS 566  57.659  17.190  21.741
  966    H    LYS 567           HN       LYS 567  56.796  21.822  15.714
  967    HA   LYS 567           HA       LYS 567  57.179  20.794  12.930
  968    HB2  LYS 567           HB2      LYS 567  57.815  23.589  13.806
  969    HB3  LYS 567           HB1      LYS 567  57.325  23.022  12.223
  970    HG2  LYS 567           HG2      LYS 567  55.554  23.177  14.687
  971    HG3  LYS 567           HG1      LYS 567  55.490  24.252  13.301
  972    HD2  LYS 567           HD2      LYS 567  54.954  21.253  13.189
  973    HD3  LYS 567           HD1      LYS 567  53.722  22.515  13.195
  974    HE2  LYS 567           HE2      LYS 567  54.983  23.472  11.138
  975    HE3  LYS 567           HE1      LYS 567  55.737  21.882  11.056
  976    HZ1  LYS 567           HZ1      LYS 567  53.845  20.918  10.393
  977    HZ2  LYS 567           HZ2      LYS 567  53.399  22.488   9.922
  978    HZ3  LYS 567           HZ3      LYS 567  52.869  21.862  11.409
  979    H    PHE 568           HN       PHE 568  59.485  21.624  12.059
  980    HA   PHE 568           HA       PHE 568  61.514  21.711  14.184
  981    HB2  PHE 568           HB2      PHE 568  60.700  19.165  12.982
  982    HB3  PHE 568           HB1      PHE 568  62.410  19.446  12.716
  983    HD1  PHE 568           HD1      PHE 568  59.839  18.584  15.132
  984    HD2  PHE 568           HD2      PHE 568  63.899  19.924  14.715
  985    HE1  PHE 568           HE1      PHE 568  60.299  17.919  17.476
  986    HE2  PHE 568           HE2      PHE 568  64.359  19.258  17.059
  987    HZ   PHE 568           HZ       PHE 568  62.560  18.255  18.440
  988    H    HIS 569           HN       HIS 569  63.330  22.681  13.431
  989    HA   HIS 569           HA       HIS 569  63.447  23.847  10.855
  990    HB2  HIS 569           HB2      HIS 569  65.477  23.205  12.958
  991    HB3  HIS 569           HB1      HIS 569  66.052  23.731  11.388
  992    HD2  HIS 569           HD2      HIS 569  64.510  26.325  10.660
  993    HE1  HIS 569           HE1      HIS 569  64.785  27.524  14.692
  994    HA   PRO 570           HA       PRO 570  63.901  19.807   8.749
  995    HB2  PRO 570           HB2      PRO 570  65.090  21.534   6.616
  996    HB3  PRO 570           HB1      PRO 570  63.803  20.322   6.495
  997    HG2  PRO 570           HG2      PRO 570  63.296  23.003   6.455
  998    HG3  PRO 570           HG1      PRO 570  62.149  21.823   7.099
  999    HD2  PRO 570           HD2      PRO 570  63.792  23.806   8.565
 1000    HD3  PRO 570           HD1      PRO 570  62.315  22.956   9.084
 1001    H    GLU 571           HN       GLU 571  66.291  22.024   9.729
 1002    HA   GLU 571           HA       GLU 571  68.565  20.301   8.911
 1003    HB2  GLU 571           HB2      GLU 571  68.827  22.876  10.447
 1004    HB3  GLU 571           HB1      GLU 571  69.939  22.157   9.285
 1005    HG2  GLU 571           HG2      GLU 571  68.124  22.528   7.529
 1006    HG3  GLU 571           HG1      GLU 571  67.306  23.520   8.742
 1007    H    HIS 572           HN       HIS 572  67.326  21.928  11.828
 1008    HA   HIS 572           HA       HIS 572  69.069  20.586  13.632
 1009    HB2  HIS 572           HB2      HIS 572  66.256  21.540  14.263
 1010    HB3  HIS 572           HB1      HIS 572  67.589  21.351  15.403
 1011    HD2  HIS 572           HD2      HIS 572  69.723  22.732  13.021
 1012    HE1  HIS 572           HE1      HIS 572  67.622  26.240  14.025
 1013    H    PHE 573           HN       PHE 573  66.806  19.226  11.670
 1014    HA   PHE 573           HA       PHE 573  66.681  16.777  13.388
 1015    HB2  PHE 573           HB2      PHE 573  64.483  18.145  13.202
 1016    HB3  PHE 573           HB1      PHE 573  64.454  17.592  11.536
 1017    HD1  PHE 573           HD1      PHE 573  64.903  16.265  15.010
 1018    HD2  PHE 573           HD2      PHE 573  63.446  15.525  11.036
 1019    HE1  PHE 573           HE1      PHE 573  63.978  14.088  15.754
 1020    HE2  PHE 573           HE2      PHE 573  62.521  13.348  11.781
 1021    HZ   PHE 573           HZ       PHE 573  62.787  12.629  14.140
 1022    H    VAL 574           HN       VAL 574  68.683  16.896  11.754
 1023    HA   VAL 574           HA       VAL 574  68.024  15.951   9.047
 1024    HB   VAL 574           HB       VAL 574  70.555  15.922   8.819
 1025   HG11  VAL 574          HG11      VAL 574  70.124  18.706   9.589
 1026   HG12  VAL 574          HG12      VAL 574  68.743  18.080   8.696
 1027   HG13  VAL 574          HG13      VAL 574  70.348  18.019   8.005
 1028   HG21  VAL 574          HG21      VAL 574  70.943  15.675  11.281
 1029   HG22  VAL 574          HG22      VAL 574  70.386  17.343  11.503
 1030   HG23  VAL 574          HG23      VAL 574  71.844  17.014  10.570
 1031    H    CYS 575           HN       CYS 575  69.642  14.107   8.293
 1032    HA   CYS 575           HA       CYS 575  69.088  11.700   9.860
 1033    HB2  CYS 575           HB2      CYS 575  69.229  10.891   7.732
 1034    HB3  CYS 575           HB1      CYS 575  70.002  12.373   7.184
 1035    H    ALA 576           HN       ALA 576  70.681  10.448  11.061
 1036    HA   ALA 576           HA       ALA 576  73.078  12.141  11.732
 1037    HB1  ALA 576           HB1      ALA 576  72.020  11.365  13.692
 1038    HB2  ALA 576           HB2      ALA 576  73.370  10.246  13.489
 1039    HB3  ALA 576           HB3      ALA 576  71.739   9.758  13.021
 1040    H    PHE 577           HN       PHE 577  73.877  11.639   9.567
 1041    HA   PHE 577           HA       PHE 577  75.943   9.611   9.712
 1042    HB2  PHE 577           HB2      PHE 577  74.090   8.396   8.454
 1043    HB3  PHE 577           HB1      PHE 577  74.150   9.665   7.244
 1044    HD1  PHE 577           HD1      PHE 577  74.492   7.183   6.082
 1045    HD2  PHE 577           HD2      PHE 577  77.547   9.344   8.237
 1046    HE1  PHE 577           HE1      PHE 577  76.252   5.949   4.881
 1047    HE2  PHE 577           HE2      PHE 577  79.260   8.077   7.032
 1048    HZ   PHE 577           HZ       PHE 577  78.630   6.387   5.355
 1049    H    CYS 578           HN       CYS 578  74.167  11.591   7.501
 1050    HA   CYS 578           HA       CYS 578  76.453  13.457   7.054
 1051    HB2  CYS 578           HB2      CYS 578  75.448  13.875   4.825
 1052    HB3  CYS 578           HB1      CYS 578  75.859  12.173   5.006
 1053    H    LEU 579           HN       LEU 579  75.636  14.525   8.930
 1054    HA   LEU 579           HA       LEU 579  73.056  15.297   9.557
 1055    HB2  LEU 579           HB2      LEU 579  75.627  16.756   9.965
 1056    HB3  LEU 579           HB1      LEU 579  74.138  17.167  10.788
 1057    HG   LEU 579           HG       LEU 579  74.549  14.310  11.082
 1058   HD11  LEU 579          HD11      LEU 579  76.667  14.103  12.101
 1059   HD12  LEU 579          HD12      LEU 579  76.894  15.847  12.203
 1060   HD13  LEU 579          HD13      LEU 579  76.988  15.034  10.638
 1061   HD21  LEU 579          HD21      LEU 579  74.960  16.418  13.212
 1062   HD22  LEU 579          HD22      LEU 579  74.370  14.771  13.415
 1063   HD23  LEU 579          HD23      LEU 579  73.358  15.976  12.621
 1064    H    LYS 580           HN       LYS 580  73.950  16.055   6.510
 1065    HA   LYS 580           HA       LYS 580  73.415  18.949   6.690
 1066    HB2  LYS 580           HB2      LYS 580  74.152  19.113   4.516
 1067    HB3  LYS 580           HB1      LYS 580  74.937  17.612   4.974
 1068    HG2  LYS 580           HG2      LYS 580  72.275  17.747   3.498
 1069    HG3  LYS 580           HG1      LYS 580  73.837  17.540   2.726
 1070    HD2  LYS 580           HD2      LYS 580  74.178  15.416   3.639
 1071    HD3  LYS 580           HD1      LYS 580  73.021  15.681   4.935
 1072    HE2  LYS 580           HE2      LYS 580  72.273  14.147   3.016
 1073    HE3  LYS 580           HE1      LYS 580  71.169  15.435   3.495
 1074    HZ1  LYS 580           HZ1      LYS 580  71.603  15.175   1.036
 1075    HZ2  LYS 580           HZ2      LYS 580  73.158  15.790   1.336
 1076    HZ3  LYS 580           HZ3      LYS 580  71.787  16.737   1.669
 1077    H    GLN 581           HN       GLN 581  71.417  16.102   5.603
 1078    HA   GLN 581           HA       GLN 581  69.115  17.786   6.120
 1079    HB2  GLN 581           HB2      GLN 581  69.844  18.575   3.885
 1080    HB3  GLN 581           HB1      GLN 581  69.445  16.985   3.241
 1081    HG2  GLN 581           HG2      GLN 581  67.517  18.332   2.877
 1082    HG3  GLN 581           HG1      GLN 581  67.112  17.342   4.262
 1083   HE21  GLN 581          HE21      GLN 581  67.456  18.432   6.462
 1084   HE22  GLN 581          HE22      GLN 581  67.224  20.105   6.544
 1085    H    LEU 582           HN       LEU 582  67.231  16.784   6.412
 1086    HA   LEU 582           HA       LEU 582  66.856  13.989   5.519
 1087    HB2  LEU 582           HB2      LEU 582  67.714  14.130   7.910
 1088    HB3  LEU 582           HB1      LEU 582  66.175  14.865   8.324
 1089    HG   LEU 582           HG       LEU 582  65.018  12.851   7.463
 1090   HD11  LEU 582          HD11      LEU 582  66.897  10.842   7.336
 1091   HD12  LEU 582          HD12      LEU 582  67.765  12.175   6.574
 1092   HD13  LEU 582          HD13      LEU 582  66.211  11.655   5.933
 1093   HD21  LEU 582          HD21      LEU 582  67.053  12.703   9.672
 1094   HD22  LEU 582          HD22      LEU 582  66.112  11.265   9.274
 1095   HD23  LEU 582          HD23      LEU 582  65.295  12.747   9.766
 1096    H    ASN 583           HN       ASN 583  64.471  13.379   5.841
 1097    HA   ASN 583           HA       ASN 583  62.609  15.676   6.015
 1098    HB2  ASN 583           HB2      ASN 583  63.198  14.143   3.485
 1099    HB3  ASN 583           HB1      ASN 583  61.573  14.762   3.755
 1100   HD21  ASN 583          HD21      ASN 583  62.956  15.798   1.620
 1101   HD22  ASN 583          HD22      ASN 583  63.451  17.383   1.949
 1102    H    LYS 584           HN       LYS 584  60.672  15.007   6.887
 1103    HA   LYS 584           HA       LYS 584  60.330  12.476   8.059
 1104    HB2  LYS 584           HB2      LYS 584  57.874  13.081   8.052
 1105    HB3  LYS 584           HB1      LYS 584  58.937  14.316   8.726
 1106    HG2  LYS 584           HG2      LYS 584  58.579  15.794   6.981
 1107    HG3  LYS 584           HG1      LYS 584  58.450  14.512   5.775
 1108    HD2  LYS 584           HD2      LYS 584  56.284  15.545   5.991
 1109    HD3  LYS 584           HD1      LYS 584  56.196  13.948   6.720
 1110    HE2  LYS 584           HE2      LYS 584  55.128  15.323   8.307
 1111    HE3  LYS 584           HE1      LYS 584  56.764  15.173   8.948
 1112    HZ1  LYS 584           HZ1      LYS 584  57.303  17.268   7.773
 1113    HZ2  LYS 584           HZ2      LYS 584  56.136  17.456   8.994
 1114    HZ3  LYS 584           HZ3      LYS 584  55.665  17.427   7.363
 1115    H    GLY 585           HN       GLY 585  60.012  13.436   4.782
 1116    HA2  GLY 585           HA2      GLY 585  58.299  11.162   4.034
 1117    HA3  GLY 585           HA1      GLY 585  58.962  12.378   2.942
 1118    H    THR 586           HN       THR 586  61.590  11.913   4.407
 1119    HA   THR 586           HA       THR 586  62.352   9.282   3.220
 1120    HB   THR 586           HB       THR 586  64.073  10.188   1.941
 1121    HG1  THR 586           HG1      THR 586  64.915  11.334   3.806
 1122   HG21  THR 586          HG21      THR 586  63.203  12.082   0.715
 1123   HG22  THR 586          HG22      THR 586  62.185  12.554   2.078
 1124   HG23  THR 586          HG23      THR 586  61.836  11.071   1.190
 1125    H    PHE 587           HN       PHE 587  61.887  10.395   5.989
 1126    HA   PHE 587           HA       PHE 587  64.630  10.284   7.121
 1127    HB2  PHE 587           HB2      PHE 587  63.781  11.091   9.132
 1128    HB3  PHE 587           HB1      PHE 587  62.786  11.899   7.945
 1129    HD1  PHE 587           HD1      PHE 587  62.508  10.650  11.040
 1130    HD2  PHE 587           HD2      PHE 587  60.769   9.945   7.177
 1131    HE1  PHE 587           HE1      PHE 587  60.482   9.716  12.117
 1132    HE2  PHE 587           HE2      PHE 587  58.748   9.012   8.254
 1133    HZ   PHE 587           HZ       PHE 587  58.603   8.896  10.725
 1134    H    LYS 588           HN       LYS 588  65.444   8.355   7.306
 1135    HA   LYS 588           HA       LYS 588  63.770   6.049   8.178
 1136    HB2  LYS 588           HB2      LYS 588  65.620   6.396   6.075
 1137    HB3  LYS 588           HB1      LYS 588  66.509   5.513   7.270
 1138    HG2  LYS 588           HG2      LYS 588  65.341   4.084   5.561
 1139    HG3  LYS 588           HG1      LYS 588  65.003   3.675   7.229
 1140    HD2  LYS 588           HD2      LYS 588  63.055   3.737   5.482
 1141    HD3  LYS 588           HD1      LYS 588  62.786   4.380   7.082
 1142    HE2  LYS 588           HE2      LYS 588  62.678   6.572   6.310
 1143    HE3  LYS 588           HE1      LYS 588  63.761   6.262   4.973
 1144    HZ1  LYS 588           HZ1      LYS 588  60.897   5.877   5.161
 1145    HZ2  LYS 588           HZ2      LYS 588  61.758   4.687   4.308
 1146    HZ3  LYS 588           HZ3      LYS 588  61.849   6.314   3.827
 1147    H    GLU 589           HN       GLU 589  65.084   4.490   9.668
 1148    HA   GLU 589           HA       GLU 589  67.077   5.885  11.347
 1149    HB2  GLU 589           HB2      GLU 589  65.236   6.715  12.517
 1150    HB3  GLU 589           HB1      GLU 589  64.272   5.269  12.253
 1151    HG2  GLU 589           HG2      GLU 589  65.526   4.041  13.889
 1152    HG3  GLU 589           HG1      GLU 589  66.771   5.292  13.980
 1153    H    GLN 590           HN       GLN 590  68.063   4.543  12.857
 1154    HA   GLN 590           HA       GLN 590  67.536   1.688  12.939
 1155    HB2  GLN 590           HB2      GLN 590  69.048   2.311  10.816
 1156    HB3  GLN 590           HB1      GLN 590  70.316   2.405  12.023
 1157    HG2  GLN 590           HG2      GLN 590  70.471   0.156  11.475
 1158    HG3  GLN 590           HG1      GLN 590  69.315   0.071  12.802
 1159   HE21  GLN 590          HE21      GLN 590  69.796  -1.197   9.817
 1160   HE22  GLN 590          HE22      GLN 590  68.190  -1.393   9.305
 1161    H    ASN 591           HN       ASN 591  68.585   0.820  14.805
 1162    HA   ASN 591           HA       ASN 591  69.316   1.037  17.012
 1163    HB2  ASN 591           HB2      ASN 591  71.591   2.665  16.826
 1164    HB3  ASN 591           HB1      ASN 591  71.564   0.923  16.654
 1165   HD21  ASN 591          HD21      ASN 591  70.538   0.455  14.210
 1166   HD22  ASN 591          HD22      ASN 591  71.415   1.239  12.991
 1167    H    ASP 592           HN       ASP 592  67.489   3.182  15.884
 1168    HA   ASP 592           HA       ASP 592  66.323   4.922  16.960
 1169    HB2  ASP 592           HB2      ASP 592  68.596   5.360  18.879
 1170    HB3  ASP 592           HB1      ASP 592  66.873   5.636  19.116
 1171    H    LYS 593           HN       LYS 593  69.351   5.104  15.538
 1172    HA   LYS 593           HA       LYS 593  69.642   8.012  15.766
 1173    HB2  LYS 593           HB2      LYS 593  71.131   6.039  14.060
 1174    HB3  LYS 593           HB1      LYS 593  71.622   7.679  14.436
 1175    HG2  LYS 593           HG2      LYS 593  71.461   6.847  16.929
 1176    HG3  LYS 593           HG1      LYS 593  71.601   5.247  16.202
 1177    HD2  LYS 593           HD2      LYS 593  73.639   6.092  14.955
 1178    HD3  LYS 593           HD1      LYS 593  73.553   7.550  15.940
 1179    HE2  LYS 593           HE2      LYS 593  73.677   4.784  17.162
 1180    HE3  LYS 593           HE1      LYS 593  75.133   5.704  16.764
 1181    HZ1  LYS 593           HZ1      LYS 593  74.405   7.472  18.195
 1182    HZ2  LYS 593           HZ2      LYS 593  74.387   6.018  19.075
 1183    HZ3  LYS 593           HZ3      LYS 593  72.933   6.688  18.505
 1184    HA   PRO 594           HA       PRO 594  66.841   8.479  12.159
 1185    HB2  PRO 594           HB2      PRO 594  68.345  11.032  11.856
 1186    HB3  PRO 594           HB1      PRO 594  66.604  10.765  11.932
 1187    HG2  PRO 594           HG2      PRO 594  68.048  11.830  13.991
 1188    HG3  PRO 594           HG1      PRO 594  66.569  10.889  14.238
 1189    HD2  PRO 594           HD2      PRO 594  69.380  10.122  14.815
 1190    HD3  PRO 594           HD1      PRO 594  67.869   9.437  15.464
 1191    H    TYR 595           HN       TYR 595  67.203   8.736   9.771
 1192    HA   TYR 595           HA       TYR 595  69.908   8.823   8.697
 1193    HB2  TYR 595           HB2      TYR 595  68.502   6.163   9.014
 1194    HB3  TYR 595           HB1      TYR 595  69.696   6.410   7.753
 1195    HD1  TYR 595           HD1      TYR 595  69.308   5.037  10.884
 1196    HD2  TYR 595           HD2      TYR 595  71.922   7.705   8.768
 1197    HE1  TYR 595           HE1      TYR 595  71.150   4.469  12.432
 1198    HE2  TYR 595           HE2      TYR 595  73.759   7.134  10.340
 1199    HH   TYR 595           HH       TYR 595  74.029   4.663  12.023
 1200    H    CYS 596           HN       CYS 596  69.775   9.202   6.446
 1201    HA   CYS 596           HA       CYS 596  67.115   9.494   5.260
 1202    HB2  CYS 596           HB2      CYS 596  69.617   9.233   3.584
 1203    HB3  CYS 596           HB1      CYS 596  68.193  10.218   3.296
 1204    H    GLN 597           HN       GLN 597  66.293   8.021   3.545
 1205    HA   GLN 597           HA       GLN 597  66.762   5.279   4.164
 1206    HB2  GLN 597           HB2      GLN 597  64.729   5.591   3.050
 1207    HB3  GLN 597           HB1      GLN 597  65.396   6.772   1.959
 1208    HG2  GLN 597           HG2      GLN 597  65.084   4.967   0.517
 1209    HG3  GLN 597           HG1      GLN 597  66.740   4.694   1.018
 1210   HE21  GLN 597          HE21      GLN 597  65.720   3.931   3.788
 1211   HE22  GLN 597          HE22      GLN 597  65.159   2.356   3.607
 1212    H    ASN 598           HN       ASN 598  67.791   7.217   1.359
 1213    HA   ASN 598           HA       ASN 598  69.571   5.463   0.154
 1214    HB2  ASN 598           HB2      ASN 598  70.444   8.315   0.509
 1215    HB3  ASN 598           HB1      ASN 598  70.445   7.322  -0.941
 1216   HD21  ASN 598          HD21      ASN 598  67.950   6.505  -1.316
 1217   HD22  ASN 598          HD22      ASN 598  66.849   7.789  -1.382
 1218    H    CYS 599           HN       CYS 599  69.935   7.206   3.171
 1219    HA   CYS 599           HA       CYS 599  72.775   6.501   3.432
 1220    HB2  CYS 599           HB2      CYS 599  70.735   7.913   5.133
 1221    HB3  CYS 599           HB1      CYS 599  72.183   7.287   5.903
 1222    H    PHE 600           HN       PHE 600  69.959   5.821   5.495
 1223    HA   PHE 600           HA       PHE 600  70.921   3.687   6.973
 1224    HB2  PHE 600           HB2      PHE 600  68.825   4.253   7.721
 1225    HB3  PHE 600           HB1      PHE 600  68.289   4.706   6.113
 1226    HD1  PHE 600           HD1      PHE 600  68.497   2.001   8.579
 1227    HD2  PHE 600           HD2      PHE 600  67.320   3.041   4.593
 1228    HE1  PHE 600           HE1      PHE 600  67.175  -0.091   8.427
 1229    HE2  PHE 600           HE2      PHE 600  66.003   0.947   4.427
 1230    HZ   PHE 600           HZ       PHE 600  65.929  -0.621   6.348
 1231    H    LEU 601           HN       LEU 601  69.000   3.323   3.994
 1232    HA   LEU 601           HA       LEU 601  69.239   0.564   3.739
 1233    HB2  LEU 601           HB2      LEU 601  68.030   0.998   1.867
 1234    HB3  LEU 601           HB1      LEU 601  68.249   2.707   2.205
 1235    HG   LEU 601           HG       LEU 601  70.381   2.617   0.850
 1236   HD11  LEU 601          HD11      LEU 601  69.760  -0.238   0.874
 1237   HD12  LEU 601          HD12      LEU 601  71.223   0.577   0.331
 1238   HD13  LEU 601          HD13      LEU 601  69.882   0.352  -0.784
 1239   HD21  LEU 601          HD21      LEU 601  68.369   3.493  -0.148
 1240   HD22  LEU 601          HD22      LEU 601  67.744   1.869  -0.433
 1241   HD23  LEU 601          HD23      LEU 601  69.138   2.448  -1.343
 1242    H    LYS 602           HN       LYS 602  71.538   3.048   2.641
 1243    HA   LYS 602           HA       LYS 602  73.319   1.252   1.341
 1244    HB2  LYS 602           HB2      LYS 602  73.331   3.776   1.206
 1245    HB3  LYS 602           HB1      LYS 602  74.110   3.790   2.780
 1246    HG2  LYS 602           HG2      LYS 602  75.933   3.884   1.335
 1247    HG3  LYS 602           HG1      LYS 602  75.828   2.161   1.646
 1248    HD2  LYS 602           HD2      LYS 602  74.670   1.800  -0.462
 1249    HD3  LYS 602           HD1      LYS 602  74.575   3.538  -0.746
 1250    HE2  LYS 602           HE2      LYS 602  76.520   2.093  -1.851
 1251    HE3  LYS 602           HE1      LYS 602  76.836   3.722  -1.257
 1252    HZ1  LYS 602           HZ1      LYS 602  77.839   2.917   0.652
 1253    HZ2  LYS 602           HZ2      LYS 602  78.391   1.842  -0.543
 1254    HZ3  LYS 602           HZ3      LYS 602  77.139   1.379   0.508
 1255    H    LEU 603           HN       LEU 603  72.838   1.833   4.766
 1256    HA   LEU 603           HA       LEU 603  75.445   0.569   5.420
 1257    HB2  LEU 603           HB2      LEU 603  73.583   1.134   7.658
 1258    HB3  LEU 603           HB1      LEU 603  75.288   1.540   7.483
 1259    HG   LEU 603           HG       LEU 603  72.987   2.970   6.143
 1260   HD11  LEU 603          HD11      LEU 603  73.387   3.222   8.697
 1261   HD12  LEU 603          HD12      LEU 603  73.213   4.677   7.720
 1262   HD13  LEU 603          HD13      LEU 603  74.818   4.140   8.217
 1263   HD21  LEU 603          HD21      LEU 603  74.551   4.441   5.175
 1264   HD22  LEU 603          HD22      LEU 603  75.366   2.896   4.995
 1265   HD23  LEU 603          HD23      LEU 603  75.826   3.985   6.296
 1266    H    PHE 604           HN       PHE 604  71.975  -0.080   5.894
 1267    HA   PHE 604           HA       PHE 604  72.681  -2.945   6.472
 1268    HB2  PHE 604           HB2      PHE 604  70.044  -1.874   7.386
 1269    HB3  PHE 604           HB1      PHE 604  71.135  -3.011   8.180
 1270    HD1  PHE 604           HD1      PHE 604  73.178  -2.149   9.386
 1271    HD2  PHE 604           HD2      PHE 604  70.184   0.473   7.779
 1272    HE1  PHE 604           HE1      PHE 604  74.041  -0.303  10.791
 1273    HE2  PHE 604           HE2      PHE 604  71.047   2.322   9.185
 1274    HZ   PHE 604           HZ       PHE 604  72.974   1.934  10.691
 1275    H    CYS 605           HN       CYS 605  72.203  -1.740   3.825
 1276    HA   CYS 605           HA       CYS 605  69.744  -1.913   2.658
 1277    HB2  CYS 605           HB2      CYS 605  70.804  -2.316   0.629
 1278    HB3  CYS 605           HB1      CYS 605  72.190  -1.832   1.597
 1279    HG   CYS 605           HG       CYS 605  72.077  -4.734   1.945
  Start of MODEL    6
    1    H    MET   1           HT1      MET   1  93.820 -22.469   8.553
    2    HA   MET   1           HA       MET   1  93.880 -21.707   5.741
    3    HB2  MET   1           HB2      MET   1  95.001 -20.672   7.942
    4    HB3  MET   1           HB1      MET   1  96.254 -21.852   7.588
    5    HG2  MET   1           HG2      MET   1  95.344 -19.504   5.938
    6    HG3  MET   1           HG1      MET   1  96.979 -19.952   6.409
    7    HE1  MET   1           HE1      MET   1  96.609 -19.003   3.676
    8    HE2  MET   1           HE2      MET   1  94.917 -19.471   3.521
    9    HE3  MET   1           HE3      MET   1  96.107 -20.112   2.391
   10    H    ALA   2           HN       ALA   2  96.842 -22.746   6.144
   11    HA   ALA   2           HA       ALA   2  96.373 -25.648   5.641
   12    HB1  ALA   2           HB1      ALA   2  98.044 -23.938   3.785
   13    HB2  ALA   2           HB2      ALA   2  96.359 -24.339   3.448
   14    HB3  ALA   2           HB3      ALA   2  97.565 -25.621   3.560
   15    H    LEU   3           HN       LEU   3  98.872 -23.118   5.611
   16    HA   LEU   3           HA       LEU   3 101.155 -24.527   6.263
   17    HB2  LEU   3           HB2      LEU   3 100.125 -21.878   7.284
   18    HB3  LEU   3           HB1      LEU   3 101.744 -22.454   7.675
   19    HG   LEU   3           HG       LEU   3 100.685 -22.183   4.847
   20   HD11  LEU   3          HD11      LEU   3 102.214 -20.151   4.797
   21   HD12  LEU   3          HD12      LEU   3 102.299 -20.273   6.554
   22   HD13  LEU   3          HD13      LEU   3 100.752 -19.967   5.766
   23   HD21  LEU   3          HD21      LEU   3 103.303 -22.995   6.077
   24   HD22  LEU   3          HD22      LEU   3 103.351 -22.078   4.573
   25   HD23  LEU   3          HD23      LEU   3 102.496 -23.613   4.637
   26    H    ASP   4           HN       ASP   4  99.620 -22.745   8.820
   27    HA   ASP   4           HA       ASP   4  99.346 -23.202  11.078
   28    HB2  ASP   4           HB2      ASP   4  97.516 -24.555  10.252
   29    HB3  ASP   4           HB1      ASP   4  98.625 -25.862   9.846
   30    H    GLY   5           HN       GLY   5 101.955 -24.025   9.570
   31    HA2  GLY   5           HA2      GLY   5 103.138 -26.194  11.028
   32    HA3  GLY   5           HA1      GLY   5 104.031 -24.885  10.241
   33    H    ILE   6           HN       ILE   6 102.098 -23.151  11.819
   34    HA   ILE   6           HA       ILE   6 103.666 -23.013  14.363
   35    HB   ILE   6           HB       ILE   6 102.530 -20.532  14.067
   36   HG12  ILE   6          HG12      ILE   6 101.682 -21.404  11.781
   37   HG13  ILE   6          HG11      ILE   6 102.463 -19.833  11.818
   38   HG21  ILE   6          HG21      ILE   6 105.187 -21.649  13.229
   39   HG22  ILE   6          HG22      ILE   6 104.805 -20.563  14.564
   40   HG23  ILE   6          HG23      ILE   6 104.821 -19.955  12.910
   41   HD11  ILE   6          HD11      ILE   6 104.213 -20.536  10.546
   42   HD12  ILE   6          HD12      ILE   6 103.120 -21.836  10.080
   43   HD13  ILE   6          HD13      ILE   6 104.314 -22.104  11.345
   44    H    ARG   7           HN       ARG   7 100.848 -21.052  14.206
   45    HA   ARG   7           HA       ARG   7  98.955 -22.958  14.978
   46    HB2  ARG   7           HB2      ARG   7 100.725 -22.729  16.960
   47    HB3  ARG   7           HB1      ARG   7  99.809 -21.360  17.376
   48    HG2  ARG   7           HG2      ARG   7  98.761 -23.097  18.567
   49    HG3  ARG   7           HG1      ARG   7  97.772 -22.883  17.121
   50    HD2  ARG   7           HD2      ARG   7  98.094 -25.175  17.010
   51    HD3  ARG   7           HD1      ARG   7  99.482 -24.580  16.085
   52    HE   ARG   7           HE       ARG   7 100.505 -24.690  18.615
   53   HH11  ARG   7          HH11      ARG   7 101.408 -26.531  19.559
   54   HH12  ARG   7          HH12      ARG   7 100.894 -28.100  19.034
   55   HH21  ARG   7          HH21      ARG   7  98.646 -26.872  16.697
   56   HH22  ARG   7          HH22      ARG   7  99.332 -28.292  17.413
   57    H    MET   8           HN       MET   8  99.247 -20.009  16.752
   58    HA   MET   8           HA       MET   8  96.973 -18.917  15.157
   59    HB2  MET   8           HB2      MET   8  97.005 -17.890  17.886
   60    HB3  MET   8           HB1      MET   8  95.726 -18.710  17.014
   61    HG2  MET   8           HG2      MET   8  97.168 -20.880  17.471
   62    HG3  MET   8           HG1      MET   8  97.853 -19.919  18.755
   63    HE1  MET   8           HE1      MET   8  96.738 -18.816  20.536
   64    HE2  MET   8           HE2      MET   8  95.080 -19.034  21.091
   65    HE3  MET   8           HE3      MET   8  95.405 -18.023  19.685
   66    HA   PRO   9           HA       PRO   9  99.387 -14.944  16.562
   67    HB2  PRO   9           HB2      PRO   9 102.064 -16.179  17.122
   68    HB3  PRO   9           HB1      PRO   9 101.276 -14.793  17.912
   69    HG2  PRO   9           HG2      PRO   9 101.326 -17.068  19.170
   70    HG3  PRO   9           HG1      PRO   9  99.793 -16.165  19.075
   71    HD2  PRO   9           HD2      PRO   9 100.646 -18.525  17.394
   72    HD3  PRO   9           HD1      PRO   9  99.146 -18.263  18.279
   73    H    ASP  10           HN       ASP  10 101.245 -17.549  15.125
   74    HA   ASP  10           HA       ASP  10 101.941 -15.791  12.792
   75    HB2  ASP  10           HB2      ASP  10 103.816 -16.829  14.194
   76    HB3  ASP  10           HB1      ASP  10 103.274 -18.384  13.576
   77    H    GLY  11           HN       GLY  11 100.361 -18.626  13.925
   78    HA2  GLY  11           HA2      GLY  11 100.043 -19.831  11.276
   79    HA3  GLY  11           HA1      GLY  11  99.274 -20.383  12.773
   80    H    CYS  12           HN       CYS  12  98.751 -17.184  12.822
   81    HA   CYS  12           HA       CYS  12  96.726 -16.763  10.833
   82    HB2  CYS  12           HB2      CYS  12  95.409 -18.379  12.002
   83    HB3  CYS  12           HB1      CYS  12  95.861 -17.698  13.563
   84    HG   CYS  12           HG       CYS  12  93.609 -16.683  11.786
   85    H    TYR  13           HN       TYR  13  96.302 -15.910  14.238
   86    HA   TYR  13           HA       TYR  13  97.737 -13.442  14.224
   87    HB2  TYR  13           HB2      TYR  13  95.744 -13.063  12.520
   88    HB3  TYR  13           HB1      TYR  13  94.764 -12.928  13.976
   89    HD1  TYR  13           HD1      TYR  13  97.422 -11.394  11.959
   90    HD2  TYR  13           HD2      TYR  13  95.158 -11.114  15.599
   91    HE1  TYR  13           HE1      TYR  13  98.206  -9.061  12.267
   92    HE2  TYR  13           HE2      TYR  13  95.943  -8.782  15.906
   93    HH   TYR  13           HH       TYR  13  98.457  -7.504  14.624
   94    H    ALA  14           HN       ALA  14  94.466 -14.379  15.280
   95    HA   ALA  14           HA       ALA  14  95.232 -15.019  17.968
   96    HB1  ALA  14           HB1      ALA  14  95.622 -12.652  18.260
   97    HB2  ALA  14           HB2      ALA  14  94.090 -13.031  19.047
   98    HB3  ALA  14           HB3      ALA  14  94.099 -12.255  17.463
   99    H    ASP  15           HN       ASP  15  92.617 -13.577  16.040
  100    HA   ASP  15           HA       ASP  15  90.895 -15.873  16.785
  101    HB2  ASP  15           HB2      ASP  15  90.543 -13.915  18.407
  102    HB3  ASP  15           HB1      ASP  15  89.872 -13.039  17.031
  103    H    GLY  16           HN       GLY  16  92.167 -13.973  14.451
  104    HA2  GLY  16           HA2      GLY  16  91.656 -14.213  12.105
  105    HA3  GLY  16           HA1      GLY  16  89.999 -14.647  12.532
  106    H    THR  17           HN       THR  17  91.297 -12.018  14.277
  107    HA   THR  17           HA       THR  17  89.454 -10.169  12.868
  108    HB   THR  17           HB       THR  17  90.118  -8.653  14.804
  109    HG1  THR  17           HG1      THR  17  92.091  -9.910  15.169
  110   HG21  THR  17          HG21      THR  17  88.751  -9.869  16.426
  111   HG22  THR  17          HG22      THR  17  88.970 -11.361  15.507
  112   HG23  THR  17          HG23      THR  17  88.063 -10.016  14.809
  113    H    TRP  18           HN       TRP  18  90.254  -8.879  11.355
  114    HA   TRP  18           HA       TRP  18  93.098  -7.955  11.520
  115    HB2  TRP  18           HB2      TRP  18  92.437  -7.847   8.805
  116    HB3  TRP  18           HB1      TRP  18  93.442  -9.073   9.562
  117    HD1  TRP  18           HD1      TRP  18  89.721  -8.450   8.739
  118    HE1  TRP  18           HE1      TRP  18  88.610 -10.738   8.314
  119    HE3  TRP  18           HE3      TRP  18  93.637 -11.547   9.809
  120    HZ2  TRP  18           HZ2      TRP  18  89.292 -13.515   8.414
  121    HZ3  TRP  18           HZ3      TRP  18  93.381 -14.007   9.637
  122    HH2  TRP  18           HH2      TRP  18  91.214 -14.994   8.942
  123    H    GLU  19           HN       GLU  19  93.173  -5.794  11.703
  124    HA   GLU  19           HA       GLU  19  90.731  -4.226  11.333
  125    HB2  GLU  19           HB2      GLU  19  92.824  -2.393  11.761
  126    HB3  GLU  19           HB1      GLU  19  91.754  -3.043  12.995
  127    HG2  GLU  19           HG2      GLU  19  94.109  -3.363  13.605
  128    HG3  GLU  19           HG1      GLU  19  93.297  -4.910  13.363
  129    H    LEU  20           HN       LEU  20  90.196  -3.095   9.542
  130    HA   LEU  20           HA       LEU  20  92.008  -3.244   7.239
  131    HB2  LEU  20           HB2      LEU  20  89.202  -3.117   7.581
  132    HB3  LEU  20           HB1      LEU  20  89.615  -1.570   6.858
  133    HG   LEU  20           HG       LEU  20  89.163  -3.027   5.044
  134   HD11  LEU  20          HD11      LEU  20  92.112  -3.440   4.964
  135   HD12  LEU  20          HD12      LEU  20  91.557  -1.778   5.176
  136   HD13  LEU  20          HD13      LEU  20  91.029  -2.715   3.781
  137   HD21  LEU  20          HD21      LEU  20  90.689  -5.047   6.671
  138   HD22  LEU  20          HD22      LEU  20  90.580  -5.249   4.925
  139   HD23  LEU  20          HD23      LEU  20  89.113  -5.191   5.896
  140    H    SER  21           HN       SER  21  93.311  -1.584   6.607
  141    HA   SER  21           HA       SER  21  93.535   0.718   8.378
  142    HB2  SER  21           HB2      SER  21  95.389  -0.579   6.996
  143    HB3  SER  21           HB1      SER  21  94.955   0.585   5.747
  144    HG   SER  21           HG       SER  21  95.682   2.190   6.973
  145    H    VAL  22           HN       VAL  22  93.101   2.849   7.892
  146    HA   VAL  22           HA       VAL  22  91.778   3.432   5.299
  147    HB   VAL  22           HB       VAL  22  90.610   3.969   8.035
  148   HG11  VAL  22          HG11      VAL  22  88.874   5.311   6.714
  149   HG12  VAL  22          HG12      VAL  22  90.044   5.346   5.393
  150   HG13  VAL  22          HG13      VAL  22  90.434   6.099   6.940
  151   HG21  VAL  22          HG21      VAL  22  89.556   2.774   5.455
  152   HG22  VAL  22          HG22      VAL  22  88.605   3.000   6.927
  153   HG23  VAL  22          HG23      VAL  22  89.973   1.879   6.924
  154    H    HIS  23           HN       HIS  23  93.186   4.816   4.445
  155    HA   HIS  23           HA       HIS  23  94.690   6.724   6.073
  156    HB2  HIS  23           HB2      HIS  23  94.451   6.037   3.162
  157    HB3  HIS  23           HB1      HIS  23  95.178   7.583   3.600
  158    HD1  HIS  23           HD1      HIS  23  97.600   6.993   3.031
  159    HD2  HIS  23           HD2      HIS  23  95.855   4.274   5.665
  160    HE1  HIS  23           HE1      HIS  23  99.471   5.505   3.868
  161    H    VAL  24           HN       VAL  24  93.372   8.245   7.009
  162    HA   VAL  24           HA       VAL  24  91.036   9.277   5.692
  163    HB   VAL  24           HB       VAL  24  92.493  10.701   7.908
  164   HG11  VAL  24          HG11      VAL  24  90.261  11.470   6.861
  165   HG12  VAL  24          HG12      VAL  24  90.290  11.311   8.616
  166   HG13  VAL  24          HG13      VAL  24  89.550  10.053   7.630
  167   HG21  VAL  24          HG21      VAL  24  92.648   8.443   8.656
  168   HG22  VAL  24          HG22      VAL  24  91.033   8.060   8.054
  169   HG23  VAL  24          HG23      VAL  24  91.226   9.106   9.461
  170    H    THR  25           HN       THR  25  91.304  10.340   3.814
  171    HA   THR  25           HA       THR  25  93.723  11.782   3.175
  172    HB   THR  25           HB       THR  25  92.728  12.160   1.056
  173    HG1  THR  25           HG1      THR  25  90.779  12.895   1.086
  174   HG21  THR  25          HG21      THR  25  93.050   9.714   1.798
  175   HG22  THR  25          HG22      THR  25  92.005   9.987   0.402
  176   HG23  THR  25          HG23      THR  25  91.298   9.670   1.988
  177    H    ASP  26           HN       ASP  26  90.368  13.060   3.302
  178    HA   ASP  26           HA       ASP  26  90.976  15.771   3.250
  179    HB2  ASP  26           HB2      ASP  26  88.671  14.605   3.397
  180    HB3  ASP  26           HB1      ASP  26  88.881  14.700   5.145
  181    H    LEU  27           HN       LEU  27  91.885  13.553   5.656
  182    HA   LEU  27           HA       LEU  27  92.436  15.726   7.655
  183    HB2  LEU  27           HB2      LEU  27  91.851  12.826   7.819
  184    HB3  LEU  27           HB1      LEU  27  92.877  13.483   9.056
  185    HG   LEU  27           HG       LEU  27  90.544  13.465   9.755
  186   HD11  LEU  27          HD11      LEU  27  90.589  15.500  10.786
  187   HD12  LEU  27          HD12      LEU  27  90.969  16.377   9.307
  188   HD13  LEU  27          HD13      LEU  27  92.238  15.498  10.165
  189   HD21  LEU  27          HD21      LEU  27  88.824  14.583   8.581
  190   HD22  LEU  27          HD22      LEU  27  89.722  13.683   7.361
  191   HD23  LEU  27          HD23      LEU  27  89.977  15.418   7.543
  192    H    ASN  28           HN       ASN  28  93.717  12.777   6.238
  193    HA   ASN  28           HA       ASN  28  95.923  12.434   5.351
  194    HB2  ASN  28           HB2      ASN  28  96.429  14.942   5.794
  195    HB3  ASN  28           HB1      ASN  28  97.036  14.408   7.359
  196   HD21  ASN  28          HD21      ASN  28  97.765  11.765   5.931
  197   HD22  ASN  28          HD22      ASN  28  99.248  12.114   5.192
  198    H    ARG  29           HN       ARG  29  94.309  11.745   7.963
  199    HA   ARG  29           HA       ARG  29  96.513  10.660   9.602
  200    HB2  ARG  29           HB2      ARG  29  93.529  10.464   9.996
  201    HB3  ARG  29           HB1      ARG  29  94.763  10.045  11.178
  202    HG2  ARG  29           HG2      ARG  29  95.318  12.257  11.611
  203    HG3  ARG  29           HG1      ARG  29  94.791  12.827  10.044
  204    HD2  ARG  29           HD2      ARG  29  93.093  13.638  11.431
  205    HD3  ARG  29           HD1      ARG  29  92.391  12.110  10.898
  206    HE   ARG  29           HE       ARG  29  93.434  12.708  13.601
  207   HH11  ARG  29          HH11      ARG  29  92.951  11.159  15.158
  208   HH12  ARG  29          HH12      ARG  29  92.295   9.631  14.673
  209   HH21  ARG  29          HH21      ARG  29  92.300  10.391  11.295
  210   HH22  ARG  29          HH22      ARG  29  91.930   9.198  12.492
  211    H    ASP  30           HN       ASP  30  95.700   8.411  10.530
  212    HA   ASP  30           HA       ASP  30  94.755   6.649   8.340
  213    HB2  ASP  30           HB2      ASP  30  97.322   6.301   9.908
  214    HB3  ASP  30           HB1      ASP  30  96.541   4.990   9.022
  215    H    VAL  31           HN       VAL  31  93.048   5.666   9.157
  216    HA   VAL  31           HA       VAL  31  93.026   5.001  12.084
  217    HB   VAL  31           HB       VAL  31  90.662   5.377  10.222
  218   HG11  VAL  31          HG11      VAL  31  90.978   4.940  13.200
  219   HG12  VAL  31          HG12      VAL  31  90.137   3.906  12.046
  220   HG13  VAL  31          HG13      VAL  31  89.476   5.489  12.460
  221   HG21  VAL  31          HG21      VAL  31  92.148   7.463  10.812
  222   HG22  VAL  31          HG22      VAL  31  91.502   7.267  12.439
  223   HG23  VAL  31          HG23      VAL  31  90.411   7.575  11.090
  224    H    THR  32           HN       THR  32  92.067   2.994  12.666
  225    HA   THR  32           HA       THR  32  91.882   0.958  10.483
  226    HB   THR  32           HB       THR  32  93.019  -0.302  12.800
  227    HG1  THR  32           HG1      THR  32  94.390   2.049  12.029
  228   HG21  THR  32          HG21      THR  32  94.750  -0.957  11.351
  229   HG22  THR  32          HG22      THR  32  94.640   0.524  10.401
  230   HG23  THR  32          HG23      THR  32  93.391  -0.713  10.254
  231    H    LEU  33           HN       LEU  33  90.165  -0.378  10.738
  232    HA   LEU  33           HA       LEU  33  88.586  -0.220  13.280
  233    HB2  LEU  33           HB2      LEU  33  87.866  -0.398  10.371
  234    HB3  LEU  33           HB1      LEU  33  86.762  -1.068  11.552
  235    HG   LEU  33           HG       LEU  33  86.371   1.370  10.828
  236   HD11  LEU  33          HD11      LEU  33  85.482   1.959  12.918
  237   HD12  LEU  33          HD12      LEU  33  86.749   1.117  13.810
  238   HD13  LEU  33          HD13      LEU  33  85.504   0.198  12.961
  239   HD21  LEU  33          HD21      LEU  33  87.730   3.082  11.744
  240   HD22  LEU  33          HD22      LEU  33  88.868   1.924  11.062
  241   HD23  LEU  33          HD23      LEU  33  88.580   1.971  12.800
  242    H    ARG  34           HN       ARG  34  88.935  -2.031  14.421
  243    HA   ARG  34           HA       ARG  34  89.970  -4.480  13.456
  244    HB2  ARG  34           HB2      ARG  34  89.893  -3.708  15.871
  245    HB3  ARG  34           HB1      ARG  34  88.182  -4.124  15.867
  246    HG2  ARG  34           HG2      ARG  34  89.364  -6.028  16.749
  247    HG3  ARG  34           HG1      ARG  34  88.818  -6.446  15.126
  248    HD2  ARG  34           HD2      ARG  34  90.952  -6.444  14.256
  249    HD3  ARG  34           HD1      ARG  34  91.549  -5.235  15.390
  250    HE   ARG  34           HE       ARG  34  90.880  -7.702  16.744
  251   HH11  ARG  34          HH11      ARG  34  92.617  -8.931  17.503
  252   HH12  ARG  34          HH12      ARG  34  94.207  -8.634  16.884
  253   HH21  ARG  34          HH21      ARG  34  93.192  -6.094  14.753
  254   HH22  ARG  34          HH22      ARG  34  94.532  -7.029  15.326
  255    H    VAL  35           HN       VAL  35  88.927  -5.552  11.862
  256    HA   VAL  35           HA       VAL  35  86.041  -6.238  12.279
  257    HB   VAL  35           HB       VAL  35  85.798  -6.062   9.783
  258   HG11  VAL  35          HG11      VAL  35  85.805  -3.509   9.811
  259   HG12  VAL  35          HG12      VAL  35  86.507  -3.621  11.428
  260   HG13  VAL  35          HG13      VAL  35  84.899  -4.280  11.113
  261   HG21  VAL  35          HG21      VAL  35  88.495  -4.704  10.051
  262   HG22  VAL  35          HG22      VAL  35  87.484  -4.649   8.610
  263   HG23  VAL  35          HG23      VAL  35  88.152  -6.185   9.160
  264    H    THR  36           HN       THR  36  85.630  -7.845  10.190
  265    HA   THR  36           HA       THR  36  87.819  -9.850  10.075
  266    HB   THR  36           HB       THR  36  86.014 -11.627  10.476
  267    HG1  THR  36           HG1      THR  36  84.728  -9.351  11.575
  268   HG21  THR  36          HG21      THR  36  87.593 -11.419  12.195
  269   HG22  THR  36          HG22      THR  36  86.056 -11.191  13.023
  270   HG23  THR  36          HG23      THR  36  87.054  -9.798  12.623
  271    H    GLY  37           HN       GLY  37  87.021 -11.600   8.395
  272    HA2  GLY  37           HA2      GLY  37  86.159 -10.117   6.052
  273    HA3  GLY  37           HA1      GLY  37  86.600 -11.816   6.076
  274    H    GLU  38           HN       GLU  38  84.162 -10.007   7.904
  275    HA   GLU  38           HA       GLU  38  81.993 -11.428   6.490
  276    HB2  GLU  38           HB2      GLU  38  80.987 -12.063   8.737
  277    HB3  GLU  38           HB1      GLU  38  82.405 -12.990   8.250
  278    HG2  GLU  38           HG2      GLU  38  83.824 -11.846   9.734
  279    HG3  GLU  38           HG1      GLU  38  82.689 -10.512   9.941
  280    H    VAL  39           HN       VAL  39  83.243  -8.606   7.608
  281    HA   VAL  39           HA       VAL  39  80.711  -7.502   8.653
  282    HB   VAL  39           HB       VAL  39  81.928  -5.607   9.286
  283   HG11  VAL  39          HG11      VAL  39  83.691  -6.487  10.581
  284   HG12  VAL  39          HG12      VAL  39  84.068  -7.716   9.372
  285   HG13  VAL  39          HG13      VAL  39  82.600  -7.848  10.337
  286   HG21  VAL  39          HG21      VAL  39  83.996  -6.430   7.229
  287   HG22  VAL  39          HG22      VAL  39  84.248  -5.142   8.404
  288   HG23  VAL  39          HG23      VAL  39  82.986  -4.981   7.194
  289    H    HIS  40           HN       HIS  40  79.472  -5.964   7.560
  290    HA   HIS  40           HA       HIS  40  79.790  -5.938   4.627
  291    HB2  HIS  40           HB2      HIS  40  77.666  -4.442   4.858
  292    HB3  HIS  40           HB1      HIS  40  77.531  -6.150   5.273
  293    HD1  HIS  40           HD1      HIS  40  77.930  -6.670   7.948
  294    HD2  HIS  40           HD2      HIS  40  76.909  -2.761   6.920
  295    HE1  HIS  40           HE1      HIS  40  77.116  -5.560  10.074
  296    H    ILE  41           HN       ILE  41  80.244  -4.022   3.405
  297    HA   ILE  41           HA       ILE  41  82.093  -2.170   4.409
  298    HB   ILE  41           HB       ILE  41  79.986  -1.560   2.317
  299   HG12  ILE  41          HG12      ILE  41  82.753  -2.734   1.913
  300   HG13  ILE  41          HG11      ILE  41  81.273  -3.693   1.924
  301   HG21  ILE  41          HG21      ILE  41  82.760  -0.447   2.829
  302   HG22  ILE  41          HG22      ILE  41  81.234   0.410   3.046
  303   HG23  ILE  41          HG23      ILE  41  81.761  -0.058   1.426
  304   HD11  ILE  41          HD11      ILE  41  80.694  -3.028  -0.157
  305   HD12  ILE  41          HD12      ILE  41  82.363  -2.490  -0.312
  306   HD13  ILE  41          HD13      ILE  41  81.105  -1.342   0.151
  307    H    GLY  42           HN       GLY  42  78.602  -1.687   4.007
  308    HA2  GLY  42           HA2      GLY  42  78.364   0.841   5.223
  309    HA3  GLY  42           HA1      GLY  42  77.092  -0.376   5.221
  310    H    GLY  43           HN       GLY  43  79.244  -2.155   6.507
  311    HA2  GLY  43           HA2      GLY  43  78.382  -1.671   9.252
  312    HA3  GLY  43           HA1      GLY  43  79.489  -2.939   8.713
  313    H    VAL  44           HN       VAL  44  81.196  -1.039   7.285
  314    HA   VAL  44           HA       VAL  44  82.852  -0.186   9.562
  315    HB   VAL  44           HB       VAL  44  83.192  -0.378   6.566
  316   HG11  VAL  44          HG11      VAL  44  84.907   1.224   8.489
  317   HG12  VAL  44          HG12      VAL  44  84.198   1.764   6.967
  318   HG13  VAL  44          HG13      VAL  44  85.528   0.606   6.958
  319   HG21  VAL  44          HG21      VAL  44  85.149  -1.723   7.242
  320   HG22  VAL  44          HG22      VAL  44  83.674  -2.330   7.994
  321   HG23  VAL  44          HG23      VAL  44  84.811  -1.366   8.936
  322    H    MET  45           HN       MET  45  81.100   1.346   6.834
  323    HA   MET  45           HA       MET  45  81.796   4.033   7.217
  324    HB2  MET  45           HB2      MET  45  79.249   2.655   6.394
  325    HB3  MET  45           HB1      MET  45  79.194   4.388   6.680
  326    HG2  MET  45           HG2      MET  45  80.154   4.813   4.660
  327    HG3  MET  45           HG1      MET  45  81.489   3.729   4.998
  328    HE1  MET  45           HE1      MET  45  77.877   3.919   3.083
  329    HE2  MET  45           HE2      MET  45  77.812   3.617   4.817
  330    HE3  MET  45           HE3      MET  45  77.364   2.334   3.684
  331    H    LEU  46           HN       LEU  46  79.567   2.027   9.067
  332    HA   LEU  46           HA       LEU  46  78.595   4.159  10.753
  333    HB2  LEU  46           HB2      LEU  46  77.693   1.698  10.316
  334    HB3  LEU  46           HB1      LEU  46  78.705   1.303  11.701
  335    HG   LEU  46           HG       LEU  46  77.504   3.399  12.806
  336   HD11  LEU  46          HD11      LEU  46  75.117   3.528  12.038
  337   HD12  LEU  46          HD12      LEU  46  75.552   2.546  10.641
  338   HD13  LEU  46          HD13      LEU  46  76.267   4.147  10.856
  339   HD21  LEU  46          HD21      LEU  46  77.286   1.171  13.718
  340   HD22  LEU  46          HD22      LEU  46  76.220   0.682  12.400
  341   HD23  LEU  46          HD23      LEU  46  75.667   1.860  13.592
  342    H    LYS  47           HN       LYS  47  80.815   1.457  11.576
  343    HA   LYS  47           HA       LYS  47  81.611   2.400  14.092
  344    HB2  LYS  47           HB2      LYS  47  83.441   0.974  12.155
  345    HB3  LYS  47           HB1      LYS  47  83.546   0.981  13.914
  346    HG2  LYS  47           HG2      LYS  47  81.498  -0.261  14.124
  347    HG3  LYS  47           HG1      LYS  47  81.159  -0.088  12.406
  348    HD2  LYS  47           HD2      LYS  47  83.324  -1.341  11.956
  349    HD3  LYS  47           HD1      LYS  47  83.387  -1.689  13.683
  350    HE2  LYS  47           HE2      LYS  47  80.992  -2.370  11.962
  351    HE3  LYS  47           HE1      LYS  47  82.322  -3.495  12.241
  352    HZ1  LYS  47           HZ1      LYS  47  81.320  -2.271  14.642
  353    HZ2  LYS  47           HZ2      LYS  47  81.634  -3.906  14.305
  354    HZ3  LYS  47           HZ3      LYS  47  80.158  -3.206  13.836
  355    H    LEU  48           HN       LEU  48  83.530   2.844  11.085
  356    HA   LEU  48           HA       LEU  48  85.541   4.429  12.096
  357    HB2  LEU  48           HB2      LEU  48  85.422   3.724   9.731
  358    HB3  LEU  48           HB1      LEU  48  84.128   4.884   9.453
  359    HG   LEU  48           HG       LEU  48  85.762   6.711  10.186
  360   HD11  LEU  48          HD11      LEU  48  87.428   5.376  11.350
  361   HD12  LEU  48          HD12      LEU  48  88.174   6.097   9.927
  362   HD13  LEU  48          HD13      LEU  48  87.694   4.403   9.904
  363   HD21  LEU  48          HD21      LEU  48  86.354   4.994   7.774
  364   HD22  LEU  48          HD22      LEU  48  87.041   6.597   8.030
  365   HD23  LEU  48          HD23      LEU  48  85.295   6.406   7.843
  366    H    VAL  49           HN       VAL  49  82.329   5.586  11.123
  367    HA   VAL  49           HA       VAL  49  82.869   8.347  11.807
  368    HB   VAL  49           HB       VAL  49  80.350   6.757  11.316
  369   HG11  VAL  49          HG11      VAL  49  79.633   8.406  12.909
  370   HG12  VAL  49          HG12      VAL  49  79.180   9.002  11.317
  371   HG13  VAL  49          HG13      VAL  49  80.599   9.660  12.130
  372   HG21  VAL  49          HG21      VAL  49  80.275   7.950   9.259
  373   HG22  VAL  49          HG22      VAL  49  81.967   7.497   9.461
  374   HG23  VAL  49          HG23      VAL  49  81.446   9.144   9.822
  375    H    GLU  50           HN       GLU  50  81.172   5.691  13.504
  376    HA   GLU  50           HA       GLU  50  80.277   6.973  15.789
  377    HB2  GLU  50           HB2      GLU  50  81.586   4.276  15.453
  378    HB3  GLU  50           HB1      GLU  50  80.977   4.804  17.016
  379    HG2  GLU  50           HG2      GLU  50  79.296   4.762  14.495
  380    HG3  GLU  50           HG1      GLU  50  79.337   3.443  15.663
  381    H    LYS  51           HN       LYS  51  83.602   6.048  15.038
  382    HA   LYS  51           HA       LYS  51  84.661   6.800  17.610
  383    HB2  LYS  51           HB2      LYS  51  86.085   6.585  14.955
  384    HB3  LYS  51           HB1      LYS  51  86.832   6.564  16.555
  385    HG2  LYS  51           HG2      LYS  51  85.328   4.580  17.097
  386    HG3  LYS  51           HG1      LYS  51  84.943   4.519  15.381
  387    HD2  LYS  51           HD2      LYS  51  87.620   4.089  16.715
  388    HD3  LYS  51           HD1      LYS  51  86.718   2.980  15.699
  389    HE2  LYS  51           HE2      LYS  51  88.408   3.791  14.268
  390    HE3  LYS  51           HE1      LYS  51  87.003   4.761  13.842
  391    HZ1  LYS  51           HZ1      LYS  51  88.570   5.831  16.010
  392    HZ2  LYS  51           HZ2      LYS  51  87.934   6.610  14.641
  393    HZ3  LYS  51           HZ3      LYS  51  89.400   5.757  14.532
  394    H    LEU  52           HN       LEU  52  84.131   8.493  14.560
  395    HA   LEU  52           HA       LEU  52  85.635  10.840  15.160
  396    HB2  LEU  52           HB2      LEU  52  84.424   9.963  12.944
  397    HB3  LEU  52           HB1      LEU  52  83.102  10.960  13.542
  398    HG   LEU  52           HG       LEU  52  84.979  12.785  13.829
  399   HD11  LEU  52          HD11      LEU  52  86.197  11.285  11.513
  400   HD12  LEU  52          HD12      LEU  52  86.732  10.972  13.160
  401   HD13  LEU  52          HD13      LEU  52  86.895  12.587  12.475
  402   HD21  LEU  52          HD21      LEU  52  84.484  13.648  11.625
  403   HD22  LEU  52          HD22      LEU  52  83.041  12.810  12.188
  404   HD23  LEU  52          HD23      LEU  52  84.110  12.035  11.022
  405    H    ASP  53           HN       ASP  53  82.112  10.528  15.132
  406    HA   ASP  53           HA       ASP  53  80.468  11.359  16.540
  407    HB2  ASP  53           HB2      ASP  53  82.138  10.311  18.202
  408    HB3  ASP  53           HB1      ASP  53  82.596  11.963  18.569
  409    H    VAL  54           HN       VAL  54  80.398  13.099  14.997
  410    HA   VAL  54           HA       VAL  54  80.487  15.664  16.279
  411    HB   VAL  54           HB       VAL  54  82.848  15.544  15.922
  412   HG11  VAL  54          HG11      VAL  54  83.747  15.091  13.630
  413   HG12  VAL  54          HG12      VAL  54  82.103  14.711  13.115
  414   HG13  VAL  54          HG13      VAL  54  82.892  13.719  14.345
  415   HG21  VAL  54          HG21      VAL  54  81.750  17.135  13.583
  416   HG22  VAL  54          HG22      VAL  54  83.219  17.458  14.502
  417   HG23  VAL  54          HG23      VAL  54  81.641  17.685  15.254
  418    H    LYS  55           HN       LYS  55  79.389  17.256  15.039
  419    HA   LYS  55           HA       LYS  55  77.567  16.202  13.081
  420    HB2  LYS  55           HB2      LYS  55  77.500  18.349  14.717
  421    HB3  LYS  55           HB1      LYS  55  78.048  19.161  13.261
  422    HG2  LYS  55           HG2      LYS  55  75.745  17.344  12.768
  423    HG3  LYS  55           HG1      LYS  55  75.383  18.622  13.909
  424    HD2  LYS  55           HD2      LYS  55  76.307  20.275  12.229
  425    HD3  LYS  55           HD1      LYS  55  76.396  18.946  11.073
  426    HE2  LYS  55           HE2      LYS  55  74.292  19.973  10.665
  427    HE3  LYS  55           HE1      LYS  55  73.918  18.532  11.611
  428    HZ1  LYS  55           HZ1      LYS  55  73.791  19.850  13.589
  429    HZ2  LYS  55           HZ2      LYS  55  72.782  20.548  12.413
  430    HZ3  LYS  55           HZ3      LYS  55  74.293  21.243  12.760
  431    H    LYS  56           HN       LYS  56  80.368  15.836  12.361
  432    HA   LYS  56           HA       LYS  56  81.002  17.728  10.239
  433    HB2  LYS  56           HB2      LYS  56  82.689  16.383  11.588
  434    HB3  LYS  56           HB1      LYS  56  82.180  14.967  10.669
  435    HG2  LYS  56           HG2      LYS  56  82.878  15.987   8.590
  436    HG3  LYS  56           HG1      LYS  56  83.178  17.530   9.388
  437    HD2  LYS  56           HD2      LYS  56  84.884  16.282  10.839
  438    HD3  LYS  56           HD1      LYS  56  84.722  14.949   9.696
  439    HE2  LYS  56           HE2      LYS  56  86.609  16.327   9.022
  440    HE3  LYS  56           HE1      LYS  56  85.308  16.533   7.847
  441    HZ1  LYS  56           HZ1      LYS  56  86.556  18.489   9.412
  442    HZ2  LYS  56           HZ2      LYS  56  84.932  18.390   9.901
  443    HZ3  LYS  56           HZ3      LYS  56  85.315  18.690   8.273
  444    H    ASP  57           HN       ASP  57  81.270  16.929   7.954
  445    HA   ASP  57           HA       ASP  57  78.823  15.614   7.095
  446    HB2  ASP  57           HB2      ASP  57  81.176  16.270   5.317
  447    HB3  ASP  57           HB1      ASP  57  79.462  16.233   4.908
  448    H    TRP  58           HN       TRP  58  79.000  13.474   7.884
  449    HA   TRP  58           HA       TRP  58  81.326  11.829   7.390
  450    HB2  TRP  58           HB2      TRP  58  78.474  11.012   7.974
  451    HB3  TRP  58           HB1      TRP  58  79.893   9.990   8.141
  452    HD1  TRP  58           HD1      TRP  58  81.750  12.210   9.614
  453    HE1  TRP  58           HE1      TRP  58  81.242  12.760  12.078
  454    HE3  TRP  58           HE3      TRP  58  76.915  10.600   9.909
  455    HZ2  TRP  58           HZ2      TRP  58  79.074  12.539  13.934
  456    HZ3  TRP  58           HZ3      TRP  58  75.657  10.782  12.032
  457    HH2  TRP  58           HH2      TRP  58  76.728  11.752  14.044
  458    H    SER  59           HN       SER  59  78.063  11.941   5.980
  459    HA   SER  59           HA       SER  59  78.281  10.004   4.002
  460    HB2  SER  59           HB2      SER  59  76.568  11.200   2.825
  461    HB3  SER  59           HB1      SER  59  76.293  11.449   4.540
  462    HG   SER  59           HG       SER  59  77.091  13.478   4.380
  463    H    ASP  60           HN       ASP  60  79.439  13.364   3.863
  464    HA   ASP  60           HA       ASP  60  80.283  13.420   1.175
  465    HB2  ASP  60           HB2      ASP  60  80.362  15.418   2.562
  466    HB3  ASP  60           HB1      ASP  60  81.556  14.673   3.626
  467    H    HIS  61           HN       HIS  61  81.237  11.270   3.544
  468    HA   HIS  61           HA       HIS  61  83.836  10.712   2.197
  469    HB2  HIS  61           HB2      HIS  61  84.811  10.570   4.240
  470    HB3  HIS  61           HB1      HIS  61  83.361  11.319   4.881
  471    HD1  HIS  61           HD1      HIS  61  84.655   7.815   4.087
  472    HD2  HIS  61           HD2      HIS  61  82.032   9.709   6.715
  473    HE1  HIS  61           HE1      HIS  61  83.824   6.033   5.684
  474    H    ALA  62           HN       ALA  62  84.438   8.448   2.170
  475    HA   ALA  62           HA       ALA  62  82.583   6.316   2.702
  476    HB1  ALA  62           HB1      ALA  62  82.452   5.713   0.151
  477    HB2  ALA  62           HB2      ALA  62  82.752   7.434  -0.097
  478    HB3  ALA  62           HB3      ALA  62  81.325   6.907   0.796
  479    H    LEU  63           HN       LEU  63  83.628   4.188   1.833
  480    HA   LEU  63           HA       LEU  63  86.578   4.562   1.949
  481    HB2  LEU  63           HB2      LEU  63  84.999   1.984   1.977
  482    HB3  LEU  63           HB1      LEU  63  86.715   2.168   2.299
  483    HG   LEU  63           HG       LEU  63  85.624   1.975   4.396
  484   HD11  LEU  63          HD11      LEU  63  86.039   4.944   4.182
  485   HD12  LEU  63          HD12      LEU  63  87.393   3.824   4.014
  486   HD13  LEU  63          HD13      LEU  63  86.459   3.860   5.508
  487   HD21  LEU  63          HD21      LEU  63  83.358   2.881   3.329
  488   HD22  LEU  63          HD22      LEU  63  83.914   4.406   4.016
  489   HD23  LEU  63          HD23      LEU  63  83.670   3.009   5.056
  490    H    TRP  64           HN       TRP  64  87.883   4.294   0.279
  491    HA   TRP  64           HA       TRP  64  86.735   3.205  -2.286
  492    HB2  TRP  64           HB2      TRP  64  87.267   5.198  -3.251
  493    HB3  TRP  64           HB1      TRP  64  87.751   5.801  -1.689
  494    HD1  TRP  64           HD1      TRP  64  90.487   4.623  -1.131
  495    HE1  TRP  64           HE1      TRP  64  92.504   5.001  -2.681
  496    HE3  TRP  64           HE3      TRP  64  88.062   5.918  -5.435
  497    HZ2  TRP  64           HZ2      TRP  64  93.029   5.797  -5.375
  498    HZ3  TRP  64           HZ3      TRP  64  89.347   6.506  -7.470
  499    HH2  TRP  64           HH2      TRP  64  91.824   6.451  -7.446
  500    H    TRP  65           HN       TRP  65  88.130   1.844  -3.501
  501    HA   TRP  65           HA       TRP  65  90.445   0.766  -1.933
  502    HB2  TRP  65           HB2      TRP  65  88.468  -0.746  -2.592
  503    HB3  TRP  65           HB1      TRP  65  89.061  -0.606  -4.245
  504    HD1  TRP  65           HD1      TRP  65  92.160  -0.492  -2.534
  505    HE1  TRP  65           HE1      TRP  65  93.223  -2.800  -2.211
  506    HE3  TRP  65           HE3      TRP  65  88.101  -3.473  -3.414
  507    HZ2  TRP  65           HZ2      TRP  65  92.476  -5.554  -2.315
  508    HZ3  TRP  65           HZ3      TRP  65  88.319  -5.936  -3.301
  509    HH2  TRP  65           HH2      TRP  65  90.496  -6.981  -2.749
  510    H    GLU  66           HN       GLU  66  92.050   2.227  -2.719
  511    HA   GLU  66           HA       GLU  66  92.364   3.086  -5.379
  512    HB2  GLU  66           HB2      GLU  66  94.806   3.335  -4.797
  513    HB3  GLU  66           HB1      GLU  66  93.682   4.102  -3.683
  514    HG2  GLU  66           HG2      GLU  66  93.814   2.112  -2.205
  515    HG3  GLU  66           HG1      GLU  66  94.984   1.402  -3.311
  516    H    LYS  67           HN       LYS  67  93.076  -0.075  -4.036
  517    HA   LYS  67           HA       LYS  67  94.886  -0.841  -6.171
  518    HB2  LYS  67           HB2      LYS  67  93.045  -2.725  -4.678
  519    HB3  LYS  67           HB1      LYS  67  94.577  -3.113  -5.448
  520    HG2  LYS  67           HG2      LYS  67  94.246  -1.324  -3.020
  521    HG3  LYS  67           HG1      LYS  67  94.789  -2.997  -2.995
  522    HD2  LYS  67           HD2      LYS  67  96.691  -2.327  -4.496
  523    HD3  LYS  67           HD1      LYS  67  96.186  -0.652  -4.296
  524    HE2  LYS  67           HE2      LYS  67  96.982  -0.526  -2.142
  525    HE3  LYS  67           HE1      LYS  67  96.542  -2.192  -1.767
  526    HZ1  LYS  67           HZ1      LYS  67  98.408  -2.841  -3.311
  527    HZ2  LYS  67           HZ2      LYS  67  98.867  -2.141  -1.832
  528    HZ3  LYS  67           HZ3      LYS  67  98.906  -1.220  -3.259
  529    H    LYS  68           HN       LYS  68  91.701  -0.008  -5.999
  530    HA   LYS  68           HA       LYS  68  91.057  -1.241  -8.633
  531    HB2  LYS  68           HB2      LYS  68  88.900  -0.800  -6.576
  532    HB3  LYS  68           HB1      LYS  68  88.941  -1.939  -7.918
  533    HG2  LYS  68           HG2      LYS  68  90.800  -2.215  -5.533
  534    HG3  LYS  68           HG1      LYS  68  89.195  -2.912  -5.561
  535    HD2  LYS  68           HD2      LYS  68  89.696  -4.321  -7.397
  536    HD3  LYS  68           HD1      LYS  68  91.160  -3.418  -7.785
  537    HE2  LYS  68           HE2      LYS  68  92.386  -4.420  -6.098
  538    HE3  LYS  68           HE1      LYS  68  90.983  -4.668  -5.063
  539    HZ1  LYS  68           HZ1      LYS  68  91.020  -6.102  -7.598
  540    HZ2  LYS  68           HZ2      LYS  68  90.461  -6.599  -6.073
  541    HZ3  LYS  68           HZ3      LYS  68  92.124  -6.620  -6.420
  542    H    ARG  69           HN       ARG  69  91.248   1.504  -6.616
  543    HA   ARG  69           HA       ARG  69  90.543   3.722  -6.879
  544    HB2  ARG  69           HB2      ARG  69  90.663   2.793  -9.769
  545    HB3  ARG  69           HB1      ARG  69  90.275   4.448  -9.323
  546    HG2  ARG  69           HG2      ARG  69  92.578   4.624  -9.627
  547    HG3  ARG  69           HG1      ARG  69  92.514   4.277  -7.903
  548    HD2  ARG  69           HD2      ARG  69  94.147   2.788  -8.768
  549    HD3  ARG  69           HD1      ARG  69  92.699   1.810  -8.558
  550    HE   ARG  69           HE       ARG  69  92.641   2.837 -11.195
  551   HH11  ARG  69          HH11      ARG  69  93.325   1.532 -12.909
  552   HH12  ARG  69          HH12      ARG  69  94.371   0.188 -12.594
  553   HH21  ARG  69          HH21      ARG  69  94.509   0.757  -9.176
  554   HH22  ARG  69          HH22      ARG  69  95.041  -0.250 -10.480
  555    H    THR  70           HN       THR  70  88.600   1.966  -6.085
  556    HA   THR  70           HA       THR  70  86.180   2.699  -7.709
  557    HB   THR  70           HB       THR  70  86.852   0.250  -7.282
  558    HG1  THR  70           HG1      THR  70  84.401   1.479  -6.904
  559   HG21  THR  70          HG21      THR  70  87.295   0.825  -4.780
  560   HG22  THR  70          HG22      THR  70  86.536  -0.715  -5.180
  561   HG23  THR  70          HG23      THR  70  85.550   0.631  -4.608
  562    H    TRP  71           HN       TRP  71  84.223   2.400  -5.995
  563    HA   TRP  71           HA       TRP  71  84.839   3.995  -3.554
  564    HB2  TRP  71           HB2      TRP  71  82.463   4.980  -3.943
  565    HB3  TRP  71           HB1      TRP  71  83.806   5.664  -4.834
  566    HD1  TRP  71           HD1      TRP  71  82.562   2.309  -6.086
  567    HE1  TRP  71           HE1      TRP  71  81.272   2.647  -8.243
  568    HE3  TRP  71           HE3      TRP  71  82.237   7.407  -6.138
  569    HZ2  TRP  71           HZ2      TRP  71  80.233   4.779  -9.848
  570    HZ3  TRP  71           HZ3      TRP  71  81.089   8.563  -8.006
  571    HH2  TRP  71           HH2      TRP  71  80.087   7.257  -9.859
  572    H    LEU  72           HN       LEU  72  84.706   2.272  -2.198
  573    HA   LEU  72           HA       LEU  72  82.967   0.073  -2.514
  574    HB2  LEU  72           HB2      LEU  72  84.110   1.162   0.053
  575    HB3  LEU  72           HB1      LEU  72  83.540  -0.481  -0.207
  576    HG   LEU  72           HG       LEU  72  85.704   0.759  -1.909
  577   HD11  LEU  72          HD11      LEU  72  87.366  -0.302  -0.492
  578   HD12  LEU  72          HD12      LEU  72  86.098  -0.912   0.574
  579   HD13  LEU  72          HD13      LEU  72  86.397   0.822   0.458
  580   HD21  LEU  72          HD21      LEU  72  86.308  -1.753  -2.080
  581   HD22  LEU  72          HD22      LEU  72  84.892  -1.184  -2.963
  582   HD23  LEU  72          HD23      LEU  72  84.693  -2.041  -1.432
  583    H    LEU  73           HN       LEU  73  81.001   1.030  -3.078
  584    HA   LEU  73           HA       LEU  73  79.357   2.017  -0.775
  585    HB2  LEU  73           HB2      LEU  73  77.887   3.088  -2.505
  586    HB3  LEU  73           HB1      LEU  73  79.506   3.773  -2.438
  587    HG   LEU  73           HG       LEU  73  79.920   1.852  -4.341
  588   HD11  LEU  73          HD11      LEU  73  77.152   2.849  -5.038
  589   HD12  LEU  73          HD12      LEU  73  77.361   1.345  -4.156
  590   HD13  LEU  73          HD13      LEU  73  78.066   1.527  -5.763
  591   HD21  LEU  73          HD21      LEU  73  79.737   3.621  -6.000
  592   HD22  LEU  73          HD22      LEU  73  80.364   4.316  -4.512
  593   HD23  LEU  73          HD23      LEU  73  78.678   4.555  -4.946
  594    H    LYS  74           HN       LYS  74  80.075  -0.657  -2.390
  595    HA   LYS  74           HA       LYS  74  77.371  -1.612  -3.030
  596    HB2  LYS  74           HB2      LYS  74  80.156  -2.740  -3.206
  597    HB3  LYS  74           HB1      LYS  74  78.801  -3.860  -3.193
  598    HG2  LYS  74           HG2      LYS  74  79.404  -3.282  -5.501
  599    HG3  LYS  74           HG1      LYS  74  77.795  -2.685  -5.115
  600    HD2  LYS  74           HD2      LYS  74  79.094  -0.980  -6.326
  601    HD3  LYS  74           HD1      LYS  74  78.720  -0.444  -4.692
  602    HE2  LYS  74           HE2      LYS  74  81.170  -0.173  -5.624
  603    HE3  LYS  74           HE1      LYS  74  80.918  -0.688  -3.960
  604    HZ1  LYS  74           HZ1      LYS  74  82.500  -2.006  -5.533
  605    HZ2  LYS  74           HZ2      LYS  74  81.054  -2.728  -6.060
  606    HZ3  LYS  74           HZ3      LYS  74  81.511  -2.826  -4.427
  607    H    THR  75           HN       THR  75  76.799  -1.022  -0.652
  608    HA   THR  75           HA       THR  75  77.690  -2.221   1.654
  609    HB   THR  75           HB       THR  75  74.758  -2.122   0.900
  610    HG1  THR  75           HG1      THR  75  76.073  -0.156   0.582
  611   HG21  THR  75          HG21      THR  75  76.153  -1.829   3.573
  612   HG22  THR  75          HG22      THR  75  75.380  -3.314   3.012
  613   HG23  THR  75          HG23      THR  75  74.412  -1.866   3.291
  614    H    HIS  76           HN       HIS  76  75.760  -3.799  -0.869
  615    HA   HIS  76           HA       HIS  76  75.274  -6.246   0.490
  616    HB2  HIS  76           HB2      HIS  76  75.790  -5.813  -2.470
  617    HB3  HIS  76           HB1      HIS  76  75.011  -7.225  -1.756
  618    HD1  HIS  76           HD1      HIS  76  74.496  -3.441  -1.477
  619    HD2  HIS  76           HD2      HIS  76  72.279  -6.944  -1.920
  620    HE1  HIS  76           HE1      HIS  76  72.064  -2.741  -1.590
  621    H    TRP  77           HN       TRP  77  76.406  -8.362  -0.229
  622    HA   TRP  77           HA       TRP  77  78.317  -9.675  -0.109
  623    HB2  TRP  77           HB2      TRP  77  79.457  -7.368  -1.709
  624    HB3  TRP  77           HB1      TRP  77  80.248  -8.912  -1.480
  625    HD1  TRP  77           HD1      TRP  77  77.751 -10.846  -1.909
  626    HE1  TRP  77           HE1      TRP  77  76.756 -11.100  -4.254
  627    HE3  TRP  77           HE3      TRP  77  79.478  -6.551  -4.077
  628    HZ2  TRP  77           HZ2      TRP  77  76.690  -9.687  -6.739
  629    HZ3  TRP  77           HZ3      TRP  77  78.936  -6.038  -6.441
  630    HH2  TRP  77           HH2      TRP  77  77.545  -7.600  -7.774
  631    H    THR  78           HN       THR  78  80.607  -9.694   0.689
  632    HA   THR  78           HA       THR  78  80.985  -7.639   2.840
  633    HB   THR  78           HB       THR  78  82.204 -10.286   3.355
  634    HG1  THR  78           HG1      THR  78  79.540 -10.561   3.700
  635   HG21  THR  78          HG21      THR  78  80.392  -8.381   4.826
  636   HG22  THR  78          HG22      THR  78  81.979  -9.006   5.279
  637   HG23  THR  78          HG23      THR  78  80.556 -10.041   5.378
  638    H    LEU  79           HN       LEU  79  83.469  -8.492   3.690
  639    HA   LEU  79           HA       LEU  79  85.240  -7.319   1.721
  640    HB2  LEU  79           HB2      LEU  79  85.722  -8.818   4.294
  641    HB3  LEU  79           HB1      LEU  79  87.039  -8.184   3.326
  642    HG   LEU  79           HG       LEU  79  86.319  -5.922   3.680
  643   HD11  LEU  79          HD11      LEU  79  83.856  -7.205   4.865
  644   HD12  LEU  79          HD12      LEU  79  83.931  -6.109   3.483
  645   HD13  LEU  79          HD13      LEU  79  84.255  -5.508   5.108
  646   HD21  LEU  79          HD21      LEU  79  86.313  -5.811   6.182
  647   HD22  LEU  79          HD22      LEU  79  87.551  -6.901   5.553
  648   HD23  LEU  79          HD23      LEU  79  86.059  -7.557   6.226
  649    H    ASP  80           HN       ASP  80  85.129 -10.523   3.233
  650    HA   ASP  80           HA       ASP  80  86.923 -11.968   1.723
  651    HB2  ASP  80           HB2      ASP  80  85.512 -12.858   3.565
  652    HB3  ASP  80           HB1      ASP  80  84.136 -12.892   2.463
  653    H    LYS  81           HN       LYS  81  83.510 -11.473   0.903
  654    HA   LYS  81           HA       LYS  81  83.380 -12.800  -1.516
  655    HB2  LYS  81           HB2      LYS  81  82.187 -10.056  -1.205
  656    HB3  LYS  81           HB1      LYS  81  81.528 -11.439  -2.070
  657    HG2  LYS  81           HG2      LYS  81  81.763 -11.076   0.917
  658    HG3  LYS  81           HG1      LYS  81  80.284 -11.250  -0.030
  659    HD2  LYS  81           HD2      LYS  81  81.150 -13.536  -0.720
  660    HD3  LYS  81           HD1      LYS  81  82.369 -13.355   0.538
  661    HE2  LYS  81           HE2      LYS  81  80.565 -14.535   1.562
  662    HE3  LYS  81           HE1      LYS  81  80.440 -12.874   2.143
  663    HZ1  LYS  81           HZ1      LYS  81  78.610 -12.464   0.873
  664    HZ2  LYS  81           HZ2      LYS  81  78.372 -14.119   1.175
  665    HZ3  LYS  81           HZ3      LYS  81  79.018 -13.607  -0.311
  666    H    TYR  82           HN       TYR  82  84.270  -9.387  -1.085
  667    HA   TYR  82           HA       TYR  82  85.115  -9.055  -3.829
  668    HB2  TYR  82           HB2      TYR  82  85.376  -7.467  -1.288
  669    HB3  TYR  82           HB1      TYR  82  86.361  -7.011  -2.673
  670    HD1  TYR  82           HD1      TYR  82  83.197  -6.604  -1.123
  671    HD2  TYR  82           HD2      TYR  82  85.084  -6.842  -4.976
  672    HE1  TYR  82           HE1      TYR  82  81.257  -5.446  -2.146
  673    HE2  TYR  82           HE2      TYR  82  83.143  -5.685  -5.997
  674    HH   TYR  82           HH       TYR  82  80.912  -3.985  -4.293
  675    H    GLY  83           HN       GLY  83  86.866  -9.689  -0.793
  676    HA2  GLY  83           HA2      GLY  83  88.793 -11.289  -0.945
  677    HA3  GLY  83           HA1      GLY  83  89.273 -10.459  -2.428
  678    H    ILE  84           HN       ILE  84  88.000  -8.233  -0.344
  679    HA   ILE  84           HA       ILE  84  90.448  -6.840   0.069
  680    HB   ILE  84           HB       ILE  84  87.833  -6.661   1.588
  681   HG12  ILE  84          HG12      ILE  84  88.766  -4.776  -0.580
  682   HG13  ILE  84          HG11      ILE  84  87.967  -6.287  -1.011
  683   HG21  ILE  84          HG21      ILE  84  89.518  -5.560   2.878
  684   HG22  ILE  84          HG22      ILE  84  88.682  -4.287   1.993
  685   HG23  ILE  84          HG23      ILE  84  90.257  -4.855   1.441
  686   HD11  ILE  84          HD11      ILE  84  86.461  -4.219  -0.723
  687   HD12  ILE  84          HD12      ILE  84  86.770  -4.386   1.006
  688   HD13  ILE  84          HD13      ILE  84  85.971  -5.688   0.123
  689    H    GLN  85           HN       GLN  85  91.457  -6.413   2.192
  690    HA   GLN  85           HA       GLN  85  90.976  -8.079   4.473
  691    HB2  GLN  85           HB2      GLN  85  92.127  -9.574   2.535
  692    HB3  GLN  85           HB1      GLN  85  93.583  -8.857   3.211
  693    HG2  GLN  85           HG2      GLN  85  93.407 -10.733   4.578
  694    HG3  GLN  85           HG1      GLN  85  92.461  -9.589   5.525
  695   HE21  GLN  85          HE21      GLN  85  90.085  -9.526   4.015
  696   HE22  GLN  85          HE22      GLN  85  89.349 -11.046   4.079
  697    H    ALA  86           HN       ALA  86  93.511  -8.158   5.575
  698    HA   ALA  86           HA       ALA  86  93.927  -5.417   6.328
  699    HB1  ALA  86           HB1      ALA  86  95.562  -6.264   7.802
  700    HB2  ALA  86           HB2      ALA  86  95.937  -7.626   6.741
  701    HB3  ALA  86           HB3      ALA  86  94.423  -7.598   7.639
  702    H    ASP  87           HN       ASP  87  95.240  -7.428   3.826
  703    HA   ASP  87           HA       ASP  87  97.643  -5.827   3.432
  704    HB2  ASP  87           HB2      ASP  87  97.693  -7.112   1.219
  705    HB3  ASP  87           HB1      ASP  87  97.756  -8.095   2.683
  706    H    ALA  88           HN       ALA  88  94.361  -5.445   2.768
  707    HA   ALA  88           HA       ALA  88  94.833  -3.650   0.431
  708    HB1  ALA  88           HB1      ALA  88  92.988  -4.927  -0.126
  709    HB2  ALA  88           HB2      ALA  88  92.144  -3.658   0.760
  710    HB3  ALA  88           HB3      ALA  88  92.546  -5.182   1.558
  711    H    LYS  89           HN       LYS  89  95.317  -1.573   1.052
  712    HA   LYS  89           HA       LYS  89  94.151  -0.514   3.579
  713    HB2  LYS  89           HB2      LYS  89  96.093   0.995   1.837
  714    HB3  LYS  89           HB1      LYS  89  95.820   1.137   3.572
  715    HG2  LYS  89           HG2      LYS  89  96.971  -1.348   2.282
  716    HG3  LYS  89           HG1      LYS  89  97.953  -0.034   2.889
  717    HD2  LYS  89           HD2      LYS  89  97.420  -0.448   5.122
  718    HD3  LYS  89           HD1      LYS  89  95.905  -1.244   4.718
  719    HE2  LYS  89           HE2      LYS  89  97.545  -2.896   5.471
  720    HE3  LYS  89           HE1      LYS  89  97.143  -3.140   3.771
  721    HZ1  LYS  89           HZ1      LYS  89  99.341  -1.332   4.219
  722    HZ2  LYS  89           HZ2      LYS  89  99.204  -2.627   3.127
  723    HZ3  LYS  89           HZ3      LYS  89  99.644  -2.916   4.743
  724    H    LEU  90           HN       LEU  90  92.340   0.545   3.460
  725    HA   LEU  90           HA       LEU  90  91.474   1.787   0.908
  726    HB2  LEU  90           HB2      LEU  90  89.778   1.774   3.385
  727    HB3  LEU  90           HB1      LEU  90  89.286   1.675   1.697
  728    HG   LEU  90           HG       LEU  90  90.658  -0.485   3.301
  729   HD11  LEU  90          HD11      LEU  90  88.273  -0.203   3.823
  730   HD12  LEU  90          HD12      LEU  90  88.530  -1.700   2.926
  731   HD13  LEU  90          HD13      LEU  90  87.880  -0.281   2.106
  732   HD21  LEU  90          HD21      LEU  90  89.910  -0.275   0.379
  733   HD22  LEU  90          HD22      LEU  90  90.125  -1.836   1.173
  734   HD23  LEU  90          HD23      LEU  90  91.473  -0.706   1.072
  735    H    GLN  91           HN       GLN  91  90.158   3.904   1.382
  736    HA   GLN  91           HA       GLN  91  91.660   5.669   3.273
  737    HB2  GLN  91           HB2      GLN  91  90.726   6.567   0.536
  738    HB3  GLN  91           HB1      GLN  91  91.799   7.419   1.639
  739    HG2  GLN  91           HG2      GLN  91  93.645   6.110   1.074
  740    HG3  GLN  91           HG1      GLN  91  92.666   4.744   0.590
  741   HE21  GLN  91          HE21      GLN  91  91.479   7.707  -0.602
  742   HE22  GLN  91          HE22      GLN  91  92.064   7.557  -2.175
  743    H    PHE  92           HN       PHE  92  90.329   7.571   3.887
  744    HA   PHE  92           HA       PHE  92  87.410   6.964   3.664
  745    HB2  PHE  92           HB2      PHE  92  87.664   7.172   5.926
  746    HB3  PHE  92           HB1      PHE  92  89.169   8.025   5.780
  747    HD1  PHE  92           HD1      PHE  92  89.077  10.553   5.158
  748    HD2  PHE  92           HD2      PHE  92  85.682   8.309   6.516
  749    HE1  PHE  92           HE1      PHE  92  87.942  12.657   5.785
  750    HE2  PHE  92           HE2      PHE  92  84.549  10.422   7.153
  751    HZ   PHE  92           HZ       PHE  92  85.676  12.594   6.785
  752    H    THR  93           HN       THR  93  86.574   7.987   1.950
  753    HA   THR  93           HA       THR  93  86.830  10.887   1.703
  754    HB   THR  93           HB       THR  93  88.700  10.762   0.367
  755    HG1  THR  93           HG1      THR  93  87.858  11.154  -1.492
  756   HG21  THR  93          HG21      THR  93  89.353   8.541   0.816
  757   HG22  THR  93          HG22      THR  93  89.207   8.587  -0.941
  758   HG23  THR  93          HG23      THR  93  87.924   7.867   0.031
  759    HA   PRO  94           HA       PRO  94  82.811  10.699  -0.074
  760    HB2  PRO  94           HB2      PRO  94  83.294  12.075  -2.547
  761    HB3  PRO  94           HB1      PRO  94  82.711  12.781  -1.031
  762    HG2  PRO  94           HG2      PRO  94  85.459  12.723  -2.152
  763    HG3  PRO  94           HG1      PRO  94  84.690  13.931  -1.107
  764    HD2  PRO  94           HD2      PRO  94  86.540  12.225  -0.147
  765    HD3  PRO  94           HD1      PRO  94  85.156  12.732   0.847
  766    H    TYR 541           HT1      TYR 541  52.238  34.343  12.274
  767    HA   TYR 541           HA       TYR 541  50.294  36.292  13.154
  768    HB2  TYR 541           HB2      TYR 541  53.018  35.493  13.642
  769    HB3  TYR 541           HB1      TYR 541  53.051  37.184  13.159
  770    HD1  TYR 541           HD1      TYR 541  51.095  38.659  14.280
  771    HD2  TYR 541           HD2      TYR 541  52.706  35.025  15.915
  772    HE1  TYR 541           HE1      TYR 541  50.309  39.324  16.537
  773    HE2  TYR 541           HE2      TYR 541  51.920  35.692  18.170
  774    HH   TYR 541           HH       TYR 541  49.737  37.581  18.871
  775    H    HIS 542           HN       HIS 542  51.891  38.598  12.459
  776    HA   HIS 542           HA       HIS 542  50.740  39.223   9.911
  777    HB2  HIS 542           HB2      HIS 542  52.879  40.596  11.559
  778    HB3  HIS 542           HB1      HIS 542  52.157  41.287  10.111
  779    HD1  HIS 542           HD1      HIS 542  49.699  39.325  11.906
  780    HD2  HIS 542           HD2      HIS 542  51.133  43.231  12.171
  781    HE1  HIS 542           HE1      HIS 542  47.996  40.623  13.259
  782    H    GLU 543           HN       GLU 543  53.927  40.349   9.902
  783    HA   GLU 543           HA       GLU 543  54.631  39.390   7.397
  784    HB2  GLU 543           HB2      GLU 543  57.100  39.404   8.746
  785    HB3  GLU 543           HB1      GLU 543  56.354  40.785   7.947
  786    HG2  GLU 543           HG2      GLU 543  55.308  41.506   9.992
  787    HG3  GLU 543           HG1      GLU 543  55.776  40.021  10.821
  788    H    ARG 544           HN       ARG 544  54.572  37.601  10.372
  789    HA   ARG 544           HA       ARG 544  56.185  35.388   9.333
  790    HB2  ARG 544           HB2      ARG 544  54.460  35.686  11.812
  791    HB3  ARG 544           HB1      ARG 544  55.367  34.232  11.429
  792    HG2  ARG 544           HG2      ARG 544  56.883  35.357  12.804
  793    HG3  ARG 544           HG1      ARG 544  57.415  35.868  11.207
  794    HD2  ARG 544           HD2      ARG 544  57.183  38.006  11.953
  795    HD3  ARG 544           HD1      ARG 544  55.443  37.749  11.910
  796    HE   ARG 544           HE       ARG 544  56.213  36.689  14.353
  797   HH11  ARG 544          HH11      ARG 544  56.306  37.933  16.242
  798   HH12  ARG 544          HH12      ARG 544  56.501  39.650  16.122
  799   HH21  ARG 544          HH21      ARG 544  56.593  39.665  12.656
  800   HH22  ARG 544          HH22      ARG 544  56.663  40.630  14.092
  801    H    ARG 545           HN       ARG 545  55.355  33.987   7.870
  802    HA   ARG 545           HA       ARG 545  52.463  33.267   8.025
  803    HB2  ARG 545           HB2      ARG 545  53.343  33.130   5.290
  804    HB3  ARG 545           HB1      ARG 545  52.125  34.187   5.982
  805    HG2  ARG 545           HG2      ARG 545  53.770  35.564   4.892
  806    HG3  ARG 545           HG1      ARG 545  53.949  35.787   6.628
  807    HD2  ARG 545           HD2      ARG 545  56.088  34.977   6.579
  808    HD3  ARG 545           HD1      ARG 545  55.614  33.571   5.626
  809    HE   ARG 545           HE       ARG 545  55.563  35.664   3.807
  810   HH11  ARG 545          HH11      ARG 545  57.369  36.245   2.582
  811   HH12  ARG 545          HH12      ARG 545  58.955  35.857   3.162
  812   HH21  ARG 545          HH21      ARG 545  57.811  34.337   6.060
  813   HH22  ARG 545          HH22      ARG 545  59.205  34.777   5.131
  814    H    GLY 546           HN       GLY 546  55.736  32.347   7.106
  815    HA2  GLY 546           HA2      GLY 546  55.304  29.815   5.996
  816    HA3  GLY 546           HA1      GLY 546  56.726  30.223   6.951
  817    H    SER 547           HN       SER 547  56.992  29.121   8.821
  818    HA   SER 547           HA       SER 547  54.763  28.293  10.497
  819    HB2  SER 547           HB2      SER 547  56.049  26.372   8.593
  820    HB3  SER 547           HB1      SER 547  55.668  25.782  10.209
  821    HG   SER 547           HG       SER 547  54.022  26.377   8.116
  822    H    LEU 548           HN       LEU 548  55.680  28.629  12.481
  823    HA   LEU 548           HA       LEU 548  58.459  28.944  12.855
  824    HB2  LEU 548           HB2      LEU 548  56.068  28.786  14.588
  825    HB3  LEU 548           HB1      LEU 548  57.561  28.320  15.391
  826    HG   LEU 548           HG       LEU 548  58.577  30.487  14.501
  827   HD11  LEU 548          HD11      LEU 548  56.763  32.251  14.014
  828   HD12  LEU 548          HD12      LEU 548  55.698  30.882  13.706
  829   HD13  LEU 548          HD13      LEU 548  57.150  31.107  12.738
  830   HD21  LEU 548          HD21      LEU 548  57.578  30.112  16.841
  831   HD22  LEU 548          HD22      LEU 548  56.181  31.007  16.247
  832   HD23  LEU 548          HD23      LEU 548  57.769  31.777  16.295
  833    H    CYS 549           HN       CYS 549  60.109  27.566  13.352
  834    HA   CYS 549           HA       CYS 549  59.536  24.679  13.204
  835    HB2  CYS 549           HB2      CYS 549  61.535  25.253  12.078
  836    HB3  CYS 549           HB1      CYS 549  62.002  26.416  13.304
  837    H    SER 550           HN       SER 550  58.589  24.032  15.065
  838    HA   SER 550           HA       SER 550  58.806  25.174  17.590
  839    HB2  SER 550           HB2      SER 550  57.096  23.592  17.272
  840    HB3  SER 550           HB1      SER 550  58.221  22.319  16.816
  841    HG   SER 550           HG       SER 550  58.881  23.330  19.214
  842    H    GLY 551           HN       GLY 551  60.308  25.331  19.017
  843    HA2  GLY 551           HA2      GLY 551  62.124  24.331  20.389
  844    HA3  GLY 551           HA1      GLY 551  62.678  23.495  18.932
  845    H    CYS 552           HN       CYS 552  62.141  25.661  17.175
  846    HA   CYS 552           HA       CYS 552  64.414  27.483  17.837
  847    HB2  CYS 552           HB2      CYS 552  63.135  26.454  15.315
  848    HB3  CYS 552           HB1      CYS 552  64.030  27.964  15.283
  849    H    GLN 553           HN       GLN 553  61.076  27.220  16.806
  850    HA   GLN 553           HA       GLN 553  59.383  28.742  16.637
  851    HB2  GLN 553           HB2      GLN 553  60.944  30.068  18.836
  852    HB3  GLN 553           HB1      GLN 553  59.315  30.541  18.346
  853    HG2  GLN 553           HG2      GLN 553  60.071  27.737  19.170
  854    HG3  GLN 553           HG1      GLN 553  59.367  28.910  20.263
  855   HE21  GLN 553          HE21      GLN 553  58.740  27.003  17.347
  856   HE22  GLN 553          HE22      GLN 553  57.046  27.093  17.432
  857    H    LYS 554           HN       LYS 554  60.787  28.957  14.641
  858    HA   LYS 554           HA       LYS 554  60.926  31.851  14.015
  859    HB2  LYS 554           HB2      LYS 554  63.038  29.829  13.220
  860    HB3  LYS 554           HB1      LYS 554  62.971  31.488  12.643
  861    HG2  LYS 554           HG2      LYS 554  63.190  30.718  15.563
  862    HG3  LYS 554           HG1      LYS 554  64.570  31.132  14.552
  863    HD2  LYS 554           HD2      LYS 554  63.198  33.322  14.043
  864    HD3  LYS 554           HD1      LYS 554  62.332  32.899  15.518
  865    HE2  LYS 554           HE2      LYS 554  64.214  34.410  16.013
  866    HE3  LYS 554           HE1      LYS 554  64.467  32.831  16.756
  867    HZ1  LYS 554           HZ1      LYS 554  66.275  32.498  15.536
  868    HZ2  LYS 554           HZ2      LYS 554  66.190  34.131  15.075
  869    HZ3  LYS 554           HZ3      LYS 554  65.489  32.932  14.097
  870    HA   PRO 555           HA       PRO 555  58.086  30.137  10.903
  871    HB2  PRO 555           HB2      PRO 555  59.148  32.324   9.202
  872    HB3  PRO 555           HB1      PRO 555  57.472  31.905   9.573
  873    HG2  PRO 555           HG2      PRO 555  58.789  34.028  10.722
  874    HG3  PRO 555           HG1      PRO 555  57.454  33.177  11.505
  875    HD2  PRO 555           HD2      PRO 555  60.313  33.178  12.236
  876    HD3  PRO 555           HD1      PRO 555  58.920  32.607  13.189
  877    H    ILE 556           HN       ILE 556  58.323  28.593   9.471
  878    HA   ILE 556           HA       ILE 556  60.974  28.042   8.264
  879    HB   ILE 556           HB       ILE 556  58.390  26.458   8.484
  880   HG12  ILE 556          HG12      ILE 556  61.056  25.686   9.669
  881   HG13  ILE 556          HG11      ILE 556  60.064  26.857  10.512
  882   HG21  ILE 556          HG21      ILE 556  59.414  25.778   6.444
  883   HG22  ILE 556          HG22      ILE 556  59.870  24.578   7.651
  884   HG23  ILE 556          HG23      ILE 556  61.026  25.811   7.160
  885   HD11  ILE 556          HD11      ILE 556  58.476  25.294  11.100
  886   HD12  ILE 556          HD12      ILE 556  59.830  24.188  10.908
  887   HD13  ILE 556          HD13      ILE 556  58.663  24.378   9.603
  888    H    THR 557           HN       THR 557  61.070  29.465   6.481
  889    HA   THR 557           HA       THR 557  58.736  29.565   4.632
  890    HB   THR 557           HB       THR 557  59.623  31.585   3.830
  891    HG1  THR 557           HG1      THR 557  62.066  30.733   4.994
  892   HG21  THR 557          HG21      THR 557  59.960  32.882   5.817
  893   HG22  THR 557          HG22      THR 557  60.610  31.490   6.685
  894   HG23  THR 557          HG23      THR 557  58.898  31.546   6.269
  895    H    GLY 558           HN       GLY 558  58.961  27.583   3.599
  896    HA2  GLY 558           HA2      GLY 558  60.115  27.358   1.153
  897    HA3  GLY 558           HA1      GLY 558  61.438  26.853   2.213
  898    H    ARG 559           HN       ARG 559  61.293  24.911   3.278
  899    HA   ARG 559           HA       ARG 559  58.957  23.155   2.637
  900    HB2  ARG 559           HB2      ARG 559  61.921  22.679   2.875
  901    HB3  ARG 559           HB1      ARG 559  60.829  21.364   3.307
  902    HG2  ARG 559           HG2      ARG 559  60.419  22.830   0.707
  903    HG3  ARG 559           HG1      ARG 559  61.687  21.612   0.817
  904    HD2  ARG 559           HD2      ARG 559  60.137  19.885   1.339
  905    HD3  ARG 559           HD1      ARG 559  58.853  21.038   1.698
  906    HE   ARG 559           HE       ARG 559  59.462  21.521  -0.966
  907   HH11  ARG 559          HH11      ARG 559  58.434  20.438  -2.667
  908   HH12  ARG 559          HH12      ARG 559  57.722  18.885  -2.381
  909   HH21  ARG 559          HH21      ARG 559  58.620  18.796   0.967
  910   HH22  ARG 559          HH22      ARG 559  57.829  17.954  -0.324
  911    H    CYS 560           HN       CYS 560  58.171  21.873   4.436
  912    HA   CYS 560           HA       CYS 560  59.349  22.488   7.082
  913    HB2  CYS 560           HB2      CYS 560  57.135  23.071   8.025
  914    HB3  CYS 560           HB1      CYS 560  57.697  24.243   6.828
  915    HG   CYS 560           HG       CYS 560  55.783  21.992   5.848
  916    H    ILE 561           HN       ILE 561  59.501  20.782   8.261
  917    HA   ILE 561           HA       ILE 561  58.013  18.339   7.540
  918    HB   ILE 561           HB       ILE 561  60.207  18.898   9.559
  919   HG12  ILE 561          HG12      ILE 561  60.131  17.586   6.847
  920   HG13  ILE 561          HG11      ILE 561  60.888  19.123   7.229
  921   HG21  ILE 561          HG21      ILE 561  58.697  16.949  10.172
  922   HG22  ILE 561          HG22      ILE 561  60.370  16.499   9.852
  923   HG23  ILE 561          HG23      ILE 561  59.136  16.220   8.624
  924   HD11  ILE 561          HD11      ILE 561  61.709  16.373   8.181
  925   HD12  ILE 561          HD12      ILE 561  62.318  17.866   8.899
  926   HD13  ILE 561          HD13      ILE 561  62.652  17.506   7.206
  927    H    THR 562           HN       THR 562  56.640  17.364   8.965
  928    HA   THR 562           HA       THR 562  55.760  18.991  11.317
  929    HB   THR 562           HB       THR 562  53.946  17.124   9.808
  930    HG1  THR 562           HG1      THR 562  53.473  19.735   9.387
  931   HG21  THR 562          HG21      THR 562  53.465  17.905  12.186
  932   HG22  THR 562          HG22      THR 562  52.212  18.269  10.996
  933   HG23  THR 562          HG23      THR 562  53.324  19.535  11.519
  934    H    ALA 563           HN       ALA 563  55.265  17.924  13.167
  935    HA   ALA 563           HA       ALA 563  56.062  15.047  13.310
  936    HB1  ALA 563           HB1      ALA 563  56.494  17.191  15.393
  937    HB2  ALA 563           HB2      ALA 563  57.727  16.668  14.242
  938    HB3  ALA 563           HB3      ALA 563  57.094  15.531  15.442
  939    H    MET 564           HN       MET 564  55.367  15.810  16.292
  940    HA   MET 564           HA       MET 564  52.817  14.511  16.372
  941    HB2  MET 564           HB2      MET 564  53.818  16.332  18.548
  942    HB3  MET 564           HB1      MET 564  52.973  14.790  18.692
  943    HG2  MET 564           HG2      MET 564  55.063  13.751  17.588
  944    HG3  MET 564           HG1      MET 564  55.850  15.288  17.941
  945    HE1  MET 564           HE1      MET 564  54.372  12.048  20.770
  946    HE2  MET 564           HE2      MET 564  55.375  11.761  19.350
  947    HE3  MET 564           HE3      MET 564  53.767  12.455  19.158
  948    H    ALA 565           HN       ALA 565  53.126  16.946  14.757
  949    HA   ALA 565           HA       ALA 565  51.281  18.338  14.013
  950    HB1  ALA 565           HB1      ALA 565  50.862  19.051  16.927
  951    HB2  ALA 565           HB2      ALA 565  49.905  17.818  16.096
  952    HB3  ALA 565           HB3      ALA 565  49.854  19.491  15.552
  953    H    LYS 566           HN       LYS 566  54.033  18.505  15.871
  954    HA   LYS 566           HA       LYS 566  54.309  21.436  15.850
  955    HB2  LYS 566           HB2      LYS 566  55.921  19.088  16.758
  956    HB3  LYS 566           HB1      LYS 566  56.829  20.532  16.330
  957    HG2  LYS 566           HG2      LYS 566  55.740  21.845  17.971
  958    HG3  LYS 566           HG1      LYS 566  54.454  20.661  18.190
  959    HD2  LYS 566           HD2      LYS 566  57.293  19.815  18.729
  960    HD3  LYS 566           HD1      LYS 566  56.470  20.811  19.921
  961    HE2  LYS 566           HE2      LYS 566  54.858  19.171  20.376
  962    HE3  LYS 566           HE1      LYS 566  55.063  18.387  18.805
  963    HZ1  LYS 566           HZ1      LYS 566  56.063  17.043  20.496
  964    HZ2  LYS 566           HZ2      LYS 566  56.977  18.351  21.081
  965    HZ3  LYS 566           HZ3      LYS 566  57.300  17.705  19.543
  966    H    LYS 567           HN       LYS 567  56.146  22.427  14.631
  967    HA   LYS 567           HA       LYS 567  56.449  21.143  11.945
  968    HB2  LYS 567           HB2      LYS 567  57.128  24.002  12.548
  969    HB3  LYS 567           HB1      LYS 567  56.594  23.297  11.034
  970    HG2  LYS 567           HG2      LYS 567  54.884  23.689  13.517
  971    HG3  LYS 567           HG1      LYS 567  54.798  24.641  12.046
  972    HD2  LYS 567           HD2      LYS 567  54.236  21.648  12.194
  973    HD3  LYS 567           HD1      LYS 567  53.012  22.916  12.137
  974    HE2  LYS 567           HE2      LYS 567  54.219  23.699   9.975
  975    HE3  LYS 567           HE1      LYS 567  54.959  22.100   9.997
  976    HZ1  LYS 567           HZ1      LYS 567  52.634  21.211  10.225
  977    HZ2  LYS 567           HZ2      LYS 567  53.016  21.902   8.720
  978    HZ3  LYS 567           HZ3      LYS 567  52.082  22.769   9.843
  979    H    PHE 568           HN       PHE 568  58.738  21.856  10.947
  980    HA   PHE 568           HA       PHE 568  60.822  22.107  13.007
  981    HB2  PHE 568           HB2      PHE 568  59.982  19.477  11.978
  982    HB3  PHE 568           HB1      PHE 568  61.699  19.736  11.752
  983    HD1  PHE 568           HD1      PHE 568  63.103  20.419  13.772
  984    HD2  PHE 568           HD2      PHE 568  59.065  18.992  14.120
  985    HE1  PHE 568           HE1      PHE 568  63.481  19.930  16.174
  986    HE2  PHE 568           HE2      PHE 568  59.445  18.503  16.522
  987    HZ   PHE 568           HZ       PHE 568  61.653  18.973  17.549
  988    H    HIS 569           HN       HIS 569  62.606  23.024  12.136
  989    HA   HIS 569           HA       HIS 569  62.701  23.979   9.477
  990    HB2  HIS 569           HB2      HIS 569  64.760  23.446  11.583
  991    HB3  HIS 569           HB1      HIS 569  65.313  23.849   9.970
  992    HD2  HIS 569           HD2      HIS 569  63.791  26.416   9.100
  993    HE1  HIS 569           HE1      HIS 569  64.267  27.890  13.019
  994    HA   PRO 570           HA       PRO 570  63.047  19.758   7.732
  995    HB2  PRO 570           HB2      PRO 570  64.133  21.274   5.394
  996    HB3  PRO 570           HB1      PRO 570  62.840  20.066   5.447
  997    HG2  PRO 570           HG2      PRO 570  62.344  22.736   5.176
  998    HG3  PRO 570           HG1      PRO 570  61.219  21.627   5.969
  999    HD2  PRO 570           HD2      PRO 570  62.922  23.727   7.185
 1000    HD3  PRO 570           HD1      PRO 570  61.467  22.935   7.838
 1001    H    GLU 571           HN       GLU 571  65.458  22.105   8.319
 1002    HA   GLU 571           HA       GLU 571  67.713  20.356   7.547
 1003    HB2  GLU 571           HB2      GLU 571  67.984  23.026   8.910
 1004    HB3  GLU 571           HB1      GLU 571  69.070  22.250   7.759
 1005    HG2  GLU 571           HG2      GLU 571  67.208  22.459   6.045
 1006    HG3  GLU 571           HG1      GLU 571  66.376  23.489   7.216
 1007    H    HIS 572           HN       HIS 572  66.577  22.114  10.424
 1008    HA   HIS 572           HA       HIS 572  68.450  20.942  12.227
 1009    HB2  HIS 572           HB2      HIS 572  65.652  21.886  12.935
 1010    HB3  HIS 572           HB1      HIS 572  67.048  21.805  14.010
 1011    HD2  HIS 572           HD2      HIS 572  69.011  23.047  11.408
 1012    HE1  HIS 572           HE1      HIS 572  66.913  26.585  12.312
 1013    H    PHE 573           HN       PHE 573  66.103  19.398  10.496
 1014    HA   PHE 573           HA       PHE 573  66.110  17.094  12.422
 1015    HB2  PHE 573           HB2      PHE 573  63.868  18.404  12.163
 1016    HB3  PHE 573           HB1      PHE 573  63.805  17.661  10.574
 1017    HD1  PHE 573           HD1      PHE 573  63.258  15.347  10.290
 1018    HD2  PHE 573           HD2      PHE 573  63.974  16.947  14.212
 1019    HE1  PHE 573           HE1      PHE 573  62.404  13.250  11.302
 1020    HE2  PHE 573           HE2      PHE 573  63.120  14.849  15.223
 1021    HZ   PHE 573           HZ       PHE 573  62.335  13.001  13.768
 1022    H    VAL 574           HN       VAL 574  68.061  17.144  10.716
 1023    HA   VAL 574           HA       VAL 574  67.341  15.941   8.129
 1024    HB   VAL 574           HB       VAL 574  69.815  16.043   7.742
 1025   HG11  VAL 574          HG11      VAL 574  69.604  18.795   8.261
 1026   HG12  VAL 574          HG12      VAL 574  67.933  18.258   8.080
 1027   HG13  VAL 574          HG13      VAL 574  69.093  17.975   6.803
 1028   HG21  VAL 574          HG21      VAL 574  70.415  15.885  10.178
 1029   HG22  VAL 574          HG22      VAL 574  69.794  17.531  10.399
 1030   HG23  VAL 574          HG23      VAL 574  71.196  17.241   9.362
 1031    H    CYS 575           HN       CYS 575  69.007  14.131   7.464
 1032    HA   CYS 575           HA       CYS 575  68.681  11.873   9.320
 1033    HB2  CYS 575           HB2      CYS 575  68.540  10.852   7.289
 1034    HB3  CYS 575           HB1      CYS 575  69.210  12.270   6.487
 1035    H    ALA 576           HN       ALA 576  70.453  10.787  10.416
 1036    HA   ALA 576           HA       ALA 576  72.880  12.546  10.564
 1037    HB1  ALA 576           HB1      ALA 576  71.609  10.438  12.268
 1038    HB2  ALA 576           HB2      ALA 576  72.383  11.947  12.744
 1039    HB3  ALA 576           HB3      ALA 576  73.369  10.541  12.345
 1040    H    PHE 577           HN       PHE 577  73.335  11.897   8.339
 1041    HA   PHE 577           HA       PHE 577  75.461   9.905   8.220
 1042    HB2  PHE 577           HB2      PHE 577  73.524   8.537   7.390
 1043    HB3  PHE 577           HB1      PHE 577  73.191   9.774   6.191
 1044    HD1  PHE 577           HD1      PHE 577  75.696   7.217   7.260
 1045    HD2  PHE 577           HD2      PHE 577  74.462   9.961   4.187
 1046    HE1  PHE 577           HE1      PHE 577  77.317   6.199   5.698
 1047    HE2  PHE 577           HE2      PHE 577  76.088   8.930   2.625
 1048    HZ   PHE 577           HZ       PHE 577  77.516   7.054   3.381
 1049    H    CYS 578           HN       CYS 578  73.283  11.653   6.183
 1050    HA   CYS 578           HA       CYS 578  75.393  13.551   5.252
 1051    HB2  CYS 578           HB2      CYS 578  73.955  13.839   3.243
 1052    HB3  CYS 578           HB1      CYS 578  74.441  12.163   3.398
 1053    H    LEU 579           HN       LEU 579  74.859  14.642   7.275
 1054    HA   LEU 579           HA       LEU 579  72.378  15.395   8.234
 1055    HB2  LEU 579           HB2      LEU 579  74.986  16.912   8.317
 1056    HB3  LEU 579           HB1      LEU 579  73.595  17.267   9.342
 1057    HG   LEU 579           HG       LEU 579  74.592  14.425   9.261
 1058   HD11  LEU 579          HD11      LEU 579  76.098  15.130  11.268
 1059   HD12  LEU 579          HD12      LEU 579  76.036  16.733  10.541
 1060   HD13  LEU 579          HD13      LEU 579  76.697  15.382   9.629
 1061   HD21  LEU 579          HD21      LEU 579  73.500  16.214  11.463
 1062   HD22  LEU 579          HD22      LEU 579  73.856  14.493  11.621
 1063   HD23  LEU 579          HD23      LEU 579  72.568  15.031  10.544
 1064    H    LYS 580           HN       LYS 580  72.851  16.109   5.098
 1065    HA   LYS 580           HA       LYS 580  72.216  18.999   5.312
 1066    HB2  LYS 580           HB2      LYS 580  72.749  19.180   3.080
 1067    HB3  LYS 580           HB1      LYS 580  73.658  17.731   3.467
 1068    HG2  LYS 580           HG2      LYS 580  70.855  17.672   2.267
 1069    HG3  LYS 580           HG1      LYS 580  72.331  17.618   1.322
 1070    HD2  LYS 580           HD2      LYS 580  72.927  15.509   2.079
 1071    HD3  LYS 580           HD1      LYS 580  72.001  15.659   3.570
 1072    HE2  LYS 580           HE2      LYS 580  71.092  14.121   1.653
 1073    HE3  LYS 580           HE1      LYS 580  69.979  15.176   2.523
 1074    HZ1  LYS 580           HZ1      LYS 580  70.100  15.138  -0.096
 1075    HZ2  LYS 580           HZ2      LYS 580  71.325  16.282   0.182
 1076    HZ3  LYS 580           HZ3      LYS 580  69.753  16.559   0.762
 1077    H    GLN 581           HN       GLN 581  70.356  16.013   4.409
 1078    HA   GLN 581           HA       GLN 581  67.967  17.563   5.022
 1079    HB2  GLN 581           HB2      GLN 581  68.515  18.222   2.690
 1080    HB3  GLN 581           HB1      GLN 581  68.147  16.570   2.199
 1081    HG2  GLN 581           HG2      GLN 581  66.119  17.781   1.902
 1082    HG3  GLN 581           HG1      GLN 581  65.895  16.905   3.403
 1083   HE21  GLN 581          HE21      GLN 581  66.343  18.180   5.451
 1084   HE22  GLN 581          HE22      GLN 581  66.053  19.845   5.423
 1085    H    LEU 582           HN       LEU 582  66.235  16.475   5.569
 1086    HA   LEU 582           HA       LEU 582  65.999  13.593   4.914
 1087    HB2  LEU 582           HB2      LEU 582  66.995  13.988   7.216
 1088    HB3  LEU 582           HB1      LEU 582  65.458  14.700   7.673
 1089    HG   LEU 582           HG       LEU 582  64.329  12.566   7.145
 1090   HD11  LEU 582          HD11      LEU 582  65.419  11.302   5.578
 1091   HD12  LEU 582          HD12      LEU 582  66.258  10.616   6.966
 1092   HD13  LEU 582          HD13      LEU 582  67.001  11.914   6.037
 1093   HD21  LEU 582          HD21      LEU 582  65.690  11.184   8.945
 1094   HD22  LEU 582          HD22      LEU 582  64.848  12.663   9.401
 1095   HD23  LEU 582          HD23      LEU 582  66.583  12.694   9.123
 1096    H    ASN 583           HN       ASN 583  63.694  12.852   5.511
 1097    HA   ASN 583           HA       ASN 583  61.686  15.037   5.516
 1098    HB2  ASN 583           HB2      ASN 583  62.165  13.115   3.237
 1099    HB3  ASN 583           HB1      ASN 583  60.542  13.723   3.541
 1100   HD21  ASN 583          HD21      ASN 583  61.700  14.422   1.150
 1101   HD22  ASN 583          HD22      ASN 583  62.153  16.053   1.165
 1102    H    LYS 584           HN       LYS 584  59.978  14.432   6.759
 1103    HA   LYS 584           HA       LYS 584  59.908  12.099   8.302
 1104    HB2  LYS 584           HB2      LYS 584  57.475  12.629   8.591
 1105    HB3  LYS 584           HB1      LYS 584  58.535  14.014   8.841
 1106    HG2  LYS 584           HG2      LYS 584  57.675  15.154   7.042
 1107    HG3  LYS 584           HG1      LYS 584  57.715  13.728   6.003
 1108    HD2  LYS 584           HD2      LYS 584  55.416  14.377   6.252
 1109    HD3  LYS 584           HD1      LYS 584  55.654  12.911   7.195
 1110    HE2  LYS 584           HE2      LYS 584  54.433  14.324   8.645
 1111    HE3  LYS 584           HE1      LYS 584  56.100  14.503   9.191
 1112    HZ1  LYS 584           HZ1      LYS 584  54.395  16.395   7.763
 1113    HZ2  LYS 584           HZ2      LYS 584  56.049  16.398   7.374
 1114    HZ3  LYS 584           HZ3      LYS 584  55.548  16.676   8.974
 1115    H    GLY 585           HN       GLY 585  59.161  12.516   4.986
 1116    HA2  GLY 585           HA2      GLY 585  57.432  10.142   4.815
 1117    HA3  GLY 585           HA1      GLY 585  57.929  11.174   3.476
 1118    H    THR 586           HN       THR 586  60.730  10.988   4.589
 1119    HA   THR 586           HA       THR 586  61.408   8.192   3.768
 1120    HB   THR 586           HB       THR 586  62.968   8.901   2.186
 1121    HG1  THR 586           HG1      THR 586  63.171  11.021   3.928
 1122   HG21  THR 586          HG21      THR 586  61.011  11.221   2.150
 1123   HG22  THR 586          HG22      THR 586  60.624   9.605   1.556
 1124   HG23  THR 586          HG23      THR 586  61.893  10.551   0.773
 1125    H    PHE 587           HN       PHE 587  61.219   9.653   6.372
 1126    HA   PHE 587           HA       PHE 587  64.065   9.849   7.169
 1127    HB2  PHE 587           HB2      PHE 587  63.375  10.870   9.142
 1128    HB3  PHE 587           HB1      PHE 587  62.177  11.423   7.992
 1129    HD1  PHE 587           HD1      PHE 587  60.251   9.299   7.727
 1130    HD2  PHE 587           HD2      PHE 587  62.403  10.526  11.238
 1131    HE1  PHE 587           HE1      PHE 587  58.461   8.359   9.152
 1132    HE2  PHE 587           HE2      PHE 587  60.610   9.581  12.662
 1133    HZ   PHE 587           HZ       PHE 587  58.639   8.497  11.620
 1134    H    LYS 588           HN       LYS 588  65.047   8.012   7.476
 1135    HA   LYS 588           HA       LYS 588  63.669   5.719   8.777
 1136    HB2  LYS 588           HB2      LYS 588  65.361   5.936   6.531
 1137    HB3  LYS 588           HB1      LYS 588  66.399   5.302   7.766
 1138    HG2  LYS 588           HG2      LYS 588  65.284   3.546   6.362
 1139    HG3  LYS 588           HG1      LYS 588  65.043   3.364   8.085
 1140    HD2  LYS 588           HD2      LYS 588  63.032   3.031   6.434
 1141    HD3  LYS 588           HD1      LYS 588  62.773   3.860   7.949
 1142    HE2  LYS 588           HE2      LYS 588  62.493   5.931   6.907
 1143    HE3  LYS 588           HE1      LYS 588  63.497   5.487   5.545
 1144    HZ1  LYS 588           HZ1      LYS 588  60.727   5.323   5.763
 1145    HZ2  LYS 588           HZ2      LYS 588  61.330   3.741   5.623
 1146    HZ3  LYS 588           HZ3      LYS 588  61.703   4.904   4.441
 1147    H    GLU 589           HN       GLU 589  65.160   4.509  10.386
 1148    HA   GLU 589           HA       GLU 589  67.115   6.274  11.729
 1149    HB2  GLU 589           HB2      GLU 589  65.261   7.141  12.853
 1150    HB3  GLU 589           HB1      GLU 589  64.414   5.600  12.879
 1151    HG2  GLU 589           HG2      GLU 589  65.847   4.752  14.604
 1152    HG3  GLU 589           HG1      GLU 589  66.983   6.094  14.422
 1153    H    GLN 590           HN       GLN 590  68.266   5.249  13.364
 1154    HA   GLN 590           HA       GLN 590  67.979   2.387  13.853
 1155    HB2  GLN 590           HB2      GLN 590  69.373   2.814  11.638
 1156    HB3  GLN 590           HB1      GLN 590  70.647   3.274  12.753
 1157    HG2  GLN 590           HG2      GLN 590  71.096   1.006  12.607
 1158    HG3  GLN 590           HG1      GLN 590  69.954   0.984  13.949
 1159   HE21  GLN 590          HE21      GLN 590  70.572  -0.968  11.591
 1160   HE22  GLN 590          HE22      GLN 590  69.035  -1.333  10.970
 1161    H    ASN 591           HN       ASN 591  69.106   1.866  15.795
 1162    HA   ASN 591           HA       ASN 591  69.825   2.442  17.943
 1163    HB2  ASN 591           HB2      ASN 591  72.067   3.977  17.621
 1164    HB3  ASN 591           HB1      ASN 591  72.044   2.238  17.413
 1165   HD21  ASN 591          HD21      ASN 591  71.224   1.633  15.059
 1166   HD22  ASN 591          HD22      ASN 591  71.944   2.510  13.805
 1167    H    ASP 592           HN       ASP 592  67.918   4.357  16.579
 1168    HA   ASP 592           HA       ASP 592  66.740   6.214  17.439
 1169    HB2  ASP 592           HB2      ASP 592  69.097   7.024  19.123
 1170    HB3  ASP 592           HB1      ASP 592  67.382   7.300  19.408
 1171    H    LYS 593           HN       LYS 593  69.658   6.200  15.832
 1172    HA   LYS 593           HA       LYS 593  69.930   9.100  15.539
 1173    HB2  LYS 593           HB2      LYS 593  71.300   6.880  14.049
 1174    HB3  LYS 593           HB1      LYS 593  71.814   8.555  14.161
 1175    HG2  LYS 593           HG2      LYS 593  71.834   8.113  16.739
 1176    HG3  LYS 593           HG1      LYS 593  71.870   6.413  16.273
 1177    HD2  LYS 593           HD2      LYS 593  73.892   6.776  14.946
 1178    HD3  LYS 593           HD1      LYS 593  73.845   8.504  15.298
 1179    HE2  LYS 593           HE2      LYS 593  73.943   6.476  17.533
 1180    HE3  LYS 593           HE1      LYS 593  75.418   7.005  16.724
 1181    HZ1  LYS 593           HZ1      LYS 593  74.609   9.338  17.180
 1182    HZ2  LYS 593           HZ2      LYS 593  75.137   8.447  18.527
 1183    HZ3  LYS 593           HZ3      LYS 593  73.475   8.647  18.235
 1184    HA   PRO 594           HA       PRO 594  66.802   8.944  12.182
 1185    HB2  PRO 594           HB2      PRO 594  68.188  11.467  11.410
 1186    HB3  PRO 594           HB1      PRO 594  66.466  11.168  11.637
 1187    HG2  PRO 594           HG2      PRO 594  67.964  12.557  13.424
 1188    HG3  PRO 594           HG1      PRO 594  66.581  11.565  13.915
 1189    HD2  PRO 594           HD2      PRO 594  69.487  11.043  14.308
 1190    HD3  PRO 594           HD1      PRO 594  68.094  10.404  15.212
 1191    H    TYR 595           HN       TYR 595  66.957   8.898   9.738
 1192    HA   TYR 595           HA       TYR 595  69.565   8.860   8.458
 1193    HB2  TYR 595           HB2      TYR 595  68.317   6.297   9.401
 1194    HB3  TYR 595           HB1      TYR 595  69.224   6.290   7.902
 1195    HD1  TYR 595           HD1      TYR 595  69.519   5.591  11.277
 1196    HD2  TYR 595           HD2      TYR 595  71.555   7.696   8.145
 1197    HE1  TYR 595           HE1      TYR 595  71.668   5.313  12.479
 1198    HE2  TYR 595           HE2      TYR 595  73.703   7.426   9.370
 1199    HH   TYR 595           HH       TYR 595  74.531   7.005  11.546
 1200    H    CYS 596           HN       CYS 596  69.258   8.980   6.210
 1201    HA   CYS 596           HA       CYS 596  66.514   8.945   5.176
 1202    HB2  CYS 596           HB2      CYS 596  69.030   8.712   3.498
 1203    HB3  CYS 596           HB1      CYS 596  67.457   9.321   3.011
 1204    H    GLN 597           HN       GLN 597  65.773   7.194   3.697
 1205    HA   GLN 597           HA       GLN 597  66.475   4.642   4.729
 1206    HB2  GLN 597           HB2      GLN 597  64.394   4.608   3.676
 1207    HB3  GLN 597           HB1      GLN 597  64.931   5.628   2.374
 1208    HG2  GLN 597           HG2      GLN 597  64.717   3.589   1.267
 1209    HG3  GLN 597           HG1      GLN 597  66.402   3.523   1.739
 1210   HE21  GLN 597          HE21      GLN 597  65.745   3.094   4.609
 1211   HE22  GLN 597          HE22      GLN 597  65.209   1.507   4.726
 1212    H    ASN 598           HN       ASN 598  67.322   6.107   1.590
 1213    HA   ASN 598           HA       ASN 598  69.140   4.232   0.653
 1214    HB2  ASN 598           HB2      ASN 598  69.914   7.126   0.457
 1215    HB3  ASN 598           HB1      ASN 598  69.904   5.887  -0.791
 1216   HD21  ASN 598          HD21      ASN 598  67.433   4.933  -0.911
 1217   HD22  ASN 598          HD22      ASN 598  66.281   6.147  -1.165
 1218    H    CYS 599           HN       CYS 599  69.569   6.485   3.299
 1219    HA   CYS 599           HA       CYS 599  72.434   5.962   3.515
 1220    HB2  CYS 599           HB2      CYS 599  70.457   7.304   5.384
 1221    HB3  CYS 599           HB1      CYS 599  72.186   7.196   5.683
 1222    H    PHE 600           HN       PHE 600  69.733   5.361   5.796
 1223    HA   PHE 600           HA       PHE 600  71.043   3.511   7.440
 1224    HB2  PHE 600           HB2      PHE 600  69.015   4.039   8.382
 1225    HB3  PHE 600           HB1      PHE 600  68.235   4.225   6.819
 1226    HD1  PHE 600           HD1      PHE 600  67.268   2.293   5.654
 1227    HD2  PHE 600           HD2      PHE 600  69.049   1.890   9.534
 1228    HE1  PHE 600           HE1      PHE 600  66.188   0.077   5.915
 1229    HE2  PHE 600           HE2      PHE 600  67.969  -0.327   9.801
 1230    HZ   PHE 600           HZ       PHE 600  66.539  -1.234   7.990
 1231    H    LEU 601           HN       LEU 601  68.896   2.703   4.678
 1232    HA   LEU 601           HA       LEU 601  69.199  -0.054   4.715
 1233    HB2  LEU 601           HB2      LEU 601  68.029   0.098   2.768
 1234    HB3  LEU 601           HB1      LEU 601  68.143   1.837   2.959
 1235    HG   LEU 601           HG       LEU 601  70.315   1.750   1.643
 1236   HD11  LEU 601          HD11      LEU 601  69.831  -1.115   1.889
 1237   HD12  LEU 601          HD12      LEU 601  71.257  -0.279   1.289
 1238   HD13  LEU 601          HD13      LEU 601  69.940  -0.662   0.189
 1239   HD21  LEU 601          HD21      LEU 601  68.006   0.582   0.083
 1240   HD22  LEU 601          HD22      LEU 601  69.208   1.750  -0.461
 1241   HD23  LEU 601          HD23      LEU 601  67.975   2.230   0.696
 1242    H    LYS 602           HN       LYS 602  71.431   2.357   3.447
 1243    HA   LYS 602           HA       LYS 602  73.283   0.439   2.354
 1244    HB2  LYS 602           HB2      LYS 602  73.247   3.350   2.794
 1245    HB3  LYS 602           HB1      LYS 602  74.852   2.677   3.005
 1246    HG2  LYS 602           HG2      LYS 602  74.481   1.499   0.747
 1247    HG3  LYS 602           HG1      LYS 602  73.090   2.565   0.551
 1248    HD2  LYS 602           HD2      LYS 602  74.733   3.867  -0.455
 1249    HD3  LYS 602           HD1      LYS 602  74.874   4.448   1.202
 1250    HE2  LYS 602           HE2      LYS 602  76.615   2.501   1.470
 1251    HE3  LYS 602           HE1      LYS 602  76.654   2.537  -0.288
 1252    HZ1  LYS 602           HZ1      LYS 602  77.317   4.729   1.583
 1253    HZ2  LYS 602           HZ2      LYS 602  77.050   4.993  -0.073
 1254    HZ3  LYS 602           HZ3      LYS 602  78.328   3.995   0.435
 1255    H    LEU 603           HN       LEU 603  72.710   1.438   5.639
 1256    HA   LEU 603           HA       LEU 603  75.398   0.564   6.506
 1257    HB2  LEU 603           HB2      LEU 603  73.128   1.297   8.342
 1258    HB3  LEU 603           HB1      LEU 603  74.864   1.434   8.626
 1259    HG   LEU 603           HG       LEU 603  73.185   3.064   6.728
 1260   HD11  LEU 603          HD11      LEU 603  74.970   4.046   8.944
 1261   HD12  LEU 603          HD12      LEU 603  73.291   3.596   9.243
 1262   HD13  LEU 603          HD13      LEU 603  73.667   4.907   8.125
 1263   HD21  LEU 603          HD21      LEU 603  75.221   2.707   5.559
 1264   HD22  LEU 603          HD22      LEU 603  76.177   2.848   7.034
 1265   HD23  LEU 603          HD23      LEU 603  75.409   4.276   6.339
 1266    H    PHE 604           HN       PHE 604  72.045  -0.441   7.409
 1267    HA   PHE 604           HA       PHE 604  73.188  -2.969   8.463
 1268    HB2  PHE 604           HB2      PHE 604  70.544  -1.559   8.674
 1269    HB3  PHE 604           HB1      PHE 604  70.573  -3.303   8.925
 1270    HD1  PHE 604           HD1      PHE 604  72.821  -0.421   9.855
 1271    HD2  PHE 604           HD2      PHE 604  70.666  -3.897  11.183
 1272    HE1  PHE 604           HE1      PHE 604  73.662  -0.066  12.154
 1273    HE2  PHE 604           HE2      PHE 604  71.513  -3.538  13.484
 1274    HZ   PHE 604           HZ       PHE 604  73.011  -1.623  13.969
 1275    H    CYS 605           HN       CYS 605  71.298  -1.848   5.711
 1276    HA   CYS 605           HA       CYS 605  71.052  -4.690   4.760
 1277    HB2  CYS 605           HB2      CYS 605  69.515  -2.217   3.917
 1278    HB3  CYS 605           HB1      CYS 605  69.281  -3.836   3.265
 1279    HG   CYS 605           HG       CYS 605  68.682  -4.532   5.838
  Start of MODEL    7
    1    H    MET   1           HT1      MET   1  92.975 -24.719   7.395
    2    HA   MET   1           HA       MET   1  93.598 -22.865   6.168
    3    HB2  MET   1           HB2      MET   1  94.173 -21.606   8.345
    4    HB3  MET   1           HB1      MET   1  95.797 -22.266   8.157
    5    HG2  MET   1           HG2      MET   1  95.817 -21.302   5.817
    6    HG3  MET   1           HG1      MET   1  94.306 -20.486   6.211
    7    HE1  MET   1           HE1      MET   1  93.897 -19.268   8.193
    8    HE2  MET   1           HE2      MET   1  94.974 -18.052   8.874
    9    HE3  MET   1           HE3      MET   1  94.986 -19.690   9.522
   10    H    ALA   2           HN       ALA   2  96.819 -22.671   6.765
   11    HA   ALA   2           HA       ALA   2  97.586 -25.296   5.645
   12    HB1  ALA   2           HB1      ALA   2  98.276 -22.738   4.183
   13    HB2  ALA   2           HB2      ALA   2  96.937 -23.783   3.705
   14    HB3  ALA   2           HB3      ALA   2  98.592 -24.392   3.656
   15    H    LEU   3           HN       LEU   3  98.750 -21.975   6.175
   16    HA   LEU   3           HA       LEU   3 101.437 -22.390   6.625
   17    HB2  LEU   3           HB2      LEU   3  99.505 -20.661   8.178
   18    HB3  LEU   3           HB1      LEU   3 101.258 -20.506   8.261
   19    HG   LEU   3           HG       LEU   3 100.727 -20.481   5.487
   20   HD11  LEU   3          HD11      LEU   3  98.957 -18.820   5.191
   21   HD12  LEU   3          HD12      LEU   3  98.674 -18.788   6.932
   22   HD13  LEU   3          HD13      LEU   3  98.315 -20.245   6.007
   23   HD21  LEU   3          HD21      LEU   3 102.347 -19.039   6.492
   24   HD22  LEU   3          HD22      LEU   3 101.120 -18.245   7.476
   25   HD23  LEU   3          HD23      LEU   3 101.145 -17.999   5.731
   26    H    ASP   4           HN       ASP   4  99.421 -21.873   9.448
   27    HA   ASP   4           HA       ASP   4  99.611 -22.752  11.599
   28    HB2  ASP   4           HB2      ASP   4  98.401 -24.595  10.574
   29    HB3  ASP   4           HB1      ASP   4  99.895 -25.219   9.880
   30    H    GLY   5           HN       GLY   5 102.040 -22.054   9.896
   31    HA2  GLY   5           HA2      GLY   5 104.218 -23.751  10.791
   32    HA3  GLY   5           HA1      GLY   5 104.369 -22.136  10.094
   33    H    ILE   6           HN       ILE   6 102.238 -21.567  12.281
   34    HA   ILE   6           HA       ILE   6 104.216 -20.950  14.444
   35    HB   ILE   6           HB       ILE   6 102.135 -19.175  14.825
   36   HG12  ILE   6          HG12      ILE   6 101.193 -20.135  12.607
   37   HG13  ILE   6          HG11      ILE   6 101.260 -18.389  12.792
   38   HG21  ILE   6          HG21      ILE   6 104.664 -18.915  13.227
   39   HG22  ILE   6          HG22      ILE   6 104.353 -18.398  14.884
   40   HG23  ILE   6          HG23      ILE   6 103.606 -17.539  13.537
   41   HD11  ILE   6          HD11      ILE   6 103.688 -19.623  11.591
   42   HD12  ILE   6          HD12      ILE   6 102.832 -18.147  11.152
   43   HD13  ILE   6          HD13      ILE   6 102.219 -19.711  10.620
   44    H    ARG   7           HN       ARG   7 100.879 -20.340  15.132
   45    HA   ARG   7           HA       ARG   7 100.445 -22.993  16.315
   46    HB2  ARG   7           HB2      ARG   7  99.954 -21.864  18.562
   47    HB3  ARG   7           HB1      ARG   7 101.638 -22.074  18.116
   48    HG2  ARG   7           HG2      ARG   7 100.418 -19.501  17.234
   49    HG3  ARG   7           HG1      ARG   7 100.599 -19.699  18.975
   50    HD2  ARG   7           HD2      ARG   7 102.994 -20.239  18.654
   51    HD3  ARG   7           HD1      ARG   7 102.800 -19.983  16.925
   52    HE   ARG   7           HE       ARG   7 101.898 -17.615  17.968
   53   HH11  ARG   7          HH11      ARG   7 103.234 -15.861  18.471
   54   HH12  ARG   7          HH12      ARG   7 104.901 -16.142  18.849
   55   HH21  ARG   7          HH21      ARG   7 104.686 -19.581  18.455
   56   HH22  ARG   7          HH22      ARG   7 105.723 -18.248  18.840
   57    H    MET   8           HN       MET   8  98.848 -20.178  17.646
   58    HA   MET   8           HA       MET   8  96.588 -20.505  15.757
   59    HB2  MET   8           HB2      MET   8  95.375 -20.417  18.353
   60    HB3  MET   8           HB1      MET   8  95.315 -21.711  17.174
   61    HG2  MET   8           HG2      MET   8  97.340 -22.709  18.025
   62    HG3  MET   8           HG1      MET   8  97.623 -21.374  19.125
   63    HE1  MET   8           HE1      MET   8  97.029 -24.730  19.180
   64    HE2  MET   8           HE2      MET   8  96.392 -24.918  20.811
   65    HE3  MET   8           HE3      MET   8  97.828 -23.933  20.542
   66    HA   PRO   9           HA       PRO   9  95.781 -16.359  18.345
   67    HB2  PRO   9           HB2      PRO   9  98.670 -16.183  19.200
   68    HB3  PRO   9           HB1      PRO   9  97.237 -15.437  19.947
   69    HG2  PRO   9           HG2      PRO   9  98.253 -17.601  21.010
   70    HG3  PRO   9           HG1      PRO   9  96.496 -17.454  20.804
   71    HD2  PRO   9           HD2      PRO   9  98.419 -19.114  19.226
   72    HD3  PRO   9           HD1      PRO   9  96.750 -19.440  19.683
   73    H    ASP  10           HN       ASP  10  98.671 -17.444  16.807
   74    HA   ASP  10           HA       ASP  10  98.623 -15.126  14.896
   75    HB2  ASP  10           HB2      ASP  10 100.667 -15.427  16.478
   76    HB3  ASP  10           HB1      ASP  10 101.065 -16.815  15.469
   77    H    GLY  11           HN       GLY  11  98.632 -18.540  15.398
   78    HA2  GLY  11           HA2      GLY  11  99.069 -19.151  12.540
   79    HA3  GLY  11           HA1      GLY  11  98.836 -20.323  13.832
   80    H    CYS  12           HN       CYS  12  96.498 -18.088  14.347
   81    HA   CYS  12           HA       CYS  12  94.578 -18.780  12.297
   82    HB2  CYS  12           HB2      CYS  12  94.595 -20.939  13.374
   83    HB3  CYS  12           HB1      CYS  12  94.429 -20.192  14.963
   84    HG   CYS  12           HG       CYS  12  92.112 -19.384  13.201
   85    H    TYR  13           HN       TYR  13  95.504 -16.981  15.036
   86    HA   TYR  13           HA       TYR  13  94.620 -15.096  16.011
   87    HB2  TYR  13           HB2      TYR  13  92.297 -15.296  14.114
   88    HB3  TYR  13           HB1      TYR  13  92.977 -13.861  14.855
   89    HD1  TYR  13           HD1      TYR  13  92.999 -15.952  11.957
   90    HD2  TYR  13           HD2      TYR  13  95.449 -13.297  14.283
   91    HE1  TYR  13           HE1      TYR  13  94.517 -15.653  10.019
   92    HE2  TYR  13           HE2      TYR  13  96.966 -12.998  12.344
   93    HH   TYR  13           HH       TYR  13  97.404 -13.567  10.249
   94    H    ALA  14           HN       ALA  14  91.546 -16.615  15.063
   95    HA   ALA  14           HA       ALA  14  91.005 -18.193  17.270
   96    HB1  ALA  14           HB1      ALA  14  89.580 -16.270  18.547
   97    HB2  ALA  14           HB2      ALA  14  90.892 -15.284  17.896
   98    HB3  ALA  14           HB3      ALA  14  91.256 -16.638  18.962
   99    H    ASP  15           HN       ASP  15  89.663 -15.563  15.319
  100    HA   ASP  15           HA       ASP  15  87.387 -17.357  14.633
  101    HB2  ASP  15           HB2      ASP  15  86.795 -15.673  16.489
  102    HB3  ASP  15           HB1      ASP  15  86.952 -14.430  15.247
  103    H    GLY  16           HN       GLY  16  89.890 -15.465  13.603
  104    HA2  GLY  16           HA2      GLY  16  90.461 -15.062  11.317
  105    HA3  GLY  16           HA1      GLY  16  88.777 -15.337  10.867
  106    H    THR  17           HN       THR  17  89.753 -13.201  13.476
  107    HA   THR  17           HA       THR  17  88.344 -10.973  12.170
  108    HB   THR  17           HB       THR  17  89.137  -9.811  14.373
  109    HG1  THR  17           HG1      THR  17  90.606 -11.815  14.584
  110   HG21  THR  17          HG21      THR  17  87.239 -12.160  14.293
  111   HG22  THR  17          HG22      THR  17  86.849 -10.447  14.112
  112   HG23  THR  17          HG23      THR  17  87.371 -11.072  15.676
  113    H    TRP  18           HN       TRP  18  89.366  -9.582  10.911
  114    HA   TRP  18           HA       TRP  18  92.254  -8.977  11.369
  115    HB2  TRP  18           HB2      TRP  18  92.004  -8.657   8.654
  116    HB3  TRP  18           HB1      TRP  18  92.628 -10.115   9.410
  117    HD1  TRP  18           HD1      TRP  18  89.320  -8.681   8.040
  118    HE1  TRP  18           HE1      TRP  18  87.846 -10.660   7.277
  119    HE3  TRP  18           HE3      TRP  18  92.219 -12.593   9.583
  120    HZ2  TRP  18           HZ2      TRP  18  87.890 -13.516   7.324
  121    HZ3  TRP  18           HZ3      TRP  18  91.481 -14.929   9.211
  122    HH2  TRP  18           HH2      TRP  18  89.321 -15.395   8.085
  123    H    GLU  19           HN       GLU  19  92.470  -6.826  11.711
  124    HA   GLU  19           HA       GLU  19  90.206  -5.062  11.190
  125    HB2  GLU  19           HB2      GLU  19  92.349  -3.385  11.872
  126    HB3  GLU  19           HB1      GLU  19  91.155  -4.030  12.990
  127    HG2  GLU  19           HG2      GLU  19  93.462  -4.490  13.731
  128    HG3  GLU  19           HG1      GLU  19  92.556  -5.969  13.417
  129    H    LEU  20           HN       LEU  20  89.901  -3.829   9.421
  130    HA   LEU  20           HA       LEU  20  91.881  -4.051   7.271
  131    HB2  LEU  20           HB2      LEU  20  89.064  -3.660   7.400
  132    HB3  LEU  20           HB1      LEU  20  89.699  -2.174   6.705
  133    HG   LEU  20           HG       LEU  20  89.245  -3.652   4.882
  134   HD11  LEU  20          HD11      LEU  20  92.157  -4.230   5.006
  135   HD12  LEU  20          HD12      LEU  20  91.705  -2.536   5.211
  136   HD13  LEU  20          HD13      LEU  20  91.213  -3.414   3.764
  137   HD21  LEU  20          HD21      LEU  20  90.746  -5.945   5.067
  138   HD22  LEU  20          HD22      LEU  20  89.052  -5.840   5.526
  139   HD23  LEU  20          HD23      LEU  20  90.307  -5.708   6.756
  140    H    SER  21           HN       SER  21  93.350  -2.482   6.791
  141    HA   SER  21           HA       SER  21  93.606  -0.243   8.639
  142    HB2  SER  21           HB2      SER  21  95.460  -1.631   7.333
  143    HB3  SER  21           HB1      SER  21  95.185  -0.403   6.101
  144    HG   SER  21           HG       SER  21  95.501   0.377   8.776
  145    H    VAL  22           HN       VAL  22  93.323   1.932   8.166
  146    HA   VAL  22           HA       VAL  22  92.238   2.616   5.489
  147    HB   VAL  22           HB       VAL  22  90.830   3.108   8.117
  148   HG11  VAL  22          HG11      VAL  22  89.263   4.519   6.664
  149   HG12  VAL  22          HG12      VAL  22  90.556   4.564   5.468
  150   HG13  VAL  22          HG13      VAL  22  90.803   5.271   7.068
  151   HG21  VAL  22          HG21      VAL  22  89.973   2.040   5.410
  152   HG22  VAL  22          HG22      VAL  22  88.932   2.182   6.832
  153   HG23  VAL  22          HG23      VAL  22  90.295   1.057   6.846
  154    H    HIS  23           HN       HIS  23  93.545   4.092   4.747
  155    HA   HIS  23           HA       HIS  23  95.001   5.927   6.536
  156    HB2  HIS  23           HB2      HIS  23  94.978   5.275   3.597
  157    HB3  HIS  23           HB1      HIS  23  95.782   6.742   4.158
  158    HD1  HIS  23           HD1      HIS  23  98.228   6.152   4.091
  159    HD2  HIS  23           HD2      HIS  23  95.952   3.143   5.863
  160    HE1  HIS  23           HE1      HIS  23  99.869   4.434   4.966
  161    H    VAL  24           HN       VAL  24  93.591   7.508   7.327
  162    HA   VAL  24           HA       VAL  24  91.461   8.563   5.662
  163    HB   VAL  24           HB       VAL  24  92.509  10.074   8.050
  164   HG11  VAL  24          HG11      VAL  24  90.431  10.699   6.701
  165   HG12  VAL  24          HG12      VAL  24  90.179  10.499   8.436
  166   HG13  VAL  24          HG13      VAL  24  89.696   9.222   7.325
  167   HG21  VAL  24          HG21      VAL  24  91.162   8.435   9.477
  168   HG22  VAL  24          HG22      VAL  24  92.702   7.827   8.872
  169   HG23  VAL  24          HG23      VAL  24  91.195   7.343   8.091
  170    H    THR  25           HN       THR  25  92.254   9.467   3.798
  171    HA   THR  25           HA       THR  25  94.666  11.056   3.721
  172    HB   THR  25           HB       THR  25  94.046  11.473   1.387
  173    HG1  THR  25           HG1      THR  25  91.659  10.079   1.942
  174   HG21  THR  25          HG21      THR  25  93.635   9.019   0.715
  175   HG22  THR  25          HG22      THR  25  93.637   8.675   2.445
  176   HG23  THR  25          HG23      THR  25  95.073   9.356   1.681
  177    H    ASP  26           HN       ASP  26  91.196  11.822   3.827
  178    HA   ASP  26           HA       ASP  26  91.615  14.684   3.524
  179    HB2  ASP  26           HB2      ASP  26  89.446  13.535   3.020
  180    HB3  ASP  26           HB1      ASP  26  89.250  13.226   4.744
  181    H    LEU  27           HN       LEU  27  92.966  12.966   5.704
  182    HA   LEU  27           HA       LEU  27  92.713  14.975   7.840
  183    HB2  LEU  27           HB2      LEU  27  91.582  12.267   7.949
  184    HB3  LEU  27           HB1      LEU  27  92.630  12.596   9.313
  185    HG   LEU  27           HG       LEU  27  90.478  14.551   8.472
  186   HD11  LEU  27          HD11      LEU  27  89.156  13.443  10.395
  187   HD12  LEU  27          HD12      LEU  27  90.242  12.069  10.179
  188   HD13  LEU  27          HD13      LEU  27  89.202  12.588   8.853
  189   HD21  LEU  27          HD21      LEU  27  90.639  15.141  10.908
  190   HD22  LEU  27          HD22      LEU  27  92.146  15.403  10.034
  191   HD23  LEU  27          HD23      LEU  27  91.958  13.984  11.060
  192    H    ASN  28           HN       ASN  28  94.263  12.182   6.424
  193    HA   ASN  28           HA       ASN  28  96.568  11.752   6.212
  194    HB2  ASN  28           HB2      ASN  28  96.847  14.270   6.842
  195    HB3  ASN  28           HB1      ASN  28  97.224  13.668   8.451
  196   HD21  ASN  28          HD21      ASN  28  98.312  11.143   7.100
  197   HD22  ASN  28          HD22      ASN  28  99.867  11.587   6.600
  198    H    ARG  29           HN       ARG  29  94.516  10.880   8.470
  199    HA   ARG  29           HA       ARG  29  96.488   9.804  10.402
  200    HB2  ARG  29           HB2      ARG  29  93.471   9.669  10.384
  201    HB3  ARG  29           HB1      ARG  29  94.525   9.123  11.690
  202    HG2  ARG  29           HG2      ARG  29  95.351  11.378  12.035
  203    HG3  ARG  29           HG1      ARG  29  94.437  11.959  10.648
  204    HD2  ARG  29           HD2      ARG  29  93.073  12.523  12.494
  205    HD3  ARG  29           HD1      ARG  29  92.360  11.035  11.869
  206    HE   ARG  29           HE       ARG  29  94.283  10.327  13.839
  207   HH11  ARG  29          HH11      ARG  29  93.570   9.812  15.923
  208   HH12  ARG  29          HH12      ARG  29  92.010  10.353  16.448
  209   HH21  ARG  29          HH21      ARG  29  91.265  11.949  13.461
  210   HH22  ARG  29          HH22      ARG  29  90.705  11.562  15.054
  211    H    ASP  30           HN       ASP  30  95.630   7.534  11.149
  212    HA   ASP  30           HA       ASP  30  94.969   5.798   8.841
  213    HB2  ASP  30           HB2      ASP  30  97.369   5.497  10.664
  214    HB3  ASP  30           HB1      ASP  30  96.712   4.162   9.714
  215    H    VAL  31           HN       VAL  31  93.219   4.718   9.473
  216    HA   VAL  31           HA       VAL  31  92.933   4.009  12.382
  217    HB   VAL  31           HB       VAL  31  90.719   4.428  10.367
  218   HG11  VAL  31          HG11      VAL  31  90.078   3.036  12.237
  219   HG12  VAL  31          HG12      VAL  31  89.386   4.639  12.491
  220   HG13  VAL  31          HG13      VAL  31  90.827   4.149  13.380
  221   HG21  VAL  31          HG21      VAL  31  91.835   6.342  12.452
  222   HG22  VAL  31          HG22      VAL  31  90.387   6.623  11.487
  223   HG23  VAL  31          HG23      VAL  31  91.965   6.540  10.704
  224    H    THR  32           HN       THR  32  91.856   2.022  12.831
  225    HA   THR  32           HA       THR  32  91.790   0.044  10.597
  226    HB   THR  32           HB       THR  32  92.641  -1.313  12.985
  227    HG1  THR  32           HG1      THR  32  94.318   0.871  12.363
  228   HG21  THR  32          HG21      THR  32  94.501  -0.547  10.744
  229   HG22  THR  32          HG22      THR  32  93.205  -1.717  10.479
  230   HG23  THR  32          HG23      THR  32  94.455  -2.042  11.678
  231    H    LEU  33           HN       LEU  33  90.003  -1.257  10.683
  232    HA   LEU  33           HA       LEU  33  88.208  -1.028  13.071
  233    HB2  LEU  33           HB2      LEU  33  87.754  -1.027  10.115
  234    HB3  LEU  33           HB1      LEU  33  86.518  -1.756  11.116
  235    HG   LEU  33           HG       LEU  33  86.247   0.730  10.529
  236   HD11  LEU  33          HD11      LEU  33  85.224   1.225  12.629
  237   HD12  LEU  33          HD12      LEU  33  86.262   0.089  13.479
  238   HD13  LEU  33          HD13      LEU  33  85.038  -0.506  12.365
  239   HD21  LEU  33          HD21      LEU  33  88.183   1.185  12.806
  240   HD22  LEU  33          HD22      LEU  33  87.512   2.349  11.679
  241   HD23  LEU  33          HD23      LEU  33  88.719   1.193  11.123
  242    H    ARG  34           HN       ARG  34  88.359  -2.880  14.200
  243    HA   ARG  34           HA       ARG  34  89.259  -5.383  13.217
  244    HB2  ARG  34           HB2      ARG  34  89.106  -4.694  15.653
  245    HB3  ARG  34           HB1      ARG  34  87.368  -4.952  15.536
  246    HG2  ARG  34           HG2      ARG  34  88.308  -6.987  16.406
  247    HG3  ARG  34           HG1      ARG  34  87.846  -7.297  14.734
  248    HD2  ARG  34           HD2      ARG  34  90.036  -7.422  14.003
  249    HD3  ARG  34           HD1      ARG  34  90.648  -6.359  15.269
  250    HE   ARG  34           HE       ARG  34  89.629  -8.914  16.266
  251   HH11  ARG  34          HH11      ARG  34  91.186 -10.275  17.177
  252   HH12  ARG  34          HH12      ARG  34  92.866  -9.941  16.921
  253   HH21  ARG  34          HH21      ARG  34  92.285  -7.118  14.993
  254   HH22  ARG  34          HH22      ARG  34  93.488  -8.155  15.685
  255    H    VAL  35           HN       VAL  35  88.212  -6.211  11.464
  256    HA   VAL  35           HA       VAL  35  85.282  -6.756  11.743
  257    HB   VAL  35           HB       VAL  35  85.075  -6.283   9.304
  258   HG11  VAL  35          HG11      VAL  35  84.353  -4.581  10.857
  259   HG12  VAL  35          HG12      VAL  35  85.238  -3.774   9.562
  260   HG13  VAL  35          HG13      VAL  35  86.016  -4.052  11.123
  261   HG21  VAL  35          HG21      VAL  35  87.313  -6.509   8.518
  262   HG22  VAL  35          HG22      VAL  35  87.921  -5.342   9.688
  263   HG23  VAL  35          HG23      VAL  35  86.915  -4.801   8.348
  264    H    THR  36           HN       THR  36  84.814  -8.104   9.511
  265    HA   THR  36           HA       THR  36  86.883 -10.204   9.179
  266    HB   THR  36           HB       THR  36  84.940 -11.892   9.392
  267    HG1  THR  36           HG1      THR  36  83.578  -9.747   9.680
  268   HG21  THR  36          HG21      THR  36  85.101 -11.814  11.947
  269   HG22  THR  36          HG22      THR  36  86.141 -10.411  11.715
  270   HG23  THR  36          HG23      THR  36  86.606 -11.976  11.045
  271    H    GLY  37           HN       GLY  37  85.911 -11.767   7.385
  272    HA2  GLY  37           HA2      GLY  37  85.198 -10.049   5.144
  273    HA3  GLY  37           HA1      GLY  37  85.498 -11.784   5.069
  274    H    GLU  38           HN       GLU  38  83.217  -9.929   7.048
  275    HA   GLU  38           HA       GLU  38  80.945 -11.089   5.535
  276    HB2  GLU  38           HB2      GLU  38  79.863 -11.672   7.778
  277    HB3  GLU  38           HB1      GLU  38  81.163 -12.738   7.243
  278    HG2  GLU  38           HG2      GLU  38  82.697 -11.866   8.774
  279    HG3  GLU  38           HG1      GLU  38  81.796 -10.361   8.979
  280    H    VAL  39           HN       VAL  39  82.436  -8.458   6.911
  281    HA   VAL  39           HA       VAL  39  79.981  -7.161   7.849
  282    HB   VAL  39           HB       VAL  39  81.325  -5.455   8.682
  283   HG11  VAL  39          HG11      VAL  39  83.323  -7.700   8.663
  284   HG12  VAL  39          HG12      VAL  39  81.793  -7.855   9.525
  285   HG13  VAL  39          HG13      VAL  39  82.925  -6.584   9.972
  286   HG21  VAL  39          HG21      VAL  39  83.368  -6.270   6.591
  287   HG22  VAL  39          HG22      VAL  39  83.717  -5.132   7.889
  288   HG23  VAL  39          HG23      VAL  39  82.496  -4.738   6.690
  289    H    HIS  40           HN       HIS  40  78.784  -5.746   6.659
  290    HA   HIS  40           HA       HIS  40  79.248  -5.597   3.808
  291    HB2  HIS  40           HB2      HIS  40  77.430  -3.656   5.214
  292    HB3  HIS  40           HB1      HIS  40  77.197  -4.504   3.684
  293    HD1  HIS  40           HD1      HIS  40  77.180  -7.322   4.139
  294    HD2  HIS  40           HD2      HIS  40  75.860  -4.782   7.170
  295    HE1  HIS  40           HE1      HIS  40  75.756  -8.733   5.686
  296    H    ILE  41           HN       ILE  41  80.191  -3.932   2.618
  297    HA   ILE  41           HA       ILE  41  82.222  -2.344   3.678
  298    HB   ILE  41           HB       ILE  41  80.439  -1.397   1.424
  299   HG12  ILE  41          HG12      ILE  41  82.643  -3.485   1.379
  300   HG13  ILE  41          HG11      ILE  41  80.935  -3.730   1.007
  301   HG21  ILE  41          HG21      ILE  41  82.408  -0.008   2.430
  302   HG22  ILE  41          HG22      ILE  41  82.306  -0.194   0.682
  303   HG23  ILE  41          HG23      ILE  41  83.441  -1.178   1.606
  304   HD11  ILE  41          HD11      ILE  41  81.623  -3.413  -1.142
  305   HD12  ILE  41          HD12      ILE  41  83.071  -2.538  -0.657
  306   HD13  ILE  41          HD13      ILE  41  81.517  -1.704  -0.724
  307    H    GLY  42           HN       GLY  42  78.962  -1.165   2.860
  308    HA2  GLY  42           HA2      GLY  42  79.214   1.366   4.044
  309    HA3  GLY  42           HA1      GLY  42  77.680   0.525   3.835
  310    H    GLY  43           HN       GLY  43  79.187  -1.694   5.429
  311    HA2  GLY  43           HA2      GLY  43  78.027  -1.005   8.012
  312    HA3  GLY  43           HA1      GLY  43  78.980  -2.449   7.650
  313    H    VAL  44           HN       VAL  44  81.094  -0.716   6.462
  314    HA   VAL  44           HA       VAL  44  82.599  -0.207   8.933
  315    HB   VAL  44           HB       VAL  44  83.233  -0.238   5.976
  316   HG11  VAL  44          HG11      VAL  44  84.468   1.692   6.672
  317   HG12  VAL  44          HG12      VAL  44  85.621   0.358   6.700
  318   HG13  VAL  44          HG13      VAL  44  84.913   0.942   8.206
  319   HG21  VAL  44          HG21      VAL  44  83.282  -2.355   7.216
  320   HG22  VAL  44          HG22      VAL  44  84.386  -1.654   8.399
  321   HG23  VAL  44          HG23      VAL  44  84.915  -1.896   6.734
  322    H    MET  45           HN       MET  45  81.174   1.616   6.227
  323    HA   MET  45           HA       MET  45  82.150   4.201   6.724
  324    HB2  MET  45           HB2      MET  45  79.411   3.211   5.901
  325    HB3  MET  45           HB1      MET  45  79.713   4.932   6.096
  326    HG2  MET  45           HG2      MET  45  81.777   4.416   4.491
  327    HG3  MET  45           HG1      MET  45  80.774   3.054   4.013
  328    HE1  MET  45           HE1      MET  45  78.201   3.405   3.973
  329    HE2  MET  45           HE2      MET  45  78.550   3.433   2.248
  330    HE3  MET  45           HE3      MET  45  77.454   4.636   2.949
  331    H    LEU  46           HN       LEU  46  79.676   2.357   8.420
  332    HA   LEU  46           HA       LEU  46  78.901   4.524  10.183
  333    HB2  LEU  46           HB2      LEU  46  77.727   2.198   9.525
  334    HB3  LEU  46           HB1      LEU  46  78.521   1.662  11.003
  335    HG   LEU  46           HG       LEU  46  77.489   3.903  12.007
  336   HD11  LEU  46          HD11      LEU  46  76.601   4.739   9.878
  337   HD12  LEU  46          HD12      LEU  46  75.276   4.398  10.987
  338   HD13  LEU  46          HD13      LEU  46  75.643   3.271   9.682
  339   HD21  LEU  46          HD21      LEU  46  75.340   2.570  12.480
  340   HD22  LEU  46          HD22      LEU  46  76.861   1.804  12.938
  341   HD23  LEU  46          HD23      LEU  46  76.033   1.307  11.462
  342    H    LYS  47           HN       LYS  47  80.651   1.479  10.940
  343    HA   LYS  47           HA       LYS  47  81.420   2.141  13.557
  344    HB2  LYS  47           HB2      LYS  47  83.161   0.620  11.604
  345    HB3  LYS  47           HB1      LYS  47  83.147   0.467  13.359
  346    HG2  LYS  47           HG2      LYS  47  80.979  -0.549  13.343
  347    HG3  LYS  47           HG1      LYS  47  80.729  -0.143  11.645
  348    HD2  LYS  47           HD2      LYS  47  82.522  -1.642  10.968
  349    HD3  LYS  47           HD1      LYS  47  82.917  -1.981  12.652
  350    HE2  LYS  47           HE2      LYS  47  80.204  -2.560  11.441
  351    HE3  LYS  47           HE1      LYS  47  81.507  -3.750  11.510
  352    HZ1  LYS  47           HZ1      LYS  47  81.015  -4.162  13.614
  353    HZ2  LYS  47           HZ2      LYS  47  79.689  -3.106  13.507
  354    HZ3  LYS  47           HZ3      LYS  47  81.198  -2.529  14.032
  355    H    LEU  48           HN       LEU  48  83.572   2.432  10.707
  356    HA   LEU  48           HA       LEU  48  85.671   3.789  11.930
  357    HB2  LEU  48           HB2      LEU  48  85.861   3.001   9.661
  358    HB3  LEU  48           HB1      LEU  48  84.529   4.019   9.135
  359    HG   LEU  48           HG       LEU  48  85.939   6.039   9.640
  360   HD11  LEU  48          HD11      LEU  48  88.060   3.940  10.119
  361   HD12  LEU  48          HD12      LEU  48  87.449   5.097  11.302
  362   HD13  LEU  48          HD13      LEU  48  88.379   5.660   9.913
  363   HD21  LEU  48          HD21      LEU  48  87.309   4.066   7.816
  364   HD22  LEU  48          HD22      LEU  48  87.286   5.822   7.667
  365   HD23  LEU  48          HD23      LEU  48  85.811   4.891   7.395
  366    H    VAL  49           HN       VAL  49  82.595   5.082  10.801
  367    HA   VAL  49           HA       VAL  49  83.303   7.866  11.225
  368    HB   VAL  49           HB       VAL  49  80.737   6.351  10.781
  369   HG11  VAL  49          HG11      VAL  49  79.568   8.543  10.685
  370   HG12  VAL  49          HG12      VAL  49  80.986   9.290  11.420
  371   HG13  VAL  49          HG13      VAL  49  80.052   8.088  12.312
  372   HG21  VAL  49          HG21      VAL  49  80.720   7.457   8.681
  373   HG22  VAL  49          HG22      VAL  49  82.400   6.984   8.931
  374   HG23  VAL  49          HG23      VAL  49  81.901   8.652   9.216
  375    H    GLU  50           HN       GLU  50  81.392   5.476  13.071
  376    HA   GLU  50           HA       GLU  50  80.590   6.976  15.253
  377    HB2  GLU  50           HB2      GLU  50  81.668   4.156  15.122
  378    HB3  GLU  50           HB1      GLU  50  81.035   4.843  16.616
  379    HG2  GLU  50           HG2      GLU  50  79.464   4.800  14.022
  380    HG3  GLU  50           HG1      GLU  50  79.350   3.533  15.244
  381    H    LYS  51           HN       LYS  51  83.831   5.718  14.607
  382    HA   LYS  51           HA       LYS  51  84.956   6.529  17.134
  383    HB2  LYS  51           HB2      LYS  51  86.256   5.970  14.454
  384    HB3  LYS  51           HB1      LYS  51  87.116   6.126  15.986
  385    HG2  LYS  51           HG2      LYS  51  86.015   4.208  16.903
  386    HG3  LYS  51           HG1      LYS  51  84.879   4.137  15.561
  387    HD2  LYS  51           HD2      LYS  51  86.670   3.583  14.015
  388    HD3  LYS  51           HD1      LYS  51  87.856   3.730  15.307
  389    HE2  LYS  51           HE2      LYS  51  87.326   1.384  15.075
  390    HE3  LYS  51           HE1      LYS  51  86.596   1.970  16.564
  391    HZ1  LYS  51           HZ1      LYS  51  84.996   2.136  14.135
  392    HZ2  LYS  51           HZ2      LYS  51  84.513   1.846  15.736
  393    HZ3  LYS  51           HZ3      LYS  51  85.215   0.600  14.821
  394    H    LEU  52           HN       LEU  52  84.616   8.129  13.973
  395    HA   LEU  52           HA       LEU  52  86.368  10.281  14.467
  396    HB2  LEU  52           HB2      LEU  52  84.726   9.410  12.404
  397    HB3  LEU  52           HB1      LEU  52  83.935  10.895  12.894
  398    HG   LEU  52           HG       LEU  52  85.441  11.571  11.240
  399   HD11  LEU  52          HD11      LEU  52  85.775  12.597  13.732
  400   HD12  LEU  52          HD12      LEU  52  86.637  13.191  12.320
  401   HD13  LEU  52          HD13      LEU  52  87.419  12.051  13.410
  402   HD21  LEU  52          HD21      LEU  52  87.924  10.834  11.391
  403   HD22  LEU  52          HD22      LEU  52  86.744   9.657  10.817
  404   HD23  LEU  52          HD23      LEU  52  87.331   9.577  12.476
  405    H    ASP  53           HN       ASP  53  82.818  10.322  14.642
  406    HA   ASP  53           HA       ASP  53  81.357  11.397  16.091
  407    HB2  ASP  53           HB2      ASP  53  83.147  10.482  17.726
  408    HB3  ASP  53           HB1      ASP  53  83.680  12.149  17.834
  409    H    VAL  54           HN       VAL  54  81.250  12.912  14.317
  410    HA   VAL  54           HA       VAL  54  81.631  15.623  15.184
  411    HB   VAL  54           HB       VAL  54  83.930  15.232  14.637
  412   HG11  VAL  54          HG11      VAL  54  82.902  14.180  11.989
  413   HG12  VAL  54          HG12      VAL  54  83.576  13.204  13.298
  414   HG13  VAL  54          HG13      VAL  54  84.600  14.355  12.434
  415   HG21  VAL  54          HG21      VAL  54  82.710  16.608  12.224
  416   HG22  VAL  54          HG22      VAL  54  84.297  16.899  12.932
  417   HG23  VAL  54          HG23      VAL  54  82.842  17.371  13.808
  418    H    LYS  55           HN       LYS  55  80.504  17.095  13.881
  419    HA   LYS  55           HA       LYS  55  78.441  16.000  12.190
  420    HB2  LYS  55           HB2      LYS  55  78.435  18.176  13.596
  421    HB3  LYS  55           HB1      LYS  55  79.289  18.886  12.230
  422    HG2  LYS  55           HG2      LYS  55  76.891  19.290  12.079
  423    HG3  LYS  55           HG1      LYS  55  77.446  18.321  10.741
  424    HD2  LYS  55           HD2      LYS  55  76.242  16.463  11.403
  425    HD3  LYS  55           HD1      LYS  55  76.451  16.810  13.112
  426    HE2  LYS  55           HE2      LYS  55  74.677  18.346  13.158
  427    HE3  LYS  55           HE1      LYS  55  74.720  18.587  11.411
  428    HZ1  LYS  55           HZ1      LYS  55  74.234  15.956  11.597
  429    HZ2  LYS  55           HZ2      LYS  55  73.028  17.140  11.425
  430    HZ3  LYS  55           HZ3      LYS  55  73.410  16.529  12.964
  431    H    LYS  56           HN       LYS  56  81.135  15.322  11.290
  432    HA   LYS  56           HA       LYS  56  81.721  16.981   8.961
  433    HB2  LYS  56           HB2      LYS  56  83.449  15.657  10.232
  434    HB3  LYS  56           HB1      LYS  56  82.730  14.189   9.584
  435    HG2  LYS  56           HG2      LYS  56  83.154  15.003   7.289
  436    HG3  LYS  56           HG1      LYS  56  83.891  16.462   7.944
  437    HD2  LYS  56           HD2      LYS  56  84.914  13.742   8.764
  438    HD3  LYS  56           HD1      LYS  56  85.437  14.464   7.245
  439    HE2  LYS  56           HE2      LYS  56  85.755  15.673  10.011
  440    HE3  LYS  56           HE1      LYS  56  87.041  15.036   8.990
  441    HZ1  LYS  56           HZ1      LYS  56  87.211  17.145   8.312
  442    HZ2  LYS  56           HZ2      LYS  56  85.656  17.568   8.853
  443    HZ3  LYS  56           HZ3      LYS  56  85.857  16.796   7.352
  444    H    ASP  57           HN       ASP  57  81.497  16.231   6.758
  445    HA   ASP  57           HA       ASP  57  78.973  14.951   6.249
  446    HB2  ASP  57           HB2      ASP  57  79.938  14.924   3.829
  447    HB3  ASP  57           HB1      ASP  57  79.615  16.473   4.592
  448    H    TRP  58           HN       TRP  58  78.925  12.898   7.035
  449    HA   TRP  58           HA       TRP  58  81.092  10.999   6.579
  450    HB2  TRP  58           HB2      TRP  58  78.281  10.609   7.624
  451    HB3  TRP  58           HB1      TRP  58  79.554   9.404   7.680
  452    HD1  TRP  58           HD1      TRP  58  81.766  11.851   8.555
  453    HE1  TRP  58           HE1      TRP  58  81.770  12.476  11.054
  454    HE3  TRP  58           HE3      TRP  58  77.231  10.009   9.972
  455    HZ2  TRP  58           HZ2      TRP  58  80.068  12.244  13.335
  456    HZ3  TRP  58           HZ3      TRP  58  76.438  10.228  12.298
  457    HH2  TRP  58           HH2      TRP  58  77.859  11.345  13.991
  458    H    SER  59           HN       SER  59  77.765  11.400   5.348
  459    HA   SER  59           HA       SER  59  77.688   9.098   3.713
  460    HB2  SER  59           HB2      SER  59  75.882  10.977   4.223
  461    HB3  SER  59           HB1      SER  59  76.453  11.633   2.694
  462    HG   SER  59           HG       SER  59  75.522   8.987   3.162
  463    H    ASP  60           HN       ASP  60  78.554  12.421   2.656
  464    HA   ASP  60           HA       ASP  60  79.316  11.821   0.031
  465    HB2  ASP  60           HB2      ASP  60  79.288  14.119   0.889
  466    HB3  ASP  60           HB1      ASP  60  80.645  13.753   1.954
  467    H    HIS  61           HN       HIS  61  80.884  11.015   3.011
  468    HA   HIS  61           HA       HIS  61  83.466  10.421   1.860
  469    HB2  HIS  61           HB2      HIS  61  84.072  10.259   4.050
  470    HB3  HIS  61           HB1      HIS  61  82.411  10.671   4.452
  471    HD1  HIS  61           HD1      HIS  61  81.336   9.009   5.963
  472    HD2  HIS  61           HD2      HIS  61  84.238   7.227   3.559
  473    HE1  HIS  61           HE1      HIS  61  81.428   6.569   6.636
  474    H    ALA  62           HN       ALA  62  84.336   8.428   1.372
  475    HA   ALA  62           HA       ALA  62  82.754   5.987   1.502
  476    HB1  ALA  62           HB1      ALA  62  83.123   7.489  -1.085
  477    HB2  ALA  62           HB2      ALA  62  81.682   6.675  -0.475
  478    HB3  ALA  62           HB3      ALA  62  83.033   5.726  -1.095
  479    H    LEU  63           HN       LEU  63  84.120   4.141   0.993
  480    HA   LEU  63           HA       LEU  63  87.011   4.825   1.211
  481    HB2  LEU  63           HB2      LEU  63  85.738   2.080   1.334
  482    HB3  LEU  63           HB1      LEU  63  87.338   2.546   1.888
  483    HG   LEU  63           HG       LEU  63  85.973   2.379   3.827
  484   HD11  LEU  63          HD11      LEU  63  85.997   5.337   3.238
  485   HD12  LEU  63          HD12      LEU  63  87.471   4.420   3.547
  486   HD13  LEU  63          HD13      LEU  63  86.228   4.529   4.788
  487   HD21  LEU  63          HD21      LEU  63  83.770   2.986   4.012
  488   HD22  LEU  63          HD22      LEU  63  83.797   2.883   2.256
  489   HD23  LEU  63          HD23      LEU  63  83.966   4.448   3.051
  490    H    TRP  64           HN       TRP  64  88.523   4.211  -0.305
  491    HA   TRP  64           HA       TRP  64  87.525   2.868  -2.812
  492    HB2  TRP  64           HB2      TRP  64  88.012   4.728  -4.035
  493    HB3  TRP  64           HB1      TRP  64  88.294   5.576  -2.546
  494    HD1  TRP  64           HD1      TRP  64  90.602   3.022  -4.389
  495    HE1  TRP  64           HE1      TRP  64  92.894   4.137  -4.686
  496    HE3  TRP  64           HE3      TRP  64  89.552   7.651  -2.578
  497    HZ2  TRP  64           HZ2      TRP  64  94.107   6.694  -4.306
  498    HZ3  TRP  64           HZ3      TRP  64  91.281   9.433  -2.585
  499    HH2  TRP  64           HH2      TRP  64  93.557   8.959  -3.451
  500    H    TRP  65           HN       TRP  65  88.839   1.277  -3.596
  501    HA   TRP  65           HA       TRP  65  91.153   0.518  -1.909
  502    HB2  TRP  65           HB2      TRP  65  89.254  -1.085  -2.580
  503    HB3  TRP  65           HB1      TRP  65  89.975  -1.081  -4.183
  504    HD1  TRP  65           HD1      TRP  65  92.873  -0.781  -2.086
  505    HE1  TRP  65           HE1      TRP  65  93.927  -3.054  -1.557
  506    HE3  TRP  65           HE3      TRP  65  89.037  -3.888  -3.426
  507    HZ2  TRP  65           HZ2      TRP  65  93.268  -5.827  -1.692
  508    HZ3  TRP  65           HZ3      TRP  65  89.291  -6.343  -3.219
  509    HH2  TRP  65           HH2      TRP  65  91.398  -7.316  -2.353
  510    H    GLU  66           HN       GLU  66  92.740   2.032  -2.740
  511    HA   GLU  66           HA       GLU  66  93.241   2.583  -5.453
  512    HB2  GLU  66           HB2      GLU  66  95.643   2.990  -4.705
  513    HB3  GLU  66           HB1      GLU  66  94.404   3.876  -3.818
  514    HG2  GLU  66           HG2      GLU  66  94.417   2.191  -2.064
  515    HG3  GLU  66           HG1      GLU  66  95.624   1.256  -2.943
  516    H    LYS  67           HN       LYS  67  93.950  -0.357  -3.682
  517    HA   LYS  67           HA       LYS  67  95.990  -1.309  -5.481
  518    HB2  LYS  67           HB2      LYS  67  93.909  -3.016  -4.086
  519    HB3  LYS  67           HB1      LYS  67  95.476  -3.546  -4.681
  520    HG2  LYS  67           HG2      LYS  67  95.008  -1.581  -2.424
  521    HG3  LYS  67           HG1      LYS  67  95.547  -3.249  -2.254
  522    HD2  LYS  67           HD2      LYS  67  97.490  -2.541  -3.838
  523    HD3  LYS  67           HD1      LYS  67  97.029  -0.896  -3.400
  524    HE2  LYS  67           HE2      LYS  67  98.589  -1.339  -1.730
  525    HE3  LYS  67           HE1      LYS  67  97.114  -1.887  -0.927
  526    HZ1  LYS  67           HZ1      LYS  67  98.653  -3.761  -2.596
  527    HZ2  LYS  67           HZ2      LYS  67  97.629  -4.083  -1.279
  528    HZ3  LYS  67           HZ3      LYS  67  99.175  -3.426  -1.017
  529    H    LYS  68           HN       LYS  68  92.788  -0.530  -5.778
  530    HA   LYS  68           HA       LYS  68  92.491  -1.921  -8.392
  531    HB2  LYS  68           HB2      LYS  68  90.101  -1.461  -6.620
  532    HB3  LYS  68           HB1      LYS  68  90.340  -2.677  -7.871
  533    HG2  LYS  68           HG2      LYS  68  91.925  -2.714  -5.282
  534    HG3  LYS  68           HG1      LYS  68  90.368  -3.487  -5.442
  535    HD2  LYS  68           HD2      LYS  68  91.123  -5.010  -7.073
  536    HD3  LYS  68           HD1      LYS  68  92.552  -4.044  -7.432
  537    HE2  LYS  68           HE2      LYS  68  93.694  -4.789  -5.555
  538    HE3  LYS  68           HE1      LYS  68  92.223  -5.117  -4.645
  539    HZ1  LYS  68           HZ1      LYS  68  92.395  -6.702  -7.010
  540    HZ2  LYS  68           HZ2      LYS  68  92.169  -7.187  -5.398
  541    HZ3  LYS  68           HZ3      LYS  68  93.738  -6.944  -6.003
  542    H    ARG  69           HN       ARG  69  92.348   0.944  -6.551
  543    HA   ARG  69           HA       ARG  69  91.590   3.116  -7.038
  544    HB2  ARG  69           HB2      ARG  69  92.026   1.999  -9.833
  545    HB3  ARG  69           HB1      ARG  69  91.515   3.656  -9.546
  546    HG2  ARG  69           HG2      ARG  69  93.826   3.934  -9.657
  547    HG3  ARG  69           HG1      ARG  69  93.614   3.715  -7.923
  548    HD2  ARG  69           HD2      ARG  69  95.366   2.234  -8.436
  549    HD3  ARG  69           HD1      ARG  69  93.952   1.185  -8.440
  550    HE   ARG  69           HE       ARG  69  94.331   2.187 -11.079
  551   HH11  ARG  69          HH11      ARG  69  95.286   0.827 -12.613
  552   HH12  ARG  69          HH12      ARG  69  96.234  -0.522 -12.082
  553   HH21  ARG  69          HH21      ARG  69  95.770   0.139  -8.710
  554   HH22  ARG  69          HH22      ARG  69  96.508  -0.911  -9.872
  555    H    THR  70           HN       THR  70  89.669   1.292  -6.313
  556    HA   THR  70           HA       THR  70  87.383   1.761  -8.199
  557    HB   THR  70           HB       THR  70  88.095  -0.596  -7.470
  558    HG1  THR  70           HG1      THR  70  86.125  -1.039  -7.976
  559   HG21  THR  70          HG21      THR  70  86.553  -0.073  -4.962
  560   HG22  THR  70          HG22      THR  70  88.280   0.281  -4.999
  561   HG23  THR  70          HG23      THR  70  87.711  -1.358  -5.312
  562    H    TRP  71           HN       TRP  71  85.282   1.572  -6.650
  563    HA   TRP  71           HA       TRP  71  85.621   3.440  -4.355
  564    HB2  TRP  71           HB2      TRP  71  83.255   4.275  -5.060
  565    HB3  TRP  71           HB1      TRP  71  84.657   4.922  -5.886
  566    HD1  TRP  71           HD1      TRP  71  83.624   1.406  -6.866
  567    HE1  TRP  71           HE1      TRP  71  82.567   1.460  -9.171
  568    HE3  TRP  71           HE3      TRP  71  83.227   6.453  -7.544
  569    HZ2  TRP  71           HZ2      TRP  71  81.674   3.365 -11.112
  570    HZ3  TRP  71           HZ3      TRP  71  82.270   7.357  -9.644
  571    HH2  TRP  71           HH2      TRP  71  81.493   5.820 -11.428
  572    H    LEU  72           HN       LEU  72  85.417   1.930  -2.823
  573    HA   LEU  72           HA       LEU  72  83.845  -0.398  -2.974
  574    HB2  LEU  72           HB2      LEU  72  84.687   1.139  -0.512
  575    HB3  LEU  72           HB1      LEU  72  84.230  -0.558  -0.559
  576    HG   LEU  72           HG       LEU  72  86.466   0.569  -2.245
  577   HD11  LEU  72          HD11      LEU  72  86.529  -0.507   0.560
  578   HD12  LEU  72          HD12      LEU  72  87.240   0.982  -0.067
  579   HD13  LEU  72          HD13      LEU  72  87.945  -0.578  -0.490
  580   HD21  LEU  72          HD21      LEU  72  85.457  -2.192  -1.600
  581   HD22  LEU  72          HD22      LEU  72  87.154  -1.956  -2.014
  582   HD23  LEU  72          HD23      LEU  72  85.898  -1.499  -3.162
  583    H    LEU  73           HN       LEU  73  81.877   0.306  -3.848
  584    HA   LEU  73           HA       LEU  73  79.958   1.460  -1.852
  585    HB2  LEU  73           HB2      LEU  73  78.639   2.283  -3.817
  586    HB3  LEU  73           HB1      LEU  73  80.217   3.046  -3.664
  587    HG   LEU  73           HG       LEU  73  80.894   0.969  -5.306
  588   HD11  LEU  73          HD11      LEU  73  79.205   0.478  -6.908
  589   HD12  LEU  73          HD12      LEU  73  78.142   1.748  -6.300
  590   HD13  LEU  73          HD13      LEU  73  78.401   0.293  -5.351
  591   HD21  LEU  73          HD21      LEU  73  79.614   3.542  -6.281
  592   HD22  LEU  73          HD22      LEU  73  80.778   2.553  -7.161
  593   HD23  LEU  73          HD23      LEU  73  81.269   3.405  -5.704
  594    H    LYS  74           HN       LYS  74  80.894  -1.358  -3.122
  595    HA   LYS  74           HA       LYS  74  78.327  -2.424  -4.014
  596    HB2  LYS  74           HB2      LYS  74  81.091  -3.498  -3.592
  597    HB3  LYS  74           HB1      LYS  74  79.770  -4.660  -3.598
  598    HG2  LYS  74           HG2      LYS  74  80.682  -4.408  -5.863
  599    HG3  LYS  74           HG1      LYS  74  79.030  -3.809  -5.799
  600    HD2  LYS  74           HD2      LYS  74  80.459  -2.256  -7.058
  601    HD3  LYS  74           HD1      LYS  74  79.870  -1.498  -5.583
  602    HE2  LYS  74           HE2      LYS  74  82.417  -1.300  -6.221
  603    HE3  LYS  74           HE1      LYS  74  81.959  -1.582  -4.546
  604    HZ1  LYS  74           HZ1      LYS  74  82.552  -3.793  -4.662
  605    HZ2  LYS  74           HZ2      LYS  74  83.748  -3.059  -5.619
  606    HZ3  LYS  74           HZ3      LYS  74  82.440  -3.855  -6.353
  607    H    THR  75           HN       THR  75  77.203  -1.659  -1.979
  608    HA   THR  75           HA       THR  75  77.780  -3.028   0.524
  609    HB   THR  75           HB       THR  75  75.473  -2.068   1.139
  610    HG1  THR  75           HG1      THR  75  75.841  -0.612  -1.245
  611   HG21  THR  75          HG21      THR  75  77.879  -0.463   0.311
  612   HG22  THR  75          HG22      THR  75  77.246  -0.771   1.929
  613   HG23  THR  75          HG23      THR  75  76.428   0.369   0.864
  614    H    HIS  76           HN       HIS  76  75.996  -3.813  -2.327
  615    HA   HIS  76           HA       HIS  76  74.133  -5.647  -1.046
  616    HB2  HIS  76           HB2      HIS  76  73.739  -6.425  -3.414
  617    HB3  HIS  76           HB1      HIS  76  73.503  -4.694  -3.171
  618    HD1  HIS  76           HD1      HIS  76  76.533  -6.887  -3.978
  619    HD2  HIS  76           HD2      HIS  76  74.751  -3.323  -5.200
  620    HE1  HIS  76           HE1      HIS  76  77.992  -5.953  -5.827
  621    H    TRP  77           HN       TRP  77  76.892  -6.126  -0.300
  622    HA   TRP  77           HA       TRP  77  76.963  -8.957  -0.545
  623    HB2  TRP  77           HB2      TRP  77  78.037  -7.553  -2.813
  624    HB3  TRP  77           HB1      TRP  77  79.379  -8.296  -1.976
  625    HD1  TRP  77           HD1      TRP  77  78.307 -10.973  -1.018
  626    HE1  TRP  77           HE1      TRP  77  77.534 -12.802  -2.662
  627    HE3  TRP  77           HE3      TRP  77  77.396  -8.117  -5.152
  628    HZ2  TRP  77           HZ2      TRP  77  76.647 -13.025  -5.370
  629    HZ3  TRP  77           HZ3      TRP  77  76.589  -9.163  -7.249
  630    HH2  TRP  77           HH2      TRP  77  76.213 -11.611  -7.363
  631    H    THR  78           HN       THR  78  80.139  -8.833  -0.477
  632    HA   THR  78           HA       THR  78  80.497  -7.190   1.947
  633    HB   THR  78           HB       THR  78  81.405  -9.896   2.579
  634    HG1  THR  78           HG1      THR  78  79.737 -10.550   1.229
  635   HG21  THR  78          HG21      THR  78  79.642  -9.538   4.450
  636   HG22  THR  78          HG22      THR  78  79.484  -7.910   3.810
  637   HG23  THR  78          HG23      THR  78  81.047  -8.475   4.417
  638    H    LEU  79           HN       LEU  79  82.694  -6.871   2.437
  639    HA   LEU  79           HA       LEU  79  84.523  -6.632   0.426
  640    HB2  LEU  79           HB2      LEU  79  86.233  -6.571   2.029
  641    HB3  LEU  79           HB1      LEU  79  84.845  -5.781   2.646
  642    HG   LEU  79           HG       LEU  79  85.758  -8.538   3.331
  643   HD11  LEU  79          HD11      LEU  79  85.614  -6.126   5.130
  644   HD12  LEU  79          HD12      LEU  79  87.068  -6.531   4.213
  645   HD13  LEU  79          HD13      LEU  79  86.449  -7.651   5.429
  646   HD21  LEU  79          HD21      LEU  79  83.402  -8.629   3.660
  647   HD22  LEU  79          HD22      LEU  79  83.328  -6.929   4.098
  648   HD23  LEU  79          HD23      LEU  79  83.971  -8.100   5.240
  649    H    ASP  80           HN       ASP  80  84.235  -9.530   2.442
  650    HA   ASP  80           HA       ASP  80  86.219 -11.141   1.334
  651    HB2  ASP  80           HB2      ASP  80  84.394 -11.626   3.098
  652    HB3  ASP  80           HB1      ASP  80  83.413 -12.169   1.752
  653    H    LYS  81           HN       LYS  81  83.118 -10.208  -0.040
  654    HA   LYS  81           HA       LYS  81  83.247 -12.057  -2.244
  655    HB2  LYS  81           HB2      LYS  81  81.096 -11.404  -2.453
  656    HB3  LYS  81           HB1      LYS  81  81.355 -10.128  -1.292
  657    HG2  LYS  81           HG2      LYS  81  82.107  -9.781  -4.194
  658    HG3  LYS  81           HG1      LYS  81  80.481  -9.492  -3.636
  659    HD2  LYS  81           HD2      LYS  81  81.596  -7.939  -1.879
  660    HD3  LYS  81           HD1      LYS  81  82.990  -8.014  -2.915
  661    HE2  LYS  81           HE2      LYS  81  81.497  -7.330  -4.835
  662    HE3  LYS  81           HE1      LYS  81  80.257  -6.996  -3.630
  663    HZ1  LYS  81           HZ1      LYS  81  81.931  -5.155  -4.396
  664    HZ2  LYS  81           HZ2      LYS  81  82.924  -5.871  -3.218
  665    HZ3  LYS  81           HZ3      LYS  81  81.406  -5.243  -2.786
  666    H    TYR  82           HN       TYR  82  84.498  -8.922  -1.580
  667    HA   TYR  82           HA       TYR  82  85.434  -8.488  -4.320
  668    HB2  TYR  82           HB2      TYR  82  84.943  -6.781  -2.287
  669    HB3  TYR  82           HB1      TYR  82  86.654  -7.033  -2.001
  670    HD1  TYR  82           HD1      TYR  82  84.881  -4.564  -3.112
  671    HD2  TYR  82           HD2      TYR  82  87.598  -7.395  -4.861
  672    HE1  TYR  82           HE1      TYR  82  85.404  -2.955  -4.924
  673    HE2  TYR  82           HE2      TYR  82  88.114  -5.789  -6.667
  674    HH   TYR  82           HH       TYR  82  86.982  -3.827  -7.760
  675    H    GLY  83           HN       GLY  83  86.939  -9.290  -1.161
  676    HA2  GLY  83           HA2      GLY  83  88.559 -11.274  -1.283
  677    HA3  GLY  83           HA1      GLY  83  89.256 -10.505  -2.710
  678    H    ILE  84           HN       ILE  84  88.233  -8.264  -0.487
  679    HA   ILE  84           HA       ILE  84  90.786  -7.142   0.058
  680    HB   ILE  84           HB       ILE  84  88.112  -7.016   1.393
  681   HG12  ILE  84          HG12      ILE  84  89.409  -4.853  -0.243
  682   HG13  ILE  84          HG11      ILE  84  88.495  -6.154  -0.994
  683   HG21  ILE  84          HG21      ILE  84  90.483  -5.237   1.897
  684   HG22  ILE  84          HG22      ILE  84  89.706  -6.325   3.057
  685   HG23  ILE  84          HG23      ILE  84  88.836  -4.922   2.452
  686   HD11  ILE  84          HD11      ILE  84  87.274  -4.618   1.284
  687   HD12  ILE  84          HD12      ILE  84  86.477  -5.495  -0.021
  688   HD13  ILE  84          HD13      ILE  84  87.247  -3.944  -0.347
  689    H    GLN  85           HN       GLN  85  91.837  -7.067   2.227
  690    HA   GLN  85           HA       GLN  85  91.107  -8.991   4.262
  691    HB2  GLN  85           HB2      GLN  85  92.444 -10.197   2.240
  692    HB3  GLN  85           HB1      GLN  85  93.824  -9.597   3.152
  693    HG2  GLN  85           HG2      GLN  85  93.530 -11.642   4.222
  694    HG3  GLN  85           HG1      GLN  85  92.474 -10.642   5.219
  695   HE21  GLN  85          HE21      GLN  85  90.263 -10.359   3.521
  696   HE22  GLN  85          HE22      GLN  85  89.546 -11.870   3.275
  697    H    ALA  86           HN       ALA  86  93.487  -9.213   5.608
  698    HA   ALA  86           HA       ALA  86  93.813  -6.592   6.734
  699    HB1  ALA  86           HB1      ALA  86  94.181  -8.860   7.856
  700    HB2  ALA  86           HB2      ALA  86  95.388  -7.621   8.196
  701    HB3  ALA  86           HB3      ALA  86  95.736  -8.900   7.029
  702    H    ASP  87           HN       ASP  87  95.404  -8.266   4.139
  703    HA   ASP  87           HA       ASP  87  97.770  -6.522   4.202
  704    HB2  ASP  87           HB2      ASP  87  98.117  -7.718   1.896
  705    HB3  ASP  87           HB1      ASP  87  98.285  -8.659   3.378
  706    H    ALA  88           HN       ALA  88  94.620  -6.130   3.293
  707    HA   ALA  88           HA       ALA  88  95.198  -4.436   0.913
  708    HB1  ALA  88           HB1      ALA  88  92.702  -5.507   2.193
  709    HB2  ALA  88           HB2      ALA  88  93.364  -5.935   0.623
  710    HB3  ALA  88           HB3      ALA  88  92.653  -4.338   0.876
  711    H    LYS  89           HN       LYS  89  95.737  -2.340   1.462
  712    HA   LYS  89           HA       LYS  89  94.489  -1.133   3.888
  713    HB2  LYS  89           HB2      LYS  89  96.566   0.245   2.206
  714    HB3  LYS  89           HB1      LYS  89  96.237   0.412   3.929
  715    HG2  LYS  89           HG2      LYS  89  97.383  -2.089   2.649
  716    HG3  LYS  89           HG1      LYS  89  98.336  -0.838   3.417
  717    HD2  LYS  89           HD2      LYS  89  97.491  -1.306   5.564
  718    HD3  LYS  89           HD1      LYS  89  96.103  -2.178   4.926
  719    HE2  LYS  89           HE2      LYS  89  97.794  -3.722   5.850
  720    HE3  LYS  89           HE1      LYS  89  97.542  -3.965   4.120
  721    HZ1  LYS  89           HZ1      LYS  89  99.561  -3.072   3.601
  722    HZ2  LYS  89           HZ2      LYS  89  99.938  -3.755   5.110
  723    HZ3  LYS  89           HZ3      LYS  89  99.623  -2.090   4.983
  724    H    LEU  90           HN       LEU  90  92.698  -0.101   3.601
  725    HA   LEU  90           HA       LEU  90  92.050   1.135   0.976
  726    HB2  LEU  90           HB2      LEU  90  90.147   1.140   3.300
  727    HB3  LEU  90           HB1      LEU  90  89.802   1.027   1.577
  728    HG   LEU  90           HG       LEU  90  91.045  -1.129   3.295
  729   HD11  LEU  90          HD11      LEU  90  88.896  -2.323   2.588
  730   HD12  LEU  90          HD12      LEU  90  88.315  -0.743   2.063
  731   HD13  LEU  90          HD13      LEU  90  88.710  -1.018   3.759
  732   HD21  LEU  90          HD21      LEU  90  90.383  -1.016   0.338
  733   HD22  LEU  90          HD22      LEU  90  90.741  -2.513   1.202
  734   HD23  LEU  90          HD23      LEU  90  91.973  -1.260   1.062
  735    H    GLN  91           HN       GLN  91  90.745   3.296   1.329
  736    HA   GLN  91           HA       GLN  91  92.107   5.011   3.362
  737    HB2  GLN  91           HB2      GLN  91  91.534   5.938   0.537
  738    HB3  GLN  91           HB1      GLN  91  92.489   6.754   1.766
  739    HG2  GLN  91           HG2      GLN  91  94.337   5.359   1.468
  740    HG3  GLN  91           HG1      GLN  91  93.382   4.038   0.838
  741   HE21  GLN  91          HE21      GLN  91  92.503   7.039  -0.491
  742   HE22  GLN  91          HE22      GLN  91  93.326   6.881  -1.946
  743    H    PHE  92           HN       PHE  92  90.869   6.923   3.888
  744    HA   PHE  92           HA       PHE  92  87.948   6.686   3.241
  745    HB2  PHE  92           HB2      PHE  92  88.190   6.242   5.563
  746    HB3  PHE  92           HB1      PHE  92  89.408   7.483   5.773
  747    HD1  PHE  92           HD1      PHE  92  88.644   9.973   5.407
  748    HD2  PHE  92           HD2      PHE  92  85.927   6.702   5.989
  749    HE1  PHE  92           HE1      PHE  92  86.884  11.560   6.106
  750    HE2  PHE  92           HE2      PHE  92  84.173   8.289   6.707
  751    HZ   PHE  92           HZ       PHE  92  84.644  10.721   6.755
  752    H    THR  93           HN       THR  93  87.148   8.394   2.100
  753    HA   THR  93           HA       THR  93  88.216  11.093   2.538
  754    HB   THR  93           HB       THR  93  89.875  10.802   0.968
  755    HG1  THR  93           HG1      THR  93  89.182  11.426  -1.041
  756   HG21  THR  93          HG21      THR  93  88.189   8.582  -0.196
  757   HG22  THR  93          HG22      THR  93  89.655   8.413   0.772
  758   HG23  THR  93          HG23      THR  93  89.744   9.095  -0.844
  759    HA   PRO  94           HA       PRO  94  84.208  12.480   1.332
  760    HB2  PRO  94           HB2      PRO  94  84.880  14.450  -0.594
  761    HB3  PRO  94           HB1      PRO  94  84.737  14.702   1.155
  762    HG2  PRO  94           HG2      PRO  94  87.174  14.233  -0.493
  763    HG3  PRO  94           HG1      PRO  94  86.954  15.265   0.932
  764    HD2  PRO  94           HD2      PRO  94  88.229  12.922   1.132
  765    HD3  PRO  94           HD1      PRO  94  87.144  13.470   2.427
  766    H    TYR 541           HT1      TYR 541  47.745  43.466   9.585
  767    HA   TYR 541           HA       TYR 541  48.759  43.512  11.812
  768    HB2  TYR 541           HB2      TYR 541  46.776  44.706  12.836
  769    HB3  TYR 541           HB1      TYR 541  45.900  43.176  12.758
  770    HD1  TYR 541           HD1      TYR 541  46.156  41.569  14.469
  771    HD2  TYR 541           HD2      TYR 541  49.056  44.711  14.055
  772    HE1  TYR 541           HE1      TYR 541  47.239  40.847  16.579
  773    HE2  TYR 541           HE2      TYR 541  50.139  43.989  16.165
  774    HH   TYR 541           HH       TYR 541  49.561  41.035  17.610
  775    H    HIS 542           HN       HIS 542  47.622  41.784   9.530
  776    HA   HIS 542           HA       HIS 542  46.739  39.304  10.632
  777    HB2  HIS 542           HB2      HIS 542  48.374  39.505   8.105
  778    HB3  HIS 542           HB1      HIS 542  47.010  38.450   8.462
  779    HD1  HIS 542           HD1      HIS 542  46.981  40.283   5.953
  780    HD2  HIS 542           HD2      HIS 542  45.306  41.321   9.627
  781    HE1  HIS 542           HE1      HIS 542  45.238  42.056   5.471
  782    H    GLU 543           HN       GLU 543  48.717  37.555   9.342
  783    HA   GLU 543           HA       GLU 543  51.287  38.027  10.609
  784    HB2  GLU 543           HB2      GLU 543  50.879  35.723  11.961
  785    HB3  GLU 543           HB1      GLU 543  50.531  37.299  12.670
  786    HG2  GLU 543           HG2      GLU 543  48.216  37.110  12.285
  787    HG3  GLU 543           HG1      GLU 543  48.422  35.840  11.082
  788    H    ARG 544           HN       ARG 544  49.647  34.924  10.162
  789    HA   ARG 544           HA       ARG 544  50.373  33.063   8.924
  790    HB2  ARG 544           HB2      ARG 544  49.932  35.356   7.038
  791    HB3  ARG 544           HB1      ARG 544  50.369  33.771   6.414
  792    HG2  ARG 544           HG2      ARG 544  47.950  33.923   6.425
  793    HG3  ARG 544           HG1      ARG 544  48.433  32.805   7.696
  794    HD2  ARG 544           HD2      ARG 544  47.888  34.289   9.405
  795    HD3  ARG 544           HD1      ARG 544  48.095  35.707   8.378
  796    HE   ARG 544           HE       ARG 544  45.940  34.405   7.241
  797   HH11  ARG 544          HH11      ARG 544  43.804  34.813   7.862
  798   HH12  ARG 544          HH12      ARG 544  43.479  35.414   9.454
  799   HH21  ARG 544          HH21      ARG 544  46.810  35.466  10.404
  800   HH22  ARG 544          HH22      ARG 544  45.179  35.783  10.892
  801    H    ARG 545           HN       ARG 545  52.605  34.594  10.094
  802    HA   ARG 545           HA       ARG 545  54.709  35.083   8.302
  803    HB2  ARG 545           HB2      ARG 545  55.702  33.745  10.724
  804    HB3  ARG 545           HB1      ARG 545  55.933  35.402  10.199
  805    HG2  ARG 545           HG2      ARG 545  54.769  35.644  12.220
  806    HG3  ARG 545           HG1      ARG 545  53.499  35.806  11.017
  807    HD2  ARG 545           HD2      ARG 545  52.619  33.660  11.495
  808    HD3  ARG 545           HD1      ARG 545  54.124  33.099  12.205
  809    HE   ARG 545           HE       ARG 545  53.336  35.157  13.876
  810   HH11  ARG 545          HH11      ARG 545  52.016  34.812  15.679
  811   HH12  ARG 545          HH12      ARG 545  50.961  33.440  15.712
  812   HH21  ARG 545          HH21      ARG 545  51.925  32.289  12.586
  813   HH22  ARG 545          HH22      ARG 545  50.909  32.010  13.961
  814    H    GLY 546           HN       GLY 546  54.690  32.107  10.268
  815    HA2  GLY 546           HA2      GLY 546  54.785  30.365   7.950
  816    HA3  GLY 546           HA1      GLY 546  56.381  30.586   8.668
  817    H    SER 547           HN       SER 547  56.859  29.542  10.593
  818    HA   SER 547           HA       SER 547  54.846  28.457  12.364
  819    HB2  SER 547           HB2      SER 547  56.039  26.732  10.225
  820    HB3  SER 547           HB1      SER 547  55.783  26.020  11.815
  821    HG   SER 547           HG       SER 547  53.979  25.862  10.311
  822    H    LEU 548           HN       LEU 548  55.946  28.699  14.280
  823    HA   LEU 548           HA       LEU 548  58.731  29.097  14.432
  824    HB2  LEU 548           HB2      LEU 548  56.528  28.663  16.353
  825    HB3  LEU 548           HB1      LEU 548  58.107  28.187  16.964
  826    HG   LEU 548           HG       LEU 548  58.957  30.474  16.205
  827   HD11  LEU 548          HD11      LEU 548  57.042  32.195  16.072
  828   HD12  LEU 548          HD12      LEU 548  56.001  30.815  15.728
  829   HD13  LEU 548          HD13      LEU 548  57.342  31.199  14.655
  830   HD21  LEU 548          HD21      LEU 548  58.199  29.822  18.577
  831   HD22  LEU 548          HD22      LEU 548  56.729  30.723  18.212
  832   HD23  LEU 548          HD23      LEU 548  58.295  31.539  18.190
  833    H    CYS 549           HN       CYS 549  60.477  27.767  14.643
  834    HA   CYS 549           HA       CYS 549  60.003  24.884  14.259
  835    HB2  CYS 549           HB2      CYS 549  61.848  25.653  13.004
  836    HB3  CYS 549           HB1      CYS 549  62.398  26.714  14.287
  837    H    SER 550           HN       SER 550  59.286  24.005  16.107
  838    HA   SER 550           HA       SER 550  59.679  24.833  18.722
  839    HB2  SER 550           HB2      SER 550  58.081  23.168  18.471
  840    HB3  SER 550           HB1      SER 550  59.150  22.142  17.517
  841    HG   SER 550           HG       SER 550  59.993  22.760  20.087
  842    H    GLY 551           HN       GLY 551  61.344  24.984  19.977
  843    HA2  GLY 551           HA2      GLY 551  63.341  23.974  21.057
  844    HA3  GLY 551           HA1      GLY 551  63.779  23.306  19.479
  845    H    CYS 552           HN       CYS 552  62.957  25.611  18.021
  846    HA   CYS 552           HA       CYS 552  65.215  27.473  18.624
  847    HB2  CYS 552           HB2      CYS 552  63.751  26.585  16.154
  848    HB3  CYS 552           HB1      CYS 552  64.527  28.160  16.164
  849    H    GLN 553           HN       GLN 553  61.803  27.126  17.917
  850    HA   GLN 553           HA       GLN 553  60.039  28.572  18.052
  851    HB2  GLN 553           HB2      GLN 553  61.748  29.748  20.226
  852    HB3  GLN 553           HB1      GLN 553  60.059  30.179  19.943
  853    HG2  GLN 553           HG2      GLN 553  61.022  27.354  20.398
  854    HG3  GLN 553           HG1      GLN 553  60.360  28.370  21.663
  855   HE21  GLN 553          HE21      GLN 553  59.574  26.714  18.635
  856   HE22  GLN 553          HE22      GLN 553  57.892  26.688  18.871
  857    H    LYS 554           HN       LYS 554  61.227  29.051  15.972
  858    HA   LYS 554           HA       LYS 554  61.178  31.991  15.627
  859    HB2  LYS 554           HB2      LYS 554  63.306  30.173  14.460
  860    HB3  LYS 554           HB1      LYS 554  63.094  31.865  14.031
  861    HG2  LYS 554           HG2      LYS 554  63.646  30.883  16.842
  862    HG3  LYS 554           HG1      LYS 554  64.889  31.472  15.744
  863    HD2  LYS 554           HD2      LYS 554  63.348  33.597  15.563
  864    HD3  LYS 554           HD1      LYS 554  62.652  32.994  17.066
  865    HE2  LYS 554           HE2      LYS 554  64.421  34.522  17.654
  866    HE3  LYS 554           HE1      LYS 554  64.988  32.892  18.014
  867    HZ1  LYS 554           HZ1      LYS 554  66.615  33.093  16.542
  868    HZ2  LYS 554           HZ2      LYS 554  66.232  34.744  16.422
  869    HZ3  LYS 554           HZ3      LYS 554  65.562  33.631  15.327
  870    HA   PRO 555           HA       PRO 555  58.124  30.418  12.659
  871    HB2  PRO 555           HB2      PRO 555  58.913  32.788  11.063
  872    HB3  PRO 555           HB1      PRO 555  57.307  32.257  11.569
  873    HG2  PRO 555           HG2      PRO 555  58.656  34.340  12.755
  874    HG3  PRO 555           HG1      PRO 555  57.435  33.373  13.587
  875    HD2  PRO 555           HD2      PRO 555  60.349  33.438  14.043
  876    HD3  PRO 555           HD1      PRO 555  59.079  32.721  15.064
  877    H    ILE 556           HN       ILE 556  58.296  28.995  11.098
  878    HA   ILE 556           HA       ILE 556  60.832  28.683   9.600
  879    HB   ILE 556           HB       ILE 556  58.340  26.973   9.899
  880   HG12  ILE 556          HG12      ILE 556  61.130  26.213  10.762
  881   HG13  ILE 556          HG11      ILE 556  60.177  27.254  11.797
  882   HG21  ILE 556          HG21      ILE 556  59.191  26.523   7.719
  883   HG22  ILE 556          HG22      ILE 556  59.803  25.240   8.762
  884   HG23  ILE 556          HG23      ILE 556  60.861  26.564   8.286
  885   HD11  ILE 556          HD11      ILE 556  60.081  24.546  11.941
  886   HD12  ILE 556          HD12      ILE 556  58.780  24.815  10.785
  887   HD13  ILE 556          HD13      ILE 556  58.717  25.569  12.378
  888    H    THR 557           HN       THR 557  60.712  30.257   7.955
  889    HA   THR 557           HA       THR 557  58.209  30.427   6.348
  890    HB   THR 557           HB       THR 557  58.953  32.544   5.658
  891    HG1  THR 557           HG1      THR 557  61.494  32.334   6.729
  892   HG21  THR 557          HG21      THR 557  58.462  32.247   8.144
  893   HG22  THR 557          HG22      THR 557  59.417  33.670   7.719
  894   HG23  THR 557          HG23      THR 557  60.208  32.243   8.391
  895    H    GLY 558           HN       GLY 558  58.396  28.554   5.126
  896    HA2  GLY 558           HA2      GLY 558  59.313  28.591   2.569
  897    HA3  GLY 558           HA1      GLY 558  60.744  28.038   3.452
  898    H    ARG 559           HN       ARG 559  60.748  26.005   4.344
  899    HA   ARG 559           HA       ARG 559  58.395  24.241   3.783
  900    HB2  ARG 559           HB2      ARG 559  61.378  23.823   3.671
  901    HB3  ARG 559           HB1      ARG 559  60.349  22.448   4.068
  902    HG2  ARG 559           HG2      ARG 559  59.669  24.165   1.688
  903    HG3  ARG 559           HG1      ARG 559  60.947  22.962   1.546
  904    HD2  ARG 559           HD2      ARG 559  59.481  21.167   1.910
  905    HD3  ARG 559           HD1      ARG 559  58.277  22.181   2.705
  906    HE   ARG 559           HE       ARG 559  58.379  23.177   0.121
  907   HH11  ARG 559          HH11      ARG 559  57.048  22.399  -1.530
  908   HH12  ARG 559          HH12      ARG 559  56.419  20.788  -1.432
  909   HH21  ARG 559          HH21      ARG 559  57.953  20.092   1.599
  910   HH22  ARG 559          HH22      ARG 559  56.931  19.482   0.340
  911    H    CYS 560           HN       CYS 560  57.828  22.788   5.527
  912    HA   CYS 560           HA       CYS 560  59.282  23.186   8.077
  913    HB2  CYS 560           HB2      CYS 560  57.194  23.633   9.309
  914    HB3  CYS 560           HB1      CYS 560  57.563  24.908   8.145
  915    HG   CYS 560           HG       CYS 560  55.092  24.312   7.699
  916    H    ILE 561           HN       ILE 561  59.590  21.383   9.067
  917    HA   ILE 561           HA       ILE 561  58.075  18.978   8.271
  918    HB   ILE 561           HB       ILE 561  60.442  19.387  10.125
  919   HG12  ILE 561          HG12      ILE 561  60.148  18.344   7.312
  920   HG13  ILE 561          HG11      ILE 561  60.883  19.872   7.768
  921   HG21  ILE 561          HG21      ILE 561  59.318  16.799   9.012
  922   HG22  ILE 561          HG22      ILE 561  59.040  17.351  10.667
  923   HG23  ILE 561          HG23      ILE 561  60.673  16.972  10.126
  924   HD11  ILE 561          HD11      ILE 561  62.533  18.554   9.154
  925   HD12  ILE 561          HD12      ILE 561  62.680  18.311   7.413
  926   HD13  ILE 561          HD13      ILE 561  61.886  17.088   8.412
  927    H    THR 562           HN       THR 562  56.860  17.852   9.709
  928    HA   THR 562           HA       THR 562  56.221  19.188  12.315
  929    HB   THR 562           HB       THR 562  54.241  17.568  10.724
  930    HG1  THR 562           HG1      THR 562  54.744  20.352  10.725
  931   HG21  THR 562          HG21      THR 562  52.637  18.555  12.226
  932   HG22  THR 562          HG22      THR 562  53.851  19.657  12.875
  933   HG23  THR 562          HG23      THR 562  53.961  17.929  13.212
  934    H    ALA 563           HN       ALA 563  55.895  17.899  14.032
  935    HA   ALA 563           HA       ALA 563  56.582  15.003  13.721
  936    HB1  ALA 563           HB1      ALA 563  57.777  15.201  15.884
  937    HB2  ALA 563           HB2      ALA 563  57.391  16.926  15.915
  938    HB3  ALA 563           HB3      ALA 563  58.461  16.291  14.663
  939    H    MET 564           HN       MET 564  56.271  15.458  16.798
  940    HA   MET 564           HA       MET 564  53.727  14.219  17.119
  941    HB2  MET 564           HB2      MET 564  54.926  15.772  19.368
  942    HB3  MET 564           HB1      MET 564  54.382  14.096  19.332
  943    HG2  MET 564           HG2      MET 564  56.705  13.812  19.464
  944    HG3  MET 564           HG1      MET 564  56.490  13.787  17.728
  945    HE1  MET 564           HE1      MET 564  59.111  14.102  18.657
  946    HE2  MET 564           HE2      MET 564  58.905  14.954  20.185
  947    HE3  MET 564           HE3      MET 564  59.831  15.701  18.886
  948    H    ALA 565           HN       ALA 565  53.848  16.753  15.679
  949    HA   ALA 565           HA       ALA 565  52.043  18.303  15.320
  950    HB1  ALA 565           HB1      ALA 565  50.741  19.200  17.087
  951    HB2  ALA 565           HB2      ALA 565  51.905  18.710  18.314
  952    HB3  ALA 565           HB3      ALA 565  50.913  17.496  17.497
  953    H    LYS 566           HN       LYS 566  54.957  18.182  16.886
  954    HA   LYS 566           HA       LYS 566  55.341  21.070  17.240
  955    HB2  LYS 566           HB2      LYS 566  57.390  18.837  17.222
  956    HB3  LYS 566           HB1      LYS 566  57.597  20.446  17.886
  957    HG2  LYS 566           HG2      LYS 566  55.527  18.466  18.877
  958    HG3  LYS 566           HG1      LYS 566  57.112  18.668  19.603
  959    HD2  LYS 566           HD2      LYS 566  56.096  20.234  20.935
  960    HD3  LYS 566           HD1      LYS 566  56.226  21.295  19.536
  961    HE2  LYS 566           HE2      LYS 566  53.952  21.465  20.028
  962    HE3  LYS 566           HE1      LYS 566  53.930  20.152  18.851
  963    HZ1  LYS 566           HZ1      LYS 566  52.645  19.670  20.879
  964    HZ2  LYS 566           HZ2      LYS 566  54.075  19.772  21.792
  965    HZ3  LYS 566           HZ3      LYS 566  53.899  18.558  20.617
  966    H    LYS 567           HN       LYS 567  56.718  22.341  15.869
  967    HA   LYS 567           HA       LYS 567  56.917  21.285  13.091
  968    HB2  LYS 567           HB2      LYS 567  57.597  24.094  13.877
  969    HB3  LYS 567           HB1      LYS 567  56.916  23.510  12.372
  970    HG2  LYS 567           HG2      LYS 567  55.483  23.664  15.047
  971    HG3  LYS 567           HG1      LYS 567  55.205  24.709  13.662
  972    HD2  LYS 567           HD2      LYS 567  54.746  21.692  13.658
  973    HD3  LYS 567           HD1      LYS 567  53.490  22.913  13.854
  974    HE2  LYS 567           HE2      LYS 567  54.353  23.907  11.631
  975    HE3  LYS 567           HE1      LYS 567  55.184  22.367  11.423
  976    HZ1  LYS 567           HZ1      LYS 567  53.275  21.615  10.613
  977    HZ2  LYS 567           HZ2      LYS 567  52.412  22.983  11.135
  978    HZ3  LYS 567           HZ3      LYS 567  52.660  21.677  12.192
  979    H    PHE 568           HN       PHE 568  59.060  22.182  11.941
  980    HA   PHE 568           HA       PHE 568  61.354  22.273  13.779
  981    HB2  PHE 568           HB2      PHE 568  60.438  19.754  12.543
  982    HB3  PHE 568           HB1      PHE 568  62.128  20.078  12.203
  983    HD1  PHE 568           HD1      PHE 568  63.636  20.705  14.221
  984    HD2  PHE 568           HD2      PHE 568  59.779  18.859  14.627
  985    HE1  PHE 568           HE1      PHE 568  64.236  19.953  16.506
  986    HE2  PHE 568           HE2      PHE 568  60.379  18.107  16.913
  987    HZ   PHE 568           HZ       PHE 568  62.608  18.654  17.852
  988    H    HIS 569           HN       HIS 569  63.009  23.336  12.816
  989    HA   HIS 569           HA       HIS 569  62.764  24.545  10.266
  990    HB2  HIS 569           HB2      HIS 569  65.031  23.967  12.118
  991    HB3  HIS 569           HB1      HIS 569  65.435  24.476  10.491
  992    HD2  HIS 569           HD2      HIS 569  63.723  27.033   9.916
  993    HE1  HIS 569           HE1      HIS 569  64.536  28.306  13.856
  994    HA   PRO 570           HA       PRO 570  63.056  20.550   8.053
  995    HB2  PRO 570           HB2      PRO 570  63.960  22.354   5.842
  996    HB3  PRO 570           HB1      PRO 570  62.714  21.094   5.828
  997    HG2  PRO 570           HG2      PRO 570  62.092  23.741   5.905
  998    HG3  PRO 570           HG1      PRO 570  61.083  22.508   6.669
  999    HD2  PRO 570           HD2      PRO 570  62.821  24.539   7.952
 1000    HD3  PRO 570           HD1      PRO 570  61.448  23.633   8.634
 1001    H    GLU 571           HN       GLU 571  65.539  22.782   8.778
 1002    HA   GLU 571           HA       GLU 571  67.686  21.042   7.680
 1003    HB2  GLU 571           HB2      GLU 571  68.145  23.659   9.099
 1004    HB3  GLU 571           HB1      GLU 571  69.105  22.897   7.832
 1005    HG2  GLU 571           HG2      GLU 571  67.085  23.207   6.308
 1006    HG3  GLU 571           HG1      GLU 571  66.423  24.244   7.575
 1007    H    HIS 572           HN       HIS 572  66.858  22.753  10.697
 1008    HA   HIS 572           HA       HIS 572  68.820  21.508  12.324
 1009    HB2  HIS 572           HB2      HIS 572  66.070  22.359  13.270
 1010    HB3  HIS 572           HB1      HIS 572  67.549  22.275  14.227
 1011    HD2  HIS 572           HD2      HIS 572  69.230  23.648  11.477
 1012    HE1  HIS 572           HE1      HIS 572  67.194  27.105  12.762
 1013    H    PHE 573           HN       PHE 573  66.362  20.002  10.696
 1014    HA   PHE 573           HA       PHE 573  66.487  17.642  12.553
 1015    HB2  PHE 573           HB2      PHE 573  64.205  18.914  12.350
 1016    HB3  PHE 573           HB1      PHE 573  64.128  18.171  10.757
 1017    HD1  PHE 573           HD1      PHE 573  63.712  15.815  10.484
 1018    HD2  PHE 573           HD2      PHE 573  64.328  17.484  14.393
 1019    HE1  PHE 573           HE1      PHE 573  62.947  13.692  11.511
 1020    HE2  PHE 573           HE2      PHE 573  63.562  15.362  15.421
 1021    HZ   PHE 573           HZ       PHE 573  62.871  13.465  13.980
 1022    H    VAL 574           HN       VAL 574  68.395  17.829  10.776
 1023    HA   VAL 574           HA       VAL 574  67.640  16.605   8.212
 1024    HB   VAL 574           HB       VAL 574  70.095  16.817   7.738
 1025   HG11  VAL 574          HG11      VAL 574  68.110  18.927   8.077
 1026   HG12  VAL 574          HG12      VAL 574  69.303  18.724   6.813
 1027   HG13  VAL 574          HG13      VAL 574  69.742  19.568   8.275
 1028   HG21  VAL 574          HG21      VAL 574  71.446  18.140   9.316
 1029   HG22  VAL 574          HG22      VAL 574  70.826  16.695  10.111
 1030   HG23  VAL 574          HG23      VAL 574  70.073  18.266  10.414
 1031    H    CYS 575           HN       CYS 575  69.360  14.862   7.482
 1032    HA   CYS 575           HA       CYS 575  69.184  12.590   9.335
 1033    HB2  CYS 575           HB2      CYS 575  69.096  11.562   7.305
 1034    HB3  CYS 575           HB1      CYS 575  69.653  13.024   6.503
 1035    H    ALA 576           HN       ALA 576  71.013  11.599  10.419
 1036    HA   ALA 576           HA       ALA 576  73.356  13.494  10.534
 1037    HB1  ALA 576           HB1      ALA 576  74.014  11.730  12.397
 1038    HB2  ALA 576           HB2      ALA 576  72.319  11.246  12.278
 1039    HB3  ALA 576           HB3      ALA 576  72.737  12.901  12.722
 1040    H    PHE 577           HN       PHE 577  73.799  12.774   8.309
 1041    HA   PHE 577           HA       PHE 577  76.028  10.947   8.309
 1042    HB2  PHE 577           HB2      PHE 577  73.620   9.794   7.385
 1043    HB3  PHE 577           HB1      PHE 577  74.417  10.318   5.906
 1044    HD1  PHE 577           HD1      PHE 577  75.737   8.589   4.907
 1045    HD2  PHE 577           HD2      PHE 577  75.490   8.835   9.168
 1046    HE1  PHE 577           HE1      PHE 577  77.305   6.695   5.103
 1047    HE2  PHE 577           HE2      PHE 577  77.053   6.940   9.377
 1048    HZ   PHE 577           HZ       PHE 577  77.962   5.860   7.342
 1049    H    CYS 578           HN       CYS 578  73.716  12.798   6.588
 1050    HA   CYS 578           HA       CYS 578  75.789  14.612   5.479
 1051    HB2  CYS 578           HB2      CYS 578  74.502  14.769   3.388
 1052    HB3  CYS 578           HB1      CYS 578  74.969  13.099   3.657
 1053    H    LEU 579           HN       LEU 579  75.164  15.771   7.403
 1054    HA   LEU 579           HA       LEU 579  72.634  16.415   8.288
 1055    HB2  LEU 579           HB2      LEU 579  73.733  18.593   9.146
 1056    HB3  LEU 579           HB1      LEU 579  74.347  17.054   9.714
 1057    HG   LEU 579           HG       LEU 579  76.057  18.833   9.002
 1058   HD11  LEU 579          HD11      LEU 579  76.229  16.070   8.984
 1059   HD12  LEU 579          HD12      LEU 579  77.580  17.179   8.767
 1060   HD13  LEU 579          HD13      LEU 579  76.783  16.489   7.360
 1061   HD21  LEU 579          HD21      LEU 579  75.280  17.915   6.220
 1062   HD22  LEU 579          HD22      LEU 579  76.554  19.051   6.645
 1063   HD23  LEU 579          HD23      LEU 579  74.870  19.484   6.914
 1064    H    LYS 580           HN       LYS 580  73.084  17.005   5.119
 1065    HA   LYS 580           HA       LYS 580  72.286  19.854   5.176
 1066    HB2  LYS 580           HB2      LYS 580  72.782  19.932   2.932
 1067    HB3  LYS 580           HB1      LYS 580  73.764  18.553   3.390
 1068    HG2  LYS 580           HG2      LYS 580  70.963  18.310   2.214
 1069    HG3  LYS 580           HG1      LYS 580  72.445  18.227   1.279
 1070    HD2  LYS 580           HD2      LYS 580  73.119  16.212   2.236
 1071    HD3  LYS 580           HD1      LYS 580  72.111  16.434   3.661
 1072    HE2  LYS 580           HE2      LYS 580  71.335  14.721   1.871
 1073    HE3  LYS 580           HE1      LYS 580  70.149  15.850   2.526
 1074    HZ1  LYS 580           HZ1      LYS 580  71.410  15.802  -0.116
 1075    HZ2  LYS 580           HZ2      LYS 580  70.999  17.312   0.547
 1076    HZ3  LYS 580           HZ3      LYS 580  69.801  16.131   0.307
 1077    H    GLN 581           HN       GLN 581  70.534  16.744   4.467
 1078    HA   GLN 581           HA       GLN 581  68.107  18.212   5.084
 1079    HB2  GLN 581           HB2      GLN 581  68.562  18.851   2.727
 1080    HB3  GLN 581           HB1      GLN 581  68.240  17.179   2.273
 1081    HG2  GLN 581           HG2      GLN 581  66.162  18.317   2.020
 1082    HG3  GLN 581           HG1      GLN 581  66.012  17.453   3.537
 1083   HE21  GLN 581          HE21      GLN 581  66.474  18.776   5.561
 1084   HE22  GLN 581          HE22      GLN 581  66.120  20.428   5.517
 1085    H    LEU 582           HN       LEU 582  66.427  17.076   5.692
 1086    HA   LEU 582           HA       LEU 582  66.254  14.182   5.084
 1087    HB2  LEU 582           HB2      LEU 582  67.341  14.629   7.336
 1088    HB3  LEU 582           HB1      LEU 582  65.801  15.285   7.858
 1089    HG   LEU 582           HG       LEU 582  64.732  13.108   7.375
 1090   HD11  LEU 582          HD11      LEU 582  65.820  11.899   5.767
 1091   HD12  LEU 582          HD12      LEU 582  66.704  11.227   7.134
 1092   HD13  LEU 582          HD13      LEU 582  67.399  12.547   6.193
 1093   HD21  LEU 582          HD21      LEU 582  66.224  11.785   9.125
 1094   HD22  LEU 582          HD22      LEU 582  65.320  13.218   9.610
 1095   HD23  LEU 582          HD23      LEU 582  67.043  13.341   9.275
 1096    H    ASN 583           HN       ASN 583  63.995  13.387   5.783
 1097    HA   ASN 583           HA       ASN 583  61.941  15.538   5.852
 1098    HB2  ASN 583           HB2      ASN 583  62.304  13.523   3.627
 1099    HB3  ASN 583           HB1      ASN 583  60.704  14.155   4.003
 1100   HD21  ASN 583          HD21      ASN 583  61.648  14.770   1.522
 1101   HD22  ASN 583          HD22      ASN 583  62.138  16.388   1.444
 1102    H    LYS 584           HN       LYS 584  60.335  14.952   7.215
 1103    HA   LYS 584           HA       LYS 584  60.402  12.668   8.836
 1104    HB2  LYS 584           HB2      LYS 584  57.953  13.145   9.211
 1105    HB3  LYS 584           HB1      LYS 584  59.006  14.540   9.453
 1106    HG2  LYS 584           HG2      LYS 584  58.550  15.307   7.156
 1107    HG3  LYS 584           HG1      LYS 584  57.511  13.914   6.887
 1108    HD2  LYS 584           HD2      LYS 584  57.058  16.220   8.804
 1109    HD3  LYS 584           HD1      LYS 584  56.098  15.797   7.390
 1110    HE2  LYS 584           HE2      LYS 584  55.720  13.526   8.618
 1111    HE3  LYS 584           HE1      LYS 584  56.239  14.410  10.055
 1112    HZ1  LYS 584           HZ1      LYS 584  54.258  15.710   8.365
 1113    HZ2  LYS 584           HZ2      LYS 584  54.396  15.682  10.058
 1114    HZ3  LYS 584           HZ3      LYS 584  53.730  14.353   9.235
 1115    H    GLY 585           HN       GLY 585  59.302  13.020   5.589
 1116    HA2  GLY 585           HA2      GLY 585  57.698  10.554   5.626
 1117    HA3  GLY 585           HA1      GLY 585  57.985  11.594   4.234
 1118    H    THR 586           HN       THR 586  60.913  11.501   5.144
 1119    HA   THR 586           HA       THR 586  61.609   8.764   4.166
 1120    HB   THR 586           HB       THR 586  63.051   9.584   2.511
 1121    HG1  THR 586           HG1      THR 586  63.288  11.623   4.277
 1122   HG21  THR 586          HG21      THR 586  60.881  11.702   2.616
 1123   HG22  THR 586          HG22      THR 586  60.617  10.054   2.046
 1124   HG23  THR 586          HG23      THR 586  61.727  11.118   1.180
 1125    H    PHE 587           HN       PHE 587  61.611  10.187   6.808
 1126    HA   PHE 587           HA       PHE 587  64.510  10.426   7.371
 1127    HB2  PHE 587           HB2      PHE 587  63.949  11.332   9.449
 1128    HB3  PHE 587           HB1      PHE 587  62.669  11.916   8.408
 1129    HD1  PHE 587           HD1      PHE 587  63.100  10.922  11.589
 1130    HD2  PHE 587           HD2      PHE 587  60.774   9.725   8.181
 1131    HE1  PHE 587           HE1      PHE 587  61.415   9.895  13.089
 1132    HE2  PHE 587           HE2      PHE 587  59.097   8.704   9.679
 1133    HZ   PHE 587           HZ       PHE 587  59.414   8.787  12.134
 1134    H    LYS 588           HN       LYS 588  65.569   8.598   7.549
 1135    HA   LYS 588           HA       LYS 588  64.313   6.217   8.817
 1136    HB2  LYS 588           HB2      LYS 588  65.935   6.583   6.533
 1137    HB3  LYS 588           HB1      LYS 588  67.010   5.900   7.707
 1138    HG2  LYS 588           HG2      LYS 588  65.870   4.217   6.226
 1139    HG3  LYS 588           HG1      LYS 588  65.710   3.925   7.944
 1140    HD2  LYS 588           HD2      LYS 588  63.635   3.646   6.365
 1141    HD3  LYS 588           HD1      LYS 588  63.423   4.373   7.937
 1142    HE2  LYS 588           HE2      LYS 588  63.037   6.492   7.035
 1143    HE3  LYS 588           HE1      LYS 588  64.010   6.170   5.618
 1144    HZ1  LYS 588           HZ1      LYS 588  61.825   6.132   4.869
 1145    HZ2  LYS 588           HZ2      LYS 588  61.283   5.232   6.204
 1146    HZ3  LYS 588           HZ3      LYS 588  62.246   4.495   5.013
 1147    H    GLU 589           HN       GLU 589  65.721   5.028  10.395
 1148    HA   GLU 589           HA       GLU 589  67.788   6.677  11.708
 1149    HB2  GLU 589           HB2      GLU 589  66.009   7.668  12.845
 1150    HB3  GLU 589           HB1      GLU 589  65.062   6.187  12.885
 1151    HG2  GLU 589           HG2      GLU 589  66.442   5.256  14.609
 1152    HG3  GLU 589           HG1      GLU 589  67.667   6.512  14.407
 1153    H    GLN 590           HN       GLN 590  68.903   5.596  13.328
 1154    HA   GLN 590           HA       GLN 590  68.419   2.795  13.917
 1155    HB2  GLN 590           HB2      GLN 590  69.936   3.293  11.637
 1156    HB3  GLN 590           HB1      GLN 590  71.182   3.194  12.865
 1157    HG2  GLN 590           HG2      GLN 590  70.615   0.946  13.410
 1158    HG3  GLN 590           HG1      GLN 590  69.067   1.068  12.637
 1159   HE21  GLN 590          HE21      GLN 590  70.030  -1.009  11.548
 1160   HE22  GLN 590          HE22      GLN 590  70.911  -0.755  10.120
 1161    H    ASN 591           HN       ASN 591  69.449   2.329  15.900
 1162    HA   ASN 591           HA       ASN 591  70.403   2.915  17.956
 1163    HB2  ASN 591           HB2      ASN 591  72.643   4.497  17.068
 1164    HB3  ASN 591           HB1      ASN 591  72.648   2.817  17.566
 1165   HD21  ASN 591          HD21      ASN 591  71.171   1.654  15.516
 1166   HD22  ASN 591          HD22      ASN 591  71.930   1.864  14.011
 1167    H    ASP 592           HN       ASP 592  68.458   4.820  16.670
 1168    HA   ASP 592           HA       ASP 592  67.428   6.781  17.473
 1169    HB2  ASP 592           HB2      ASP 592  69.890   7.530  19.028
 1170    HB3  ASP 592           HB1      ASP 592  68.198   7.867  19.391
 1171    H    LYS 593           HN       LYS 593  70.319   6.617  15.770
 1172    HA   LYS 593           HA       LYS 593  70.701   9.490  15.412
 1173    HB2  LYS 593           HB2      LYS 593  71.903   7.045  14.138
 1174    HB3  LYS 593           HB1      LYS 593  72.427   8.689  13.808
 1175    HG2  LYS 593           HG2      LYS 593  72.458   8.545  16.613
 1176    HG3  LYS 593           HG1      LYS 593  73.041   6.960  16.115
 1177    HD2  LYS 593           HD2      LYS 593  74.617   8.223  14.520
 1178    HD3  LYS 593           HD1      LYS 593  74.195   9.665  15.439
 1179    HE2  LYS 593           HE2      LYS 593  74.822   8.195  17.528
 1180    HE3  LYS 593           HE1      LYS 593  75.692   7.214  16.344
 1181    HZ1  LYS 593           HZ1      LYS 593  76.323   9.820  15.744
 1182    HZ2  LYS 593           HZ2      LYS 593  77.325   8.680  16.508
 1183    HZ3  LYS 593           HZ3      LYS 593  76.383   9.746  17.437
 1184    HA   PRO 594           HA       PRO 594  67.481   9.382  12.113
 1185    HB2  PRO 594           HB2      PRO 594  68.703  12.005  11.429
 1186    HB3  PRO 594           HB1      PRO 594  67.016  11.608  11.748
 1187    HG2  PRO 594           HG2      PRO 594  68.587  12.986  13.503
 1188    HG3  PRO 594           HG1      PRO 594  67.246  11.953  14.022
 1189    HD2  PRO 594           HD2      PRO 594  70.177  11.470  14.254
 1190    HD3  PRO 594           HD1      PRO 594  68.839  10.782  15.202
 1191    H    TYR 595           HN       TYR 595  67.579   9.343   9.729
 1192    HA   TYR 595           HA       TYR 595  70.132   9.624   8.334
 1193    HB2  TYR 595           HB2      TYR 595  69.000   6.844   8.772
 1194    HB3  TYR 595           HB1      TYR 595  70.294   7.227   7.651
 1195    HD1  TYR 595           HD1      TYR 595  72.241   8.756   8.920
 1196    HD2  TYR 595           HD2      TYR 595  69.699   5.805  10.726
 1197    HE1  TYR 595           HE1      TYR 595  73.918   8.376  10.709
 1198    HE2  TYR 595           HE2      TYR 595  71.377   5.454  12.504
 1199    HH   TYR 595           HH       TYR 595  73.462   5.887  13.175
 1200    H    CYS 596           HN       CYS 596  69.653   9.905   6.110
 1201    HA   CYS 596           HA       CYS 596  66.885   9.721   5.213
 1202    HB2  CYS 596           HB2      CYS 596  69.256   9.582   3.331
 1203    HB3  CYS 596           HB1      CYS 596  67.670  10.284   3.045
 1204    H    GLN 597           HN       GLN 597  66.089   7.992   3.726
 1205    HA   GLN 597           HA       GLN 597  66.981   5.414   4.571
 1206    HB2  GLN 597           HB2      GLN 597  64.807   5.350   3.703
 1207    HB3  GLN 597           HB1      GLN 597  65.189   6.450   2.410
 1208    HG2  GLN 597           HG2      GLN 597  64.963   4.458   1.228
 1209    HG3  GLN 597           HG1      GLN 597  66.681   4.435   1.560
 1210   HE21  GLN 597          HE21      GLN 597  66.315   3.839   4.435
 1211   HE22  GLN 597          HE22      GLN 597  65.830   2.235   4.523
 1212    H    ASN 598           HN       ASN 598  67.417   7.116   1.476
 1213    HA   ASN 598           HA       ASN 598  69.239   5.439   0.228
 1214    HB2  ASN 598           HB2      ASN 598  69.791   8.391   0.169
 1215    HB3  ASN 598           HB1      ASN 598  69.731   7.240  -1.160
 1216   HD21  ASN 598          HD21      ASN 598  67.338   6.126  -1.132
 1217   HD22  ASN 598          HD22      ASN 598  66.084   7.263  -1.160
 1218    H    CYS 599           HN       CYS 599  69.767   7.534   2.982
 1219    HA   CYS 599           HA       CYS 599  72.676   7.225   2.901
 1220    HB2  CYS 599           HB2      CYS 599  70.714   8.491   4.810
 1221    HB3  CYS 599           HB1      CYS 599  72.385   8.228   5.299
 1222    H    PHE 600           HN       PHE 600  70.164   6.281   5.269
 1223    HA   PHE 600           HA       PHE 600  71.752   4.482   6.750
 1224    HB2  PHE 600           HB2      PHE 600  69.795   4.873   7.882
 1225    HB3  PHE 600           HB1      PHE 600  68.863   5.056   6.406
 1226    HD1  PHE 600           HD1      PHE 600  67.980   3.060   5.226
 1227    HD2  PHE 600           HD2      PHE 600  69.964   2.744   9.017
 1228    HE1  PHE 600           HE1      PHE 600  67.047   0.782   5.519
 1229    HE2  PHE 600           HE2      PHE 600  69.029   0.464   9.311
 1230    HZ   PHE 600           HZ       PHE 600  67.573  -0.517   7.564
 1231    H    LEU 601           HN       LEU 601  69.484   3.715   4.079
 1232    HA   LEU 601           HA       LEU 601  69.923   0.960   4.024
 1233    HB2  LEU 601           HB2      LEU 601  68.557   1.082   2.210
 1234    HB3  LEU 601           HB1      LEU 601  68.568   2.819   2.454
 1235    HG   LEU 601           HG       LEU 601  70.582   2.935   0.923
 1236   HD11  LEU 601          HD11      LEU 601  71.630   0.997   0.395
 1237   HD12  LEU 601          HD12      LEU 601  70.234   0.546  -0.575
 1238   HD13  LEU 601          HD13      LEU 601  70.342   0.031   1.107
 1239   HD21  LEU 601          HD21      LEU 601  68.114   1.682  -0.311
 1240   HD22  LEU 601          HD22      LEU 601  69.244   2.784  -1.095
 1241   HD23  LEU 601          HD23      LEU 601  68.212   3.362   0.209
 1242    H    LYS 602           HN       LYS 602  71.871   3.505   2.489
 1243    HA   LYS 602           HA       LYS 602  73.690   1.834   1.141
 1244    HB2  LYS 602           HB2      LYS 602  73.471   4.568   1.598
 1245    HB3  LYS 602           HB1      LYS 602  74.955   4.194   2.437
 1246    HG2  LYS 602           HG2      LYS 602  74.574   3.159  -0.362
 1247    HG3  LYS 602           HG1      LYS 602  74.967   4.851  -0.139
 1248    HD2  LYS 602           HD2      LYS 602  77.044   4.386   0.780
 1249    HD3  LYS 602           HD1      LYS 602  76.570   2.766   1.302
 1250    HE2  LYS 602           HE2      LYS 602  76.819   1.886  -0.867
 1251    HE3  LYS 602           HE1      LYS 602  76.704   3.478  -1.613
 1252    HZ1  LYS 602           HZ1      LYS 602  78.978   2.228  -0.252
 1253    HZ2  LYS 602           HZ2      LYS 602  78.830   3.920  -0.212
 1254    HZ3  LYS 602           HZ3      LYS 602  78.943   3.109  -1.701
 1255    H    LEU 603           HN       LEU 603  73.292   2.339   4.541
 1256    HA   LEU 603           HA       LEU 603  75.979   1.258   5.162
 1257    HB2  LEU 603           HB2      LEU 603  73.958   1.857   7.286
 1258    HB3  LEU 603           HB1      LEU 603  75.705   2.099   7.301
 1259    HG   LEU 603           HG       LEU 603  73.689   3.720   5.729
 1260   HD11  LEU 603          HD11      LEU 603  75.519   4.727   7.880
 1261   HD12  LEU 603          HD12      LEU 603  73.945   4.036   8.278
 1262   HD13  LEU 603          HD13      LEU 603  74.048   5.461   7.248
 1263   HD21  LEU 603          HD21      LEU 603  75.582   5.131   5.081
 1264   HD22  LEU 603          HD22      LEU 603  75.876   3.492   4.532
 1265   HD23  LEU 603          HD23      LEU 603  76.691   4.094   5.971
 1266    H    PHE 604           HN       PHE 604  72.610   0.416   6.107
 1267    HA   PHE 604           HA       PHE 604  73.571  -2.319   6.776
 1268    HB2  PHE 604           HB2      PHE 604  71.096  -0.715   7.379
 1269    HB3  PHE 604           HB1      PHE 604  71.012  -2.474   7.466
 1270    HD1  PHE 604           HD1      PHE 604  72.776   0.526   8.801
 1271    HD2  PHE 604           HD2      PHE 604  72.028  -3.682   9.255
 1272    HE1  PHE 604           HE1      PHE 604  73.849   0.574  11.034
 1273    HE2  PHE 604           HE2      PHE 604  73.104  -3.631  11.488
 1274    HZ   PHE 604           HZ       PHE 604  74.014  -1.504  12.378
 1275    H    CYS 605           HN       CYS 605  72.692  -0.884   3.988
 1276    HA   CYS 605           HA       CYS 605  71.910  -3.438   2.792
 1277    HB2  CYS 605           HB2      CYS 605  69.948  -1.169   3.084
 1278    HB3  CYS 605           HB1      CYS 605  69.837  -2.269   1.711
 1279    HG   CYS 605           HG       CYS 605  69.469  -3.118   4.692
  Start of MODEL    8
    1    H    MET   1           HT1      MET   1  88.093 -21.468   8.232
    2    HA   MET   1           HA       MET   1  86.829 -24.031   8.293
    3    HB2  MET   1           HB2      MET   1  88.752 -23.138   6.841
    4    HB3  MET   1           HB1      MET   1  89.776 -23.351   8.260
    5    HG2  MET   1           HG2      MET   1  88.981 -25.747   8.365
    6    HG3  MET   1           HG1      MET   1  88.182 -25.486   6.816
    7    HE1  MET   1           HE1      MET   1  89.199 -26.649   4.995
    8    HE2  MET   1           HE2      MET   1  89.689 -27.706   6.315
    9    HE3  MET   1           HE3      MET   1  90.840 -27.306   5.043
   10    H    ALA   2           HN       ALA   2  89.829 -24.473   9.633
   11    HA   ALA   2           HA       ALA   2  89.113 -24.126  12.444
   12    HB1  ALA   2           HB1      ALA   2  89.119 -26.862  11.157
   13    HB2  ALA   2           HB2      ALA   2  87.838 -26.123  12.118
   14    HB3  ALA   2           HB3      ALA   2  89.340 -26.630  12.891
   15    H    LEU   3           HN       LEU   3  91.188 -25.914  10.185
   16    HA   LEU   3           HA       LEU   3  93.447 -26.620  10.510
   17    HB2  LEU   3           HB2      LEU   3  93.232 -23.631  10.337
   18    HB3  LEU   3           HB1      LEU   3  94.780 -24.461  10.210
   19    HG   LEU   3           HG       LEU   3  92.464 -25.339   8.483
   20   HD11  LEU   3          HD11      LEU   3  94.283 -22.972   8.037
   21   HD12  LEU   3          HD12      LEU   3  92.519 -23.009   8.017
   22   HD13  LEU   3          HD13      LEU   3  93.431 -23.782   6.720
   23   HD21  LEU   3          HD21      LEU   3  95.488 -25.393   8.231
   24   HD22  LEU   3          HD22      LEU   3  94.395 -25.854   6.929
   25   HD23  LEU   3          HD23      LEU   3  94.409 -26.772   8.431
   26    H    ASP   4           HN       ASP   4  93.802 -23.565  12.137
   27    HA   ASP   4           HA       ASP   4  94.849 -23.044  14.152
   28    HB2  ASP   4           HB2      ASP   4  92.737 -23.725  15.094
   29    HB3  ASP   4           HB1      ASP   4  93.147 -25.426  14.893
   30    H    GLY   5           HN       GLY   5  95.924 -25.166  12.246
   31    HA2  GLY   5           HA2      GLY   5  97.436 -27.072  13.811
   32    HA3  GLY   5           HA1      GLY   5  97.735 -26.625  12.129
   33    H    ILE   6           HN       ILE   6  97.584 -23.807  13.411
   34    HA   ILE   6           HA       ILE   6 100.499 -23.637  14.056
   35    HB   ILE   6           HB       ILE   6  99.792 -21.093  13.316
   36   HG12  ILE   6          HG12      ILE   6  97.448 -22.163  12.789
   37   HG13  ILE   6          HG11      ILE   6  98.147 -21.021  11.659
   38   HG21  ILE   6          HG21      ILE   6 100.765 -23.402  11.664
   39   HG22  ILE   6          HG22      ILE   6 101.694 -22.070  12.353
   40   HG23  ILE   6          HG23      ILE   6 100.615 -21.778  10.990
   41   HD11  ILE   6          HD11      ILE   6  97.177 -23.366  10.840
   42   HD12  ILE   6          HD12      ILE   6  98.794 -23.921  11.269
   43   HD13  ILE   6          HD13      ILE   6  98.590 -22.644  10.073
   44    H    ARG   7           HN       ARG   7  98.781 -20.731  14.642
   45    HA   ARG   7           HA       ARG   7  97.924 -21.429  17.321
   46    HB2  ARG   7           HB2      ARG   7  99.525 -19.722  18.354
   47    HB3  ARG   7           HB1      ARG   7 100.170 -21.284  17.911
   48    HG2  ARG   7           HG2      ARG   7 100.334 -19.252  15.761
   49    HG3  ARG   7           HG1      ARG   7 101.309 -18.896  17.186
   50    HD2  ARG   7           HD2      ARG   7 102.278 -21.215  17.008
   51    HD3  ARG   7           HD1      ARG   7 101.428 -21.377  15.478
   52    HE   ARG   7           HE       ARG   7 103.870 -19.902  15.894
   53   HH11  ARG   7          HH11      ARG   7 104.667 -18.738  14.133
   54   HH12  ARG   7          HH12      ARG   7 103.617 -18.373  12.805
   55   HH21  ARG   7          HH21      ARG   7 100.866 -19.953  14.200
   56   HH22  ARG   7          HH22      ARG   7 101.465 -19.058  12.845
   57    H    MET   8           HN       MET   8  99.202 -18.205  16.646
   58    HA   MET   8           HA       MET   8  96.402 -17.298  16.097
   59    HB2  MET   8           HB2      MET   8  97.811 -15.336  17.745
   60    HB3  MET   8           HB1      MET   8  96.239 -16.073  17.982
   61    HG2  MET   8           HG2      MET   8  97.428 -18.146  18.819
   62    HG3  MET   8           HG1      MET   8  98.916 -17.212  18.825
   63    HE1  MET   8           HE1      MET   8  98.986 -14.755  19.922
   64    HE2  MET   8           HE2      MET   8  99.740 -16.092  20.787
   65    HE3  MET   8           HE3      MET   8  98.796 -14.899  21.675
   66    HA   PRO   9           HA       PRO   9  99.357 -13.772  14.402
   67    HB2  PRO   9           HB2      PRO   9 101.702 -15.617  13.972
   68    HB3  PRO   9           HB1      PRO   9 101.694 -13.858  14.239
   69    HG2  PRO   9           HG2      PRO   9 102.330 -15.430  16.223
   70    HG3  PRO   9           HG1      PRO   9 101.192 -14.096  16.498
   71    HD2  PRO   9           HD2      PRO   9 100.592 -17.011  16.181
   72    HD3  PRO   9           HD1      PRO   9  99.904 -15.851  17.314
   73    H    ASP  10           HN       ASP  10  99.087 -17.102  13.737
   74    HA   ASP  10           HA       ASP  10  98.340 -16.559  10.912
   75    HB2  ASP  10           HB2      ASP  10 100.787 -17.415  11.302
   76    HB3  ASP  10           HB1      ASP  10 100.015 -18.966  11.597
   77    H    GLY  11           HN       GLY  11  97.927 -18.320  13.862
   78    HA2  GLY  11           HA2      GLY  11  96.118 -20.293  12.589
   79    HA3  GLY  11           HA1      GLY  11  96.646 -20.299  14.265
   80    H    CYS  12           HN       CYS  12  95.856 -17.217  14.145
   81    HA   CYS  12           HA       CYS  12  92.985 -17.244  13.856
   82    HB2  CYS  12           HB2      CYS  12  92.865 -18.650  15.744
   83    HB3  CYS  12           HB1      CYS  12  94.175 -17.801  16.560
   84    HG   CYS  12           HG       CYS  12  91.615 -16.133  16.080
   85    H    TYR  13           HN       TYR  13  95.789 -15.766  15.427
   86    HA   TYR  13           HA       TYR  13  96.426 -13.496  15.388
   87    HB2  TYR  13           HB2      TYR  13  94.542 -13.344  13.476
   88    HB3  TYR  13           HB1      TYR  13  93.636 -12.539  14.757
   89    HD1  TYR  13           HD1      TYR  13  94.448 -10.421  15.732
   90    HD2  TYR  13           HD2      TYR  13  96.532 -12.350  12.510
   91    HE1  TYR  13           HE1      TYR  13  95.730  -8.340  15.314
   92    HE2  TYR  13           HE2      TYR  13  97.813 -10.270  12.091
   93    HH   TYR  13           HH       TYR  13  98.502  -8.234  13.448
   94    H    ALA  14           HN       ALA  14  93.223 -14.368  16.576
   95    HA   ALA  14           HA       ALA  14  93.597 -14.228  19.276
   96    HB1  ALA  14           HB1      ALA  14  94.346 -12.037  19.507
   97    HB2  ALA  14           HB2      ALA  14  92.610 -11.743  19.602
   98    HB3  ALA  14           HB3      ALA  14  93.468 -11.488  18.081
   99    H    ASP  15           HN       ASP  15  91.504 -12.746  16.840
  100    HA   ASP  15           HA       ASP  15  89.299 -14.501  17.684
  101    HB2  ASP  15           HB2      ASP  15  89.254 -12.382  19.109
  102    HB3  ASP  15           HB1      ASP  15  88.892 -11.509  17.621
  103    H    GLY  16           HN       GLY  16  91.101 -13.252  15.322
  104    HA2  GLY  16           HA2      GLY  16  90.786 -13.419  12.975
  105    HA3  GLY  16           HA1      GLY  16  89.068 -13.716  13.256
  106    H    THR  17           HN       THR  17  90.307 -11.114  15.032
  107    HA   THR  17           HA       THR  17  88.763  -9.212  13.383
  108    HB   THR  17           HB       THR  17  89.288  -7.662  15.292
  109    HG1  THR  17           HG1      THR  17  90.246  -9.962  16.601
  110   HG21  THR  17          HG21      THR  17  87.994 -10.333  15.811
  111   HG22  THR  17          HG22      THR  17  87.212  -8.808  15.386
  112   HG23  THR  17          HG23      THR  17  87.942  -9.011  16.978
  113    H    TRP  18           HN       TRP  18  89.749  -8.016  11.914
  114    HA   TRP  18           HA       TRP  18  92.603  -7.211  12.291
  115    HB2  TRP  18           HB2      TRP  18  92.344  -7.283   9.556
  116    HB3  TRP  18           HB1      TRP  18  93.043  -8.585  10.507
  117    HD1  TRP  18           HD1      TRP  18  89.581  -7.514   9.157
  118    HE1  TRP  18           HE1      TRP  18  88.238  -9.653   8.639
  119    HE3  TRP  18           HE3      TRP  18  92.884 -11.051  10.787
  120    HZ2  TRP  18           HZ2      TRP  18  88.525 -12.487   8.882
  121    HZ3  TRP  18           HZ3      TRP  18  92.325 -13.460  10.634
  122    HH2  TRP  18           HH2      TRP  18  90.151 -14.183   9.684
  123    H    GLU  19           HN       GLU  19  92.694  -5.041  12.376
  124    HA   GLU  19           HA       GLU  19  90.375  -3.451  11.623
  125    HB2  GLU  19           HB2      GLU  19  92.449  -1.618  12.079
  126    HB3  GLU  19           HB1      GLU  19  91.286  -2.170  13.278
  127    HG2  GLU  19           HG2      GLU  19  93.625  -2.438  14.039
  128    HG3  GLU  19           HG1      GLU  19  92.767  -3.975  13.938
  129    H    LEU  20           HN       LEU  20  90.014  -2.491   9.696
  130    HA   LEU  20           HA       LEU  20  92.032  -2.860   7.598
  131    HB2  LEU  20           HB2      LEU  20  89.187  -2.625   7.668
  132    HB3  LEU  20           HB1      LEU  20  89.752  -1.229   6.760
  133    HG   LEU  20           HG       LEU  20  89.396  -2.978   5.176
  134   HD11  LEU  20          HD11      LEU  20  91.361  -2.825   4.044
  135   HD12  LEU  20          HD12      LEU  20  92.326  -3.406   5.396
  136   HD13  LEU  20          HD13      LEU  20  91.803  -1.721   5.347
  137   HD21  LEU  20          HD21      LEU  20  89.264  -5.019   6.241
  138   HD22  LEU  20          HD22      LEU  20  90.631  -4.689   7.301
  139   HD23  LEU  20          HD23      LEU  20  90.908  -5.168   5.632
  140    H    SER  21           HN       SER  21  93.384  -1.274   6.900
  141    HA   SER  21           HA       SER  21  93.508   1.182   8.458
  142    HB2  SER  21           HB2      SER  21  95.435  -0.258   7.340
  143    HB3  SER  21           HB1      SER  21  95.114   0.792   5.961
  144    HG   SER  21           HG       SER  21  96.548   1.335   8.085
  145    H    VAL  22           HN       VAL  22  93.139   3.267   7.743
  146    HA   VAL  22           HA       VAL  22  92.008   3.600   5.013
  147    HB   VAL  22           HB       VAL  22  90.682   4.455   7.586
  148   HG11  VAL  22          HG11      VAL  22  90.612   6.455   6.281
  149   HG12  VAL  22          HG12      VAL  22  89.072   5.661   5.964
  150   HG13  VAL  22          HG13      VAL  22  90.376   5.558   4.781
  151   HG21  VAL  22          HG21      VAL  22  90.070   2.261   6.669
  152   HG22  VAL  22          HG22      VAL  22  89.758   3.001   5.091
  153   HG23  VAL  22          HG23      VAL  22  88.730   3.397   6.469
  154    H    HIS  23           HN       HIS  23  93.578   4.817   4.148
  155    HA   HIS  23           HA       HIS  23  94.940   6.918   5.661
  156    HB2  HIS  23           HB2      HIS  23  95.027   5.796   2.881
  157    HB3  HIS  23           HB1      HIS  23  95.695   7.412   3.132
  158    HD1  HIS  23           HD1      HIS  23  96.008   3.939   4.707
  159    HD2  HIS  23           HD2      HIS  23  98.304   7.355   4.040
  160    HE1  HIS  23           HE1      HIS  23  98.339   3.411   5.546
  161    H    VAL  24           HN       VAL  24  93.587   8.597   6.212
  162    HA   VAL  24           HA       VAL  24  91.392   9.405   4.546
  163    HB   VAL  24           HB       VAL  24  92.648  11.192   6.621
  164   HG11  VAL  24          HG11      VAL  24  90.599  11.806   5.203
  165   HG12  VAL  24          HG12      VAL  24  90.410  11.934   6.950
  166   HG13  VAL  24          HG13      VAL  24  89.740  10.550   6.092
  167   HG21  VAL  24          HG21      VAL  24  91.062   8.644   7.043
  168   HG22  VAL  24          HG22      VAL  24  91.219   9.893   8.280
  169   HG23  VAL  24          HG23      VAL  24  92.650   9.042   7.700
  170    H    THR  25           HN       THR  25  91.750  10.242   2.583
  171    HA   THR  25           HA       THR  25  94.124  11.806   1.978
  172    HB   THR  25           HB       THR  25  93.391  11.728  -0.250
  173    HG1  THR  25           HG1      THR  25  91.469  12.662  -0.285
  174   HG21  THR  25          HG21      THR  25  91.811   9.398   0.836
  175   HG22  THR  25          HG22      THR  25  93.573   9.419   0.896
  176   HG23  THR  25          HG23      THR  25  92.742   9.483  -0.659
  177    H    ASP  26           HN       ASP  26  93.892  14.075   1.097
  178    HA   ASP  26           HA       ASP  26  93.084  16.278   1.268
  179    HB2  ASP  26           HB2      ASP  26  90.776  14.931   0.957
  180    HB3  ASP  26           HB1      ASP  26  90.550  15.398   2.640
  181    H    LEU  27           HN       LEU  27  92.370  14.109   3.988
  182    HA   LEU  27           HA       LEU  27  93.061  16.230   5.941
  183    HB2  LEU  27           HB2      LEU  27  91.623  13.655   5.982
  184    HB3  LEU  27           HB1      LEU  27  92.626  13.902   7.398
  185    HG   LEU  27           HG       LEU  27  90.733  16.053   6.431
  186   HD11  LEU  27          HD11      LEU  27  90.119  13.767   8.326
  187   HD12  LEU  27          HD12      LEU  27  89.384  14.025   6.742
  188   HD13  LEU  27          HD13      LEU  27  89.082  15.163   8.053
  189   HD21  LEU  27          HD21      LEU  27  92.573  16.437   8.193
  190   HD22  LEU  27          HD22      LEU  27  91.629  15.382   9.242
  191   HD23  LEU  27          HD23      LEU  27  90.932  16.890   8.653
  192    H    ASN  28           HN       ASN  28  94.153  13.159   4.634
  193    HA   ASN  28           HA       ASN  28  96.325  12.296   4.471
  194    HB2  ASN  28           HB2      ASN  28  96.993  14.803   4.606
  195    HB3  ASN  28           HB1      ASN  28  97.391  14.459   6.283
  196   HD21  ASN  28          HD21      ASN  28  98.019  11.593   5.373
  197   HD22  ASN  28          HD22      ASN  28  99.588  11.705   4.744
  198    H    ARG  29           HN       ARG  29  94.356  12.009   6.881
  199    HA   ARG  29           HA       ARG  29  96.278  11.178   8.963
  200    HB2  ARG  29           HB2      ARG  29  93.258  11.114   8.877
  201    HB3  ARG  29           HB1      ARG  29  94.242  10.653  10.266
  202    HG2  ARG  29           HG2      ARG  29  95.186  12.903  10.378
  203    HG3  ARG  29           HG1      ARG  29  94.269  13.376   8.954
  204    HD2  ARG  29           HD2      ARG  29  92.926  14.145  10.729
  205    HD3  ARG  29           HD1      ARG  29  92.189  12.599  10.295
  206    HE   ARG  29           HE       ARG  29  94.097  12.021  12.276
  207   HH11  ARG  29          HH11      ARG  29  93.489  11.866  14.447
  208   HH12  ARG  29          HH12      ARG  29  92.047  12.660  14.987
  209   HH21  ARG  29          HH21      ARG  29  91.268  13.944  11.860
  210   HH22  ARG  29          HH22      ARG  29  90.789  13.837  13.521
  211    H    ASP  30           HN       ASP  30  95.411   9.036  10.025
  212    HA   ASP  30           HA       ASP  30  94.780   7.000   7.959
  213    HB2  ASP  30           HB2      ASP  30  97.069   6.840   9.939
  214    HB3  ASP  30           HB1      ASP  30  96.475   5.489   8.971
  215    H    VAL  31           HN       VAL  31  92.960   6.134   8.675
  216    HA   VAL  31           HA       VAL  31  92.587   5.778  11.631
  217    HB   VAL  31           HB       VAL  31  90.439   5.753   9.500
  218   HG11  VAL  31          HG11      VAL  31  89.001   6.171  11.482
  219   HG12  VAL  31          HG12      VAL  31  90.429   6.082  12.513
  220   HG13  VAL  31          HG13      VAL  31  89.897   4.656  11.623
  221   HG21  VAL  31          HG21      VAL  31  91.638   7.961   9.555
  222   HG22  VAL  31          HG22      VAL  31  91.316   8.063  11.284
  223   HG23  VAL  31          HG23      VAL  31  89.979   8.088  10.137
  224    H    THR  32           HN       THR  32  91.730   3.816  12.352
  225    HA   THR  32           HA       THR  32  91.738   1.545  10.417
  226    HB   THR  32           HB       THR  32  92.723   0.583  12.931
  227    HG1  THR  32           HG1      THR  32  93.791   3.040  12.108
  228   HG21  THR  32          HG21      THR  32  94.490   1.149  10.557
  229   HG22  THR  32          HG22      THR  32  93.272  -0.127  10.494
  230   HG23  THR  32          HG23      THR  32  94.564  -0.202  11.689
  231    H    LEU  33           HN       LEU  33  89.963   0.299  10.677
  232    HA   LEU  33           HA       LEU  33  88.260   0.706  13.106
  233    HB2  LEU  33           HB2      LEU  33  87.689   0.283  10.189
  234    HB3  LEU  33           HB1      LEU  33  86.501  -0.232  11.367
  235    HG   LEU  33           HG       LEU  33  86.231   2.130  10.399
  236   HD11  LEU  33          HD11      LEU  33  85.227   1.221  12.582
  237   HD12  LEU  33          HD12      LEU  33  85.307   2.969  12.392
  238   HD13  LEU  33          HD13      LEU  33  86.483   2.140  13.402
  239   HD21  LEU  33          HD21      LEU  33  88.739   2.616  10.696
  240   HD22  LEU  33          HD22      LEU  33  88.363   2.869  12.401
  241   HD23  LEU  33          HD23      LEU  33  87.615   3.879  11.181
  242    H    ARG  34           HN       ARG  34  88.495  -1.014  14.420
  243    HA   ARG  34           HA       ARG  34  89.475  -3.574  13.704
  244    HB2  ARG  34           HB2      ARG  34  89.325  -2.641  16.051
  245    HB3  ARG  34           HB1      ARG  34  87.592  -2.947  15.988
  246    HG2  ARG  34           HG2      ARG  34  88.602  -4.851  17.066
  247    HG3  ARG  34           HG1      ARG  34  88.109  -5.356  15.452
  248    HD2  ARG  34           HD2      ARG  34  90.277  -5.532  14.688
  249    HD3  ARG  34           HD1      ARG  34  90.898  -4.305  15.791
  250    HE   ARG  34           HE       ARG  34  90.792  -7.134  16.325
  251   HH11  ARG  34          HH11      ARG  34  91.327  -7.809  18.414
  252   HH12  ARG  34          HH12      ARG  34  91.323  -6.660  19.710
  253   HH21  ARG  34          HH21      ARG  34  90.373  -3.999  17.701
  254   HH22  ARG  34          HH22      ARG  34  90.782  -4.504  19.306
  255    H    VAL  35           HN       VAL  35  88.471  -4.666  12.104
  256    HA   VAL  35           HA       VAL  35  85.552  -5.250  12.423
  257    HB   VAL  35           HB       VAL  35  85.393  -5.138   9.933
  258   HG11  VAL  35          HG11      VAL  35  86.217  -2.649  11.447
  259   HG12  VAL  35          HG12      VAL  35  84.577  -3.257  11.205
  260   HG13  VAL  35          HG13      VAL  35  85.487  -2.610   9.840
  261   HG21  VAL  35          HG21      VAL  35  88.188  -4.021  10.235
  262   HG22  VAL  35          HG22      VAL  35  87.203  -3.778   8.796
  263   HG23  VAL  35          HG23      VAL  35  87.681  -5.407   9.272
  264    H    THR  36           HN       THR  36  85.171  -6.931  10.392
  265    HA   THR  36           HA       THR  36  87.310  -8.991  10.441
  266    HB   THR  36           HB       THR  36  85.431 -10.701  10.832
  267    HG1  THR  36           HG1      THR  36  83.981  -9.082  12.355
  268   HG21  THR  36          HG21      THR  36  85.411 -10.170  13.359
  269   HG22  THR  36          HG22      THR  36  86.464  -8.823  12.940
  270   HG23  THR  36          HG23      THR  36  86.963 -10.474  12.588
  271    H    GLY  37           HN       GLY  37  86.500 -10.821   8.852
  272    HA2  GLY  37           HA2      GLY  37  85.820  -9.484   6.357
  273    HA3  GLY  37           HA1      GLY  37  86.177 -11.200   6.550
  274    H    GLU  38           HN       GLU  38  83.758  -9.117   8.082
  275    HA   GLU  38           HA       GLU  38  81.587 -10.588   6.720
  276    HB2  GLU  38           HB2      GLU  38  80.541 -11.336   8.700
  277    HB3  GLU  38           HB1      GLU  38  82.234 -11.758   8.908
  278    HG2  GLU  38           HG2      GLU  38  81.903 -10.727  10.956
  279    HG3  GLU  38           HG1      GLU  38  82.300  -9.295  10.008
  280    H    VAL  39           HN       VAL  39  82.927  -7.728   7.845
  281    HA   VAL  39           HA       VAL  39  80.383  -6.415   8.447
  282    HB   VAL  39           HB       VAL  39  81.606  -4.582   9.165
  283   HG11  VAL  39          HG11      VAL  39  83.243  -5.463  10.598
  284   HG12  VAL  39          HG12      VAL  39  83.716  -6.704   9.433
  285   HG13  VAL  39          HG13      VAL  39  82.175  -6.827  10.280
  286   HG21  VAL  39          HG21      VAL  39  83.798  -5.471   7.257
  287   HG22  VAL  39          HG22      VAL  39  83.996  -4.171   8.429
  288   HG23  VAL  39          HG23      VAL  39  82.818  -4.007   7.138
  289    H    HIS  40           HN       HIS  40  79.152  -5.381   6.969
  290    HA   HIS  40           HA       HIS  40  79.832  -5.479   4.181
  291    HB2  HIS  40           HB2      HIS  40  77.884  -3.415   5.172
  292    HB3  HIS  40           HB1      HIS  40  77.757  -4.510   3.794
  293    HD1  HIS  40           HD1      HIS  40  77.483  -7.157   4.525
  294    HD2  HIS  40           HD2      HIS  40  76.475  -4.289   7.378
  295    HE1  HIS  40           HE1      HIS  40  76.044  -8.333   6.246
  296    H    ILE  41           HN       ILE  41  80.540  -3.731   2.812
  297    HA   ILE  41           HA       ILE  41  82.616  -2.102   3.765
  298    HB   ILE  41           HB       ILE  41  80.721  -1.322   1.534
  299   HG12  ILE  41          HG12      ILE  41  83.071  -3.241   1.511
  300   HG13  ILE  41          HG11      ILE  41  81.378  -3.645   1.238
  301   HG21  ILE  41          HG21      ILE  41  82.511   0.304   2.314
  302   HG22  ILE  41          HG22      ILE  41  82.602  -0.164   0.612
  303   HG23  ILE  41          HG23      ILE  41  83.703  -0.885   1.787
  304   HD11  ILE  41          HD11      ILE  41  83.336  -2.586  -0.634
  305   HD12  ILE  41          HD12      ILE  41  81.879  -1.589  -0.597
  306   HD13  ILE  41          HD13      ILE  41  81.766  -3.310  -0.949
  307    H    GLY  42           HN       GLY  42  79.259  -1.107   3.121
  308    HA2  GLY  42           HA2      GLY  42  79.466   1.481   4.202
  309    HA3  GLY  42           HA1      GLY  42  77.965   0.568   4.136
  310    H    GLY  43           HN       GLY  43  79.746  -1.511   5.669
  311    HA2  GLY  43           HA2      GLY  43  78.692  -0.922   8.289
  312    HA3  GLY  43           HA1      GLY  43  79.908  -2.154   7.922
  313    H    VAL  44           HN       VAL  44  81.578  -0.164   6.547
  314    HA   VAL  44           HA       VAL  44  83.037   0.833   8.899
  315    HB   VAL  44           HB       VAL  44  83.562   0.487   5.959
  316   HG11  VAL  44          HG11      VAL  44  84.994   2.482   7.734
  317   HG12  VAL  44          HG12      VAL  44  84.253   2.787   6.162
  318   HG13  VAL  44          HG13      VAL  44  85.720   1.815   6.273
  319   HG21  VAL  44          HG21      VAL  44  85.474  -0.688   6.717
  320   HG22  VAL  44          HG22      VAL  44  84.202  -1.117   7.861
  321   HG23  VAL  44          HG23      VAL  44  85.423   0.082   8.306
  322    H    MET  45           HN       MET  45  81.379   2.192   6.022
  323    HA   MET  45           HA       MET  45  81.835   4.928   6.397
  324    HB2  MET  45           HB2      MET  45  79.318   3.450   5.576
  325    HB3  MET  45           HB1      MET  45  79.392   5.207   5.589
  326    HG2  MET  45           HG2      MET  45  81.601   4.760   4.131
  327    HG3  MET  45           HG1      MET  45  80.754   3.275   3.746
  328    HE1  MET  45           HE1      MET  45  78.284   3.277   3.534
  329    HE2  MET  45           HE2      MET  45  78.288   3.511   1.793
  330    HE3  MET  45           HE3      MET  45  77.273   4.540   2.820
  331    H    LEU  46           HN       LEU  46  79.662   2.779   8.134
  332    HA   LEU  46           HA       LEU  46  78.353   4.787   9.730
  333    HB2  LEU  46           HB2      LEU  46  77.668   2.333   9.349
  334    HB3  LEU  46           HB1      LEU  46  78.872   1.931  10.570
  335    HG   LEU  46           HG       LEU  46  77.564   3.904  11.911
  336   HD11  LEU  46          HD11      LEU  46  75.199   3.837  11.515
  337   HD12  LEU  46          HD12      LEU  46  75.367   2.543  10.324
  338   HD13  LEU  46          HD13      LEU  46  75.970   4.163   9.965
  339   HD21  LEU  46          HD21      LEU  46  76.149   2.030  12.919
  340   HD22  LEU  46          HD22      LEU  46  77.892   1.765  12.909
  341   HD23  LEU  46          HD23      LEU  46  76.872   0.964  11.713
  342    H    LYS  47           HN       LYS  47  80.743   2.368  10.840
  343    HA   LYS  47           HA       LYS  47  81.292   3.564  13.312
  344    HB2  LYS  47           HB2      LYS  47  83.310   2.100  11.602
  345    HB3  LYS  47           HB1      LYS  47  83.305   2.239  13.364
  346    HG2  LYS  47           HG2      LYS  47  81.086   1.071  13.384
  347    HG3  LYS  47           HG1      LYS  47  81.259   0.818  11.649
  348    HD2  LYS  47           HD2      LYS  47  83.513  -0.288  12.194
  349    HD3  LYS  47           HD1      LYS  47  82.974  -0.304  13.871
  350    HE2  LYS  47           HE2      LYS  47  80.798  -1.415  12.828
  351    HE3  LYS  47           HE1      LYS  47  81.907  -1.836  11.521
  352    HZ1  LYS  47           HZ1      LYS  47  83.117  -2.335  14.025
  353    HZ2  LYS  47           HZ2      LYS  47  82.781  -3.423  12.764
  354    HZ3  LYS  47           HZ3      LYS  47  81.612  -3.114  13.957
  355    H    LEU  48           HN       LEU  48  83.220   4.028  10.302
  356    HA   LEU  48           HA       LEU  48  85.098   5.818  11.281
  357    HB2  LEU  48           HB2      LEU  48  84.005   5.170   8.671
  358    HB3  LEU  48           HB1      LEU  48  84.277   6.907   8.749
  359    HG   LEU  48           HG       LEU  48  86.384   4.907   9.592
  360   HD11  LEU  48          HD11      LEU  48  86.227   6.263   6.908
  361   HD12  LEU  48          HD12      LEU  48  85.710   4.601   7.182
  362   HD13  LEU  48          HD13      LEU  48  87.398   5.056   7.447
  363   HD21  LEU  48          HD21      LEU  48  87.870   6.861   9.047
  364   HD22  LEU  48          HD22      LEU  48  86.781   7.143  10.405
  365   HD23  LEU  48          HD23      LEU  48  86.413   7.829   8.822
  366    H    VAL  49           HN       VAL  49  81.956   6.897   9.885
  367    HA   VAL  49           HA       VAL  49  82.188   9.611  10.641
  368    HB   VAL  49           HB       VAL  49  79.672   7.922  10.597
  369   HG11  VAL  49          HG11      VAL  49  80.145  10.902  10.683
  370   HG12  VAL  49          HG12      VAL  49  79.175   9.919  11.780
  371   HG13  VAL  49          HG13      VAL  49  78.621  10.207  10.130
  372   HG21  VAL  49          HG21      VAL  49  79.775   7.994   8.323
  373   HG22  VAL  49          HG22      VAL  49  81.402   8.647   8.455
  374   HG23  VAL  49          HG23      VAL  49  80.020   9.739   8.331
  375    H    GLU  50           HN       GLU  50  80.638   6.958  12.485
  376    HA   GLU  50           HA       GLU  50  79.813   8.311  14.750
  377    HB2  GLU  50           HB2      GLU  50  81.154   5.606  14.546
  378    HB3  GLU  50           HB1      GLU  50  80.465   6.208  16.044
  379    HG2  GLU  50           HG2      GLU  50  78.919   5.894  13.444
  380    HG3  GLU  50           HG1      GLU  50  78.895   4.740  14.775
  381    H    LYS  51           HN       LYS  51  83.143   7.311  14.014
  382    HA   LYS  51           HA       LYS  51  84.242   8.125  16.531
  383    HB2  LYS  51           HB2      LYS  51  85.475   7.754  13.797
  384    HB3  LYS  51           HB1      LYS  51  86.409   8.072  15.257
  385    HG2  LYS  51           HG2      LYS  51  85.456   6.063  16.316
  386    HG3  LYS  51           HG1      LYS  51  84.519   5.734  14.858
  387    HD2  LYS  51           HD2      LYS  51  86.414   5.188  13.593
  388    HD3  LYS  51           HD1      LYS  51  87.503   6.064  14.664
  389    HE2  LYS  51           HE2      LYS  51  87.050   4.369  16.445
  390    HE3  LYS  51           HE1      LYS  51  86.070   3.469  15.288
  391    HZ1  LYS  51           HZ1      LYS  51  88.591   4.117  14.170
  392    HZ2  LYS  51           HZ2      LYS  51  87.891   2.588  14.414
  393    HZ3  LYS  51           HZ3      LYS  51  88.805   3.312  15.648
  394    H    LEU  52           HN       LEU  52  84.477   9.788  13.332
  395    HA   LEU  52           HA       LEU  52  85.641  12.135  14.417
  396    HB2  LEU  52           HB2      LEU  52  84.998  11.163  11.881
  397    HB3  LEU  52           HB1      LEU  52  83.943  12.554  12.045
  398    HG   LEU  52           HG       LEU  52  86.073  13.813  12.844
  399   HD11  LEU  52          HD11      LEU  52  88.165  12.867  11.812
  400   HD12  LEU  52          HD12      LEU  52  87.275  11.378  11.503
  401   HD13  LEU  52          HD13      LEU  52  87.545  11.915  13.159
  402   HD21  LEU  52          HD21      LEU  52  86.135  12.917   9.954
  403   HD22  LEU  52          HD22      LEU  52  86.592  14.482  10.615
  404   HD23  LEU  52          HD23      LEU  52  84.896  14.015  10.561
  405    H    ASP  53           HN       ASP  53  82.335  11.817  13.184
  406    HA   ASP  53           HA       ASP  53  80.310  12.628  13.995
  407    HB2  ASP  53           HB2      ASP  53  81.508  11.889  16.191
  408    HB3  ASP  53           HB1      ASP  53  81.674  13.608  16.478
  409    H    VAL  54           HN       VAL  54  80.551  14.205  12.336
  410    HA   VAL  54           HA       VAL  54  80.408  16.906  13.350
  411    HB   VAL  54           HB       VAL  54  82.762  16.825  13.409
  412   HG11  VAL  54          HG11      VAL  54  82.561  15.450  10.726
  413   HG12  VAL  54          HG12      VAL  54  83.136  14.761  12.248
  414   HG13  VAL  54          HG13      VAL  54  84.078  16.012  11.430
  415   HG21  VAL  54          HG21      VAL  54  82.230  17.926  10.638
  416   HG22  VAL  54          HG22      VAL  54  83.415  18.486  11.818
  417   HG23  VAL  54          HG23      VAL  54  81.696  18.765  12.094
  418    H    LYS  55           HN       LYS  55  79.578  18.365  11.791
  419    HA   LYS  55           HA       LYS  55  78.003  17.131   9.733
  420    HB2  LYS  55           HB2      LYS  55  78.649  20.040  10.257
  421    HB3  LYS  55           HB1      LYS  55  77.469  19.483   9.070
  422    HG2  LYS  55           HG2      LYS  55  76.574  18.116  11.250
  423    HG3  LYS  55           HG1      LYS  55  77.292  19.497  12.058
  424    HD2  LYS  55           HD2      LYS  55  75.957  21.007  10.587
  425    HD3  LYS  55           HD1      LYS  55  75.189  19.581   9.883
  426    HE2  LYS  55           HE2      LYS  55  73.702  20.320  11.596
  427    HE3  LYS  55           HE1      LYS  55  74.548  18.925  12.267
  428    HZ1  LYS  55           HZ1      LYS  55  76.203  20.742  13.072
  429    HZ2  LYS  55           HZ2      LYS  55  74.780  20.433  13.948
  430    HZ3  LYS  55           HZ3      LYS  55  74.865  21.771  12.904
  431    H    LYS  56           HN       LYS  56  80.841  16.595   9.398
  432    HA   LYS  56           HA       LYS  56  81.676  18.236   7.120
  433    HB2  LYS  56           HB2      LYS  56  83.378  17.372   8.619
  434    HB3  LYS  56           HB1      LYS  56  82.849  15.714   8.329
  435    HG2  LYS  56           HG2      LYS  56  83.852  15.611   6.243
  436    HG3  LYS  56           HG1      LYS  56  83.573  17.317   5.902
  437    HD2  LYS  56           HD2      LYS  56  85.983  16.824   6.194
  438    HD3  LYS  56           HD1      LYS  56  85.394  17.949   7.415
  439    HE2  LYS  56           HE2      LYS  56  85.366  15.007   8.033
  440    HE3  LYS  56           HE1      LYS  56  86.890  15.888   8.124
  441    HZ1  LYS  56           HZ1      LYS  56  85.566  17.564   9.495
  442    HZ2  LYS  56           HZ2      LYS  56  86.006  16.102  10.236
  443    HZ3  LYS  56           HZ3      LYS  56  84.420  16.327   9.673
  444    H    ASP  57           HN       ASP  57  81.994  17.358   4.962
  445    HA   ASP  57           HA       ASP  57  79.786  16.071   3.845
  446    HB2  ASP  57           HB2      ASP  57  82.585  15.721   2.756
  447    HB3  ASP  57           HB1      ASP  57  81.072  15.819   1.858
  448    H    TRP  58           HN       TRP  58  79.011  14.101   4.421
  449    HA   TRP  58           HA       TRP  58  80.936  11.838   4.758
  450    HB2  TRP  58           HB2      TRP  58  78.549  12.730   6.340
  451    HB3  TRP  58           HB1      TRP  58  78.943  11.022   6.281
  452    HD1  TRP  58           HD1      TRP  58  79.588  13.905   8.315
  453    HE1  TRP  58           HE1      TRP  58  81.723  13.624   9.725
  454    HE3  TRP  58           HE3      TRP  58  81.742   9.952   5.903
  455    HZ2  TRP  58           HZ2      TRP  58  84.036  11.955   9.817
  456    HZ3  TRP  58           HZ3      TRP  58  83.911   9.034   6.684
  457    HH2  TRP  58           HH2      TRP  58  85.061  10.035   8.634
  458    H    SER  59           HN       SER  59  77.817  12.934   3.505
  459    HA   SER  59           HA       SER  59  76.800  10.371   2.748
  460    HB2  SER  59           HB2      SER  59  75.770  12.184   0.860
  461    HB3  SER  59           HB1      SER  59  75.044  11.786   2.412
  462    HG   SER  59           HG       SER  59  76.909  13.853   1.847
  463    H    ASP  60           HN       ASP  60  78.409  12.810   0.658
  464    HA   ASP  60           HA       ASP  60  78.595  11.007  -1.579
  465    HB2  ASP  60           HB2      ASP  60  78.666  13.420  -1.905
  466    HB3  ASP  60           HB1      ASP  60  80.134  13.534  -0.932
  467    H    HIS  61           HN       HIS  61  80.224  10.945   1.329
  468    HA   HIS  61           HA       HIS  61  82.861  10.280   0.373
  469    HB2  HIS  61           HB2      HIS  61  83.300  10.683   2.563
  470    HB3  HIS  61           HB1      HIS  61  81.578  10.719   2.894
  471    HD1  HIS  61           HD1      HIS  61  84.521   8.353   2.855
  472    HD2  HIS  61           HD2      HIS  61  80.579   8.430   4.206
  473    HE1  HIS  61           HE1      HIS  61  84.223   6.311   4.322
  474    H    ALA  62           HN       ALA  62  83.884   8.259   0.429
  475    HA   ALA  62           HA       ALA  62  82.460   5.775   0.822
  476    HB1  ALA  62           HB1      ALA  62  81.401   6.119  -1.269
  477    HB2  ALA  62           HB2      ALA  62  82.791   5.111  -1.673
  478    HB3  ALA  62           HB3      ALA  62  82.843   6.849  -1.977
  479    H    LEU  63           HN       LEU  63  83.983   3.950   0.539
  480    HA   LEU  63           HA       LEU  63  86.800   4.891   0.776
  481    HB2  LEU  63           HB2      LEU  63  85.661   2.110   1.194
  482    HB3  LEU  63           HB1      LEU  63  87.276   2.653   1.618
  483    HG   LEU  63           HG       LEU  63  85.938   2.644   3.615
  484   HD11  LEU  63          HD11      LEU  63  87.501   4.638   3.046
  485   HD12  LEU  63          HD12      LEU  63  86.390   4.804   4.405
  486   HD13  LEU  63          HD13      LEU  63  86.005   5.556   2.859
  487   HD21  LEU  63          HD21      LEU  63  84.005   4.710   2.633
  488   HD22  LEU  63          HD22      LEU  63  83.783   3.436   3.824
  489   HD23  LEU  63          HD23      LEU  63  83.744   3.045   2.109
  490    H    TRP  64           HN       TRP  64  88.473   4.104  -0.531
  491    HA   TRP  64           HA       TRP  64  87.644   2.643  -3.030
  492    HB2  TRP  64           HB2      TRP  64  88.203   4.488  -4.243
  493    HB3  TRP  64           HB1      TRP  64  88.478   5.354  -2.759
  494    HD1  TRP  64           HD1      TRP  64  91.169   4.437  -1.725
  495    HE1  TRP  64           HE1      TRP  64  93.336   4.726  -3.081
  496    HE3  TRP  64           HE3      TRP  64  89.216   4.907  -6.419
  497    HZ2  TRP  64           HZ2      TRP  64  94.140   5.140  -5.795
  498    HZ3  TRP  64           HZ3      TRP  64  90.703   5.269  -8.368
  499    HH2  TRP  64           HH2      TRP  64  93.160   5.389  -8.063
  500    H    TRP  65           HN       TRP  65  89.232   1.206  -3.870
  501    HA   TRP  65           HA       TRP  65  91.364   0.461  -1.904
  502    HB2  TRP  65           HB2      TRP  65  89.500  -1.180  -2.591
  503    HB3  TRP  65           HB1      TRP  65  90.301  -1.253  -4.155
  504    HD1  TRP  65           HD1      TRP  65  93.145  -0.857  -2.073
  505    HE1  TRP  65           HE1      TRP  65  94.155  -3.101  -1.327
  506    HE3  TRP  65           HE3      TRP  65  89.236  -3.990  -3.096
  507    HZ2  TRP  65           HZ2      TRP  65  93.423  -5.848  -1.178
  508    HZ3  TRP  65           HZ3      TRP  65  89.433  -6.420  -2.644
  509    HH2  TRP  65           HH2      TRP  65  91.517  -7.349  -1.685
  510    H    GLU  66           HN       GLU  66  92.996   1.925  -2.721
  511    HA   GLU  66           HA       GLU  66  93.570   2.364  -5.436
  512    HB2  GLU  66           HB2      GLU  66  95.913   2.899  -4.669
  513    HB3  GLU  66           HB1      GLU  66  94.622   3.763  -3.851
  514    HG2  GLU  66           HG2      GLU  66  94.701   2.020  -2.037
  515    HG3  GLU  66           HG1      GLU  66  96.116   1.360  -2.843
  516    H    LYS  67           HN       LYS  67  94.265  -0.519  -3.565
  517    HA   LYS  67           HA       LYS  67  96.393  -1.479  -5.254
  518    HB2  LYS  67           HB2      LYS  67  94.305  -2.997  -3.705
  519    HB3  LYS  67           HB1      LYS  67  95.609  -3.764  -4.572
  520    HG2  LYS  67           HG2      LYS  67  95.843  -3.237  -1.994
  521    HG3  LYS  67           HG1      LYS  67  97.213  -3.110  -3.054
  522    HD2  LYS  67           HD2      LYS  67  96.951  -0.705  -3.182
  523    HD3  LYS  67           HD1      LYS  67  95.463  -0.788  -2.233
  524    HE2  LYS  67           HE2      LYS  67  97.438  -0.143  -0.859
  525    HE3  LYS  67           HE1      LYS  67  96.693  -1.646  -0.315
  526    HZ1  LYS  67           HZ1      LYS  67  98.355  -2.874  -1.584
  527    HZ2  LYS  67           HZ2      LYS  67  99.084  -1.868  -0.425
  528    HZ3  LYS  67           HZ3      LYS  67  99.083  -1.420  -2.064
  529    H    LYS  68           HN       LYS  68  93.068  -0.958  -5.537
  530    HA   LYS  68           HA       LYS  68  92.881  -2.428  -8.135
  531    HB2  LYS  68           HB2      LYS  68  90.451  -1.797  -6.472
  532    HB3  LYS  68           HB1      LYS  68  90.701  -3.103  -7.625
  533    HG2  LYS  68           HG2      LYS  68  92.211  -2.988  -4.995
  534    HG3  LYS  68           HG1      LYS  68  90.632  -3.730  -5.139
  535    HD2  LYS  68           HD2      LYS  68  91.399  -5.358  -6.689
  536    HD3  LYS  68           HD1      LYS  68  92.904  -4.487  -6.974
  537    HE2  LYS  68           HE2      LYS  68  93.839  -5.179  -4.958
  538    HE3  LYS  68           HE1      LYS  68  92.278  -5.408  -4.181
  539    HZ1  LYS  68           HZ1      LYS  68  92.466  -7.544  -4.681
  540    HZ2  LYS  68           HZ2      LYS  68  93.858  -7.274  -5.618
  541    HZ3  LYS  68           HZ3      LYS  68  92.317  -7.141  -6.322
  542    H    ARG  69           HN       ARG  69  92.705   0.576  -6.516
  543    HA   ARG  69           HA       ARG  69  91.977   2.697  -7.189
  544    HB2  ARG  69           HB2      ARG  69  92.525   1.378  -9.870
  545    HB3  ARG  69           HB1      ARG  69  92.011   3.053  -9.733
  546    HG2  ARG  69           HG2      ARG  69  94.328   3.314  -9.762
  547    HG3  ARG  69           HG1      ARG  69  94.036   3.233  -8.029
  548    HD2  ARG  69           HD2      ARG  69  95.807   1.719  -8.355
  549    HD3  ARG  69           HD1      ARG  69  94.387   0.680  -8.307
  550    HE   ARG  69           HE       ARG  69  94.803   0.125 -10.555
  551   HH11  ARG  69          HH11      ARG  69  95.887   0.344 -12.525
  552   HH12  ARG  69          HH12      ARG  69  96.919   1.710 -12.785
  553   HH21  ARG  69          HH21      ARG  69  96.337   3.079  -9.652
  554   HH22  ARG  69          HH22      ARG  69  97.173   3.259 -11.158
  555    H    THR  70           HN       THR  70  90.015   0.987  -6.386
  556    HA   THR  70           HA       THR  70  87.795   1.345  -8.379
  557    HB   THR  70           HB       THR  70  88.488  -0.986  -7.519
  558    HG1  THR  70           HG1      THR  70  86.538  -0.664  -8.547
  559   HG21  THR  70          HG21      THR  70  86.799  -0.350  -5.132
  560   HG22  THR  70          HG22      THR  70  88.532  -0.022  -5.080
  561   HG23  THR  70          HG23      THR  70  87.954  -1.664  -5.361
  562    H    TRP  71           HN       TRP  71  85.652   1.164  -6.869
  563    HA   TRP  71           HA       TRP  71  85.880   3.189  -4.694
  564    HB2  TRP  71           HB2      TRP  71  83.369   3.649  -5.605
  565    HB3  TRP  71           HB1      TRP  71  84.758   4.543  -6.195
  566    HD1  TRP  71           HD1      TRP  71  83.028   1.188  -7.114
  567    HE1  TRP  71           HE1      TRP  71  83.025   0.968  -9.638
  568    HE3  TRP  71           HE3      TRP  71  85.459   5.500  -8.363
  569    HZ2  TRP  71           HZ2      TRP  71  83.924   2.415 -11.945
  570    HZ3  TRP  71           HZ3      TRP  71  85.870   6.052 -10.745
  571    HH2  TRP  71           HH2      TRP  71  85.106   4.516 -12.536
  572    H    LEU  72           HN       LEU  72  85.648   1.846  -2.988
  573    HA   LEU  72           HA       LEU  72  84.284  -0.628  -3.100
  574    HB2  LEU  72           HB2      LEU  72  84.946   1.089  -0.715
  575    HB3  LEU  72           HB1      LEU  72  84.516  -0.613  -0.644
  576    HG   LEU  72           HG       LEU  72  86.793   0.431  -2.332
  577   HD11  LEU  72          HD11      LEU  72  86.861  -0.622   0.494
  578   HD12  LEU  72          HD12      LEU  72  87.309   0.997  -0.046
  579   HD13  LEU  72          HD13      LEU  72  88.286  -0.393  -0.522
  580   HD21  LEU  72          HD21      LEU  72  87.489  -2.092  -1.844
  581   HD22  LEU  72          HD22      LEU  72  86.361  -1.700  -3.140
  582   HD23  LEU  72          HD23      LEU  72  85.755  -2.289  -1.590
  583    H    LEU  73           HN       LEU  73  82.320  -0.146  -4.089
  584    HA   LEU  73           HA       LEU  73  80.215   0.946  -2.254
  585    HB2  LEU  73           HB2      LEU  73  78.889   1.456  -4.329
  586    HB3  LEU  73           HB1      LEU  73  80.354   2.417  -4.171
  587    HG   LEU  73           HG       LEU  73  81.382   0.400  -5.643
  588   HD11  LEU  73          HD11      LEU  73  79.229  -0.842  -5.762
  589   HD12  LEU  73          HD12      LEU  73  79.778  -0.326  -7.352
  590   HD13  LEU  73          HD13      LEU  73  78.485   0.551  -6.532
  591   HD21  LEU  73          HD21      LEU  73  81.458   2.725  -6.333
  592   HD22  LEU  73          HD22      LEU  73  79.737   2.725  -6.684
  593   HD23  LEU  73          HD23      LEU  73  80.840   1.776  -7.678
  594    H    LYS  74           HN       LYS  74  81.543  -1.791  -3.238
  595    HA   LYS  74           HA       LYS  74  79.245  -3.324  -4.135
  596    HB2  LYS  74           HB2      LYS  74  81.661  -4.611  -2.875
  597    HB3  LYS  74           HB1      LYS  74  80.685  -5.172  -4.214
  598    HG2  LYS  74           HG2      LYS  74  82.302  -2.651  -4.582
  599    HG3  LYS  74           HG1      LYS  74  83.130  -4.186  -4.602
  600    HD2  LYS  74           HD2      LYS  74  82.639  -3.908  -6.860
  601    HD3  LYS  74           HD1      LYS  74  81.268  -4.876  -6.347
  602    HE2  LYS  74           HE2      LYS  74  79.858  -2.957  -6.266
  603    HE3  LYS  74           HE1      LYS  74  81.226  -1.858  -6.424
  604    HZ1  LYS  74           HZ1      LYS  74  80.654  -3.869  -8.500
  605    HZ2  LYS  74           HZ2      LYS  74  81.521  -2.413  -8.631
  606    HZ3  LYS  74           HZ3      LYS  74  79.829  -2.387  -8.488
  607    H    THR  75           HN       THR  75  78.883  -1.830  -1.635
  608    HA   THR  75           HA       THR  75  79.126  -3.348   0.696
  609    HB   THR  75           HB       THR  75  76.643  -1.748   0.037
  610    HG1  THR  75           HG1      THR  75  78.237  -0.396  -0.520
  611   HG21  THR  75          HG21      THR  75  76.372  -2.607   2.195
  612   HG22  THR  75          HG22      THR  75  77.152  -1.060   2.520
  613   HG23  THR  75          HG23      THR  75  78.097  -2.544   2.555
  614    H    HIS  76           HN       HIS  76  77.423  -4.196  -2.091
  615    HA   HIS  76           HA       HIS  76  75.150  -5.567  -1.152
  616    HB2  HIS  76           HB2      HIS  76  75.871  -5.263  -3.567
  617    HB3  HIS  76           HB1      HIS  76  77.008  -6.587  -3.315
  618    HD1  HIS  76           HD1      HIS  76  73.835  -6.116  -4.705
  619    HD2  HIS  76           HD2      HIS  76  75.317  -8.889  -1.968
  620    HE1  HIS  76           HE1      HIS  76  72.252  -8.092  -4.760
  621    H    TRP  77           HN       TRP  77  78.270  -7.140  -1.891
  622    HA   TRP  77           HA       TRP  77  77.599  -9.335  -0.035
  623    HB2  TRP  77           HB2      TRP  77  80.331  -9.376  -1.172
  624    HB3  TRP  77           HB1      TRP  77  79.050 -10.578  -1.301
  625    HD1  TRP  77           HD1      TRP  77  80.708  -7.758  -3.116
  626    HE1  TRP  77           HE1      TRP  77  79.664  -7.499  -5.450
  627    HE3  TRP  77           HE3      TRP  77  76.683 -10.863  -2.631
  628    HZ2  TRP  77           HZ2      TRP  77  77.414  -8.477  -6.929
  629    HZ3  TRP  77           HZ3      TRP  77  75.107 -11.181  -4.517
  630    HH2  TRP  77           HH2      TRP  77  75.466  -9.992  -6.663
  631    H    THR  78           HN       THR  78  80.651  -9.559   0.576
  632    HA   THR  78           HA       THR  78  80.842  -7.313   2.533
  633    HB   THR  78           HB       THR  78  82.034  -9.821   3.520
  634    HG1  THR  78           HG1      THR  78  79.274  -9.983   3.555
  635   HG21  THR  78          HG21      THR  78  81.648  -8.246   5.200
  636   HG22  THR  78          HG22      THR  78  80.253  -9.310   5.381
  637   HG23  THR  78          HG23      THR  78  80.071  -7.773   4.554
  638    H    LEU  79           HN       LEU  79  83.155  -7.214   3.338
  639    HA   LEU  79           HA       LEU  79  84.879  -6.875   1.133
  640    HB2  LEU  79           HB2      LEU  79  86.565  -6.363   2.677
  641    HB3  LEU  79           HB1      LEU  79  85.096  -5.660   3.198
  642    HG   LEU  79           HG       LEU  79  86.307  -8.170   4.271
  643   HD11  LEU  79          HD11      LEU  79  87.607  -6.285   4.962
  644   HD12  LEU  79          HD12      LEU  79  86.579  -6.723   6.330
  645   HD13  LEU  79          HD13      LEU  79  86.154  -5.348   5.310
  646   HD21  LEU  79          HD21      LEU  79  83.966  -8.403   4.673
  647   HD22  LEU  79          HD22      LEU  79  83.767  -6.668   4.875
  648   HD23  LEU  79          HD23      LEU  79  84.527  -7.610   6.142
  649    H    ASP  80           HN       ASP  80  84.902  -9.412   3.600
  650    HA   ASP  80           HA       ASP  80  87.003 -11.019   2.770
  651    HB2  ASP  80           HB2      ASP  80  85.180 -11.397   4.550
  652    HB3  ASP  80           HB1      ASP  80  84.252 -12.165   3.276
  653    H    LYS  81           HN       LYS  81  83.853 -10.600   1.299
  654    HA   LYS  81           HA       LYS  81  84.070 -12.688  -0.648
  655    HB2  LYS  81           HB2      LYS  81  82.559 -10.116  -1.105
  656    HB3  LYS  81           HB1      LYS  81  82.156 -11.740  -1.641
  657    HG2  LYS  81           HG2      LYS  81  82.032 -10.666   1.176
  658    HG3  LYS  81           HG1      LYS  81  80.692 -11.242   0.188
  659    HD2  LYS  81           HD2      LYS  81  81.906 -13.486   0.142
  660    HD3  LYS  81           HD1      LYS  81  82.904 -12.854   1.439
  661    HE2  LYS  81           HE2      LYS  81  81.005 -12.560   2.879
  662    HE3  LYS  81           HE1      LYS  81  79.880 -12.897   1.564
  663    HZ1  LYS  81           HZ1      LYS  81  81.584 -15.058   1.665
  664    HZ2  LYS  81           HZ2      LYS  81  79.965 -15.009   2.177
  665    HZ3  LYS  81           HZ3      LYS  81  81.218 -14.713   3.285
  666    H    TYR  82           HN       TYR  82  84.637  -9.198  -0.818
  667    HA   TYR  82           HA       TYR  82  85.700  -9.240  -3.469
  668    HB2  TYR  82           HB2      TYR  82  85.250  -7.274  -1.466
  669    HB3  TYR  82           HB1      TYR  82  86.972  -7.180  -1.817
  670    HD1  TYR  82           HD1      TYR  82  87.435  -5.466  -3.346
  671    HD2  TYR  82           HD2      TYR  82  83.894  -7.838  -3.895
  672    HE1  TYR  82           HE1      TYR  82  86.936  -4.238  -5.438
  673    HE2  TYR  82           HE2      TYR  82  83.399  -6.608  -5.988
  674    HH   TYR  82           HH       TYR  82  85.105  -3.741  -6.882
  675    H    GLY  83           HN       GLY  83  87.267  -9.526  -0.259
  676    HA2  GLY  83           HA2      GLY  83  89.097 -11.258  -0.121
  677    HA3  GLY  83           HA1      GLY  83  89.655 -10.730  -1.707
  678    H    ILE  84           HN       ILE  84  88.580  -8.707   0.913
  679    HA   ILE  84           HA       ILE  84  91.108  -7.175   0.853
  680    HB   ILE  84           HB       ILE  84  88.424  -6.867   2.127
  681   HG12  ILE  84          HG12      ILE  84  89.656  -5.046   0.077
  682   HG13  ILE  84          HG11      ILE  84  88.802  -6.512  -0.396
  683   HG21  ILE  84          HG21      ILE  84  89.069  -4.582   2.743
  684   HG22  ILE  84          HG22      ILE  84  90.728  -4.935   2.244
  685   HG23  ILE  84          HG23      ILE  84  90.002  -5.797   3.608
  686   HD11  ILE  84          HD11      ILE  84  87.458  -4.277  -0.230
  687   HD12  ILE  84          HD12      ILE  84  87.509  -4.571   1.509
  688   HD13  ILE  84          HD13      ILE  84  86.753  -5.747   0.435
  689    H    GLN  85           HN       GLN  85  92.119  -6.634   2.983
  690    HA   GLN  85           HA       GLN  85  91.431  -8.179   5.334
  691    HB2  GLN  85           HB2      GLN  85  92.815  -9.683   3.566
  692    HB3  GLN  85           HB1      GLN  85  94.170  -8.883   4.350
  693    HG2  GLN  85           HG2      GLN  85  93.943 -10.710   5.773
  694    HG3  GLN  85           HG1      GLN  85  92.848  -9.584   6.575
  695   HE21  GLN  85          HE21      GLN  85  90.621  -9.679   4.901
  696   HE22  GLN  85          HE22      GLN  85  89.963 -11.236   4.914
  697    H    ALA  86           HN       ALA  86  93.859  -8.110   6.656
  698    HA   ALA  86           HA       ALA  86  94.085  -5.325   7.341
  699    HB1  ALA  86           HB1      ALA  86  94.533  -7.407   8.797
  700    HB2  ALA  86           HB2      ALA  86  95.640  -6.047   8.975
  701    HB3  ALA  86           HB3      ALA  86  96.112  -7.455   8.018
  702    H    ASP  87           HN       ASP  87  95.683  -7.360   5.041
  703    HA   ASP  87           HA       ASP  87  98.037  -5.635   4.789
  704    HB2  ASP  87           HB2      ASP  87  98.361  -7.099   2.681
  705    HB3  ASP  87           HB1      ASP  87  98.441  -7.909   4.247
  706    H    ALA  88           HN       ALA  88  94.844  -5.411   3.875
  707    HA   ALA  88           HA       ALA  88  95.391  -3.957   1.335
  708    HB1  ALA  88           HB1      ALA  88  93.596  -5.464   1.101
  709    HB2  ALA  88           HB2      ALA  88  92.790  -3.920   1.381
  710    HB3  ALA  88           HB3      ALA  88  92.965  -5.084   2.696
  711    H    LYS  89           HN       LYS  89  95.886  -1.802   1.691
  712    HA   LYS  89           HA       LYS  89  94.600  -0.408   3.989
  713    HB2  LYS  89           HB2      LYS  89  96.628   0.863   2.163
  714    HB3  LYS  89           HB1      LYS  89  96.274   1.222   3.852
  715    HG2  LYS  89           HG2      LYS  89  97.495  -1.392   2.922
  716    HG3  LYS  89           HG1      LYS  89  98.429  -0.010   3.448
  717    HD2  LYS  89           HD2      LYS  89  97.742  -0.182   5.672
  718    HD3  LYS  89           HD1      LYS  89  96.279  -1.064   5.255
  719    HE2  LYS  89           HE2      LYS  89  97.928  -2.560   6.296
  720    HE3  LYS  89           HE1      LYS  89  97.603  -3.015   4.622
  721    HZ1  LYS  89           HZ1      LYS  89  99.773  -1.124   5.081
  722    HZ2  LYS  89           HZ2      LYS  89  99.650  -2.384   3.947
  723    HZ3  LYS  89           HZ3      LYS  89 100.048  -2.726   5.563
  724    H    LEU  90           HN       LEU  90  92.776   0.530   3.616
  725    HA   LEU  90           HA       LEU  90  92.056   1.456   0.894
  726    HB2  LEU  90           HB2      LEU  90  90.254   1.651   3.294
  727    HB3  LEU  90           HB1      LEU  90  89.824   1.436   1.598
  728    HG   LEU  90           HG       LEU  90  91.155  -0.598   3.393
  729   HD11  LEU  90          HD11      LEU  90  89.012  -1.878   2.727
  730   HD12  LEU  90          HD12      LEU  90  88.392  -0.307   2.222
  731   HD13  LEU  90          HD13      LEU  90  88.846  -0.575   3.903
  732   HD21  LEU  90          HD21      LEU  90  90.565  -0.577   0.428
  733   HD22  LEU  90          HD22      LEU  90  90.753  -2.086   1.325
  734   HD23  LEU  90          HD23      LEU  90  92.091  -0.943   1.235
  735    H    GLN  91           HN       GLN  91  90.717   3.601   1.010
  736    HA   GLN  91           HA       GLN  91  92.051   5.597   2.786
  737    HB2  GLN  91           HB2      GLN  91  91.425   6.130  -0.128
  738    HB3  GLN  91           HB1      GLN  91  92.378   7.125   0.965
  739    HG2  GLN  91           HG2      GLN  91  94.261   5.759   0.784
  740    HG3  GLN  91           HG1      GLN  91  93.328   4.340   0.371
  741   HE21  GLN  91          HE21      GLN  91  92.336   7.133  -1.303
  742   HE22  GLN  91          HE22      GLN  91  93.079   6.776  -2.776
  743    H    PHE  92           HN       PHE  92  90.734   7.540   3.047
  744    HA   PHE  92           HA       PHE  92  87.820   7.057   2.520
  745    HB2  PHE  92           HB2      PHE  92  87.938   7.385   4.835
  746    HB3  PHE  92           HB1      PHE  92  89.317   8.468   4.712
  747    HD1  PHE  92           HD1      PHE  92  85.679   8.244   4.718
  748    HD2  PHE  92           HD2      PHE  92  89.009  10.810   3.882
  749    HE1  PHE  92           HE1      PHE  92  84.167  10.214   4.715
  750    HE2  PHE  92           HE2      PHE  92  87.507  12.780   3.902
  751    HZ   PHE  92           HZ       PHE  92  85.082  12.479   4.317
  752    H    THR  93           HN       THR  93  86.833   8.461   1.082
  753    HA   THR  93           HA       THR  93  88.137  11.076   0.501
  754    HB   THR  93           HB       THR  93  89.113   9.967  -1.298
  755    HG1  THR  93           HG1      THR  93  87.168  10.041  -2.982
  756   HG21  THR  93          HG21      THR  93  86.654   8.199  -1.302
  757   HG22  THR  93          HG22      THR  93  88.290   7.749  -0.819
  758   HG23  THR  93          HG23      THR  93  87.934   8.097  -2.511
  759    HA   PRO  94           HA       PRO  94  83.873  12.327   0.383
  760    HB2  PRO  94           HB2      PRO  94  84.004  14.612  -1.099
  761    HB3  PRO  94           HB1      PRO  94  84.691  14.499   0.533
  762    HG2  PRO  94           HG2      PRO  94  86.075  14.260  -2.109
  763    HG3  PRO  94           HG1      PRO  94  86.559  15.175  -0.668
  764    HD2  PRO  94           HD2      PRO  94  87.621  12.734  -1.253
  765    HD3  PRO  94           HD1      PRO  94  87.386  13.287   0.420
  766    H    TYR 541           HT1      TYR 541  55.946  42.128  10.421
  767    HA   TYR 541           HA       TYR 541  55.779  40.697  12.387
  768    HB2  TYR 541           HB2      TYR 541  54.973  43.300  13.723
  769    HB3  TYR 541           HB1      TYR 541  54.902  41.701  14.463
  770    HD1  TYR 541           HD1      TYR 541  56.954  40.484  15.051
  771    HD2  TYR 541           HD2      TYR 541  57.100  44.426  13.350
  772    HE1  TYR 541           HE1      TYR 541  59.330  40.688  15.728
  773    HE2  TYR 541           HE2      TYR 541  59.476  44.630  14.028
  774    HH   TYR 541           HH       TYR 541  61.074  43.718  15.420
  775    H    HIS 542           HN       HIS 542  54.318  41.450  10.024
  776    HA   HIS 542           HA       HIS 542  51.597  42.136  10.662
  777    HB2  HIS 542           HB2      HIS 542  52.951  40.871   8.276
  778    HB3  HIS 542           HB1      HIS 542  51.206  41.083   8.334
  779    HD1  HIS 542           HD1      HIS 542  50.472  43.694   8.977
  780    HD2  HIS 542           HD2      HIS 542  54.251  43.107   7.317
  781    HE1  HIS 542           HE1      HIS 542  51.223  45.945   8.093
  782    H    GLU 543           HN       GLU 543  51.834  39.226   8.836
  783    HA   GLU 543           HA       GLU 543  51.034  37.544  11.171
  784    HB2  GLU 543           HB2      GLU 543  49.099  36.675   9.961
  785    HB3  GLU 543           HB1      GLU 543  48.965  38.427  10.094
  786    HG2  GLU 543           HG2      GLU 543  48.462  38.091   7.832
  787    HG3  GLU 543           HG1      GLU 543  50.189  38.438   7.763
  788    H    ARG 544           HN       ARG 544  52.982  37.941   8.531
  789    HA   ARG 544           HA       ARG 544  52.973  35.327   7.355
  790    HB2  ARG 544           HB2      ARG 544  55.100  37.479   7.512
  791    HB3  ARG 544           HB1      ARG 544  55.335  35.975   6.642
  792    HG2  ARG 544           HG2      ARG 544  54.559  37.402   4.948
  793    HG3  ARG 544           HG1      ARG 544  53.111  36.544   5.428
  794    HD2  ARG 544           HD2      ARG 544  52.096  38.493   5.973
  795    HD3  ARG 544           HD1      ARG 544  53.370  38.884   7.110
  796    HE   ARG 544           HE       ARG 544  52.920  40.180   4.633
  797   HH11  ARG 544          HH11      ARG 544  54.494  41.352   3.549
  798   HH12  ARG 544          HH12      ARG 544  56.167  41.067   3.897
  799   HH21  ARG 544          HH21      ARG 544  55.537  38.631   6.270
  800   HH22  ARG 544          HH22      ARG 544  56.755  39.531   5.434
  801    H    ARG 545           HN       ARG 545  52.747  34.285   9.632
  802    HA   ARG 545           HA       ARG 545  55.234  34.067  11.167
  803    HB2  ARG 545           HB2      ARG 545  53.890  32.513  12.550
  804    HB3  ARG 545           HB1      ARG 545  53.050  34.037  12.284
  805    HG2  ARG 545           HG2      ARG 545  52.121  32.643  10.138
  806    HG3  ARG 545           HG1      ARG 545  52.401  31.308  11.243
  807    HD2  ARG 545           HD2      ARG 545  51.112  32.937  12.942
  808    HD3  ARG 545           HD1      ARG 545  50.434  33.555  11.437
  809    HE   ARG 545           HE       ARG 545  49.632  31.167  12.735
  810   HH11  ARG 545          HH11      ARG 545  48.748  29.387  11.694
  811   HH12  ARG 545          HH12      ARG 545  48.884  29.247   9.973
  812   HH21  ARG 545          HH21      ARG 545  50.598  32.226   9.592
  813   HH22  ARG 545          HH22      ARG 545  49.938  30.846   8.790
  814    H    GLY 546           HN       GLY 546  54.716  31.164  11.709
  815    HA2  GLY 546           HA2      GLY 546  55.159  29.802   9.158
  816    HA3  GLY 546           HA1      GLY 546  56.602  29.906  10.166
  817    H    SER 547           HN       SER 547  56.771  28.569  11.961
  818    HA   SER 547           HA       SER 547  54.533  27.220  13.181
  819    HB2  SER 547           HB2      SER 547  56.001  25.891  10.947
  820    HB3  SER 547           HB1      SER 547  55.601  24.895  12.343
  821    HG   SER 547           HG       SER 547  53.646  24.848  11.600
  822    H    LEU 548           HN       LEU 548  55.322  27.034  15.259
  823    HA   LEU 548           HA       LEU 548  58.064  27.365  15.873
  824    HB2  LEU 548           HB2      LEU 548  55.602  26.665  17.356
  825    HB3  LEU 548           HB1      LEU 548  57.074  26.051  18.096
  826    HG   LEU 548           HG       LEU 548  58.026  28.410  17.875
  827   HD11  LEU 548          HD11      LEU 548  55.172  28.906  17.047
  828   HD12  LEU 548          HD12      LEU 548  56.656  29.440  16.266
  829   HD13  LEU 548          HD13      LEU 548  56.149  30.176  17.779
  830   HD21  LEU 548          HD21      LEU 548  56.947  27.384  19.967
  831   HD22  LEU 548          HD22      LEU 548  55.530  28.346  19.556
  832   HD23  LEU 548          HD23      LEU 548  57.069  29.141  19.898
  833    H    CYS 549           HN       CYS 549  59.762  25.960  16.062
  834    HA   CYS 549           HA       CYS 549  59.322  23.195  15.144
  835    HB2  CYS 549           HB2      CYS 549  61.333  24.103  14.305
  836    HB3  CYS 549           HB1      CYS 549  61.701  24.926  15.808
  837    H    SER 550           HN       SER 550  58.335  22.045  16.724
  838    HA   SER 550           HA       SER 550  58.406  22.473  19.468
  839    HB2  SER 550           HB2      SER 550  56.794  20.962  18.675
  840    HB3  SER 550           HB1      SER 550  57.995  19.918  17.924
  841    HG   SER 550           HG       SER 550  58.253  20.405  20.650
  842    H    GLY 551           HN       GLY 551  59.852  22.304  20.955
  843    HA2  GLY 551           HA2      GLY 551  61.669  21.049  22.094
  844    HA3  GLY 551           HA1      GLY 551  62.313  20.654  20.493
  845    H    CYS 552           HN       CYS 552  61.721  23.186  19.353
  846    HA   CYS 552           HA       CYS 552  63.874  24.861  20.571
  847    HB2  CYS 552           HB2      CYS 552  62.746  24.460  17.811
  848    HB3  CYS 552           HB1      CYS 552  63.533  25.980  18.204
  849    H    GLN 553           HN       GLN 553  60.586  24.738  19.358
  850    HA   GLN 553           HA       GLN 553  58.826  26.184  19.505
  851    HB2  GLN 553           HB2      GLN 553  60.223  26.924  22.061
  852    HB3  GLN 553           HB1      GLN 553  58.594  27.450  21.628
  853    HG2  GLN 553           HG2      GLN 553  59.455  24.558  21.713
  854    HG3  GLN 553           HG1      GLN 553  58.644  25.367  23.039
  855   HE21  GLN 553          HE21      GLN 553  58.243  24.304  19.685
  856   HE22  GLN 553          HE22      GLN 553  56.545  24.300  19.699
  857    H    LYS 554           HN       LYS 554  60.304  26.986  17.722
  858    HA   LYS 554           HA       LYS 554  60.318  29.942  17.907
  859    HB2  LYS 554           HB2      LYS 554  62.578  28.285  16.754
  860    HB3  LYS 554           HB1      LYS 554  62.441  30.030  16.587
  861    HG2  LYS 554           HG2      LYS 554  62.584  28.575  19.239
  862    HG3  LYS 554           HG1      LYS 554  63.967  29.319  18.444
  863    HD2  LYS 554           HD2      LYS 554  62.439  31.470  18.417
  864    HD3  LYS 554           HD1      LYS 554  61.567  30.633  19.700
  865    HE2  LYS 554           HE2      LYS 554  64.541  31.217  19.714
  866    HE3  LYS 554           HE1      LYS 554  63.322  32.118  20.617
  867    HZ1  LYS 554           HZ1      LYS 554  64.048  30.596  22.158
  868    HZ2  LYS 554           HZ2      LYS 554  64.268  29.360  21.014
  869    HZ3  LYS 554           HZ3      LYS 554  62.702  29.791  21.513
  870    HA   PRO 555           HA       PRO 555  57.723  29.026  14.298
  871    HB2  PRO 555           HB2      PRO 555  58.732  31.631  13.303
  872    HB3  PRO 555           HB1      PRO 555  57.070  31.058  13.467
  873    HG2  PRO 555           HG2      PRO 555  58.233  32.848  15.201
  874    HG3  PRO 555           HG1      PRO 555  56.906  31.775  15.657
  875    HD2  PRO 555           HD2      PRO 555  59.725  31.678  16.521
  876    HD3  PRO 555           HD1      PRO 555  58.321  30.820  17.203
  877    H    ILE 556           HN       ILE 556  58.106  27.933  12.524
  878    HA   ILE 556           HA       ILE 556  60.835  27.826  11.373
  879    HB   ILE 556           HB       ILE 556  58.322  26.158  11.010
  880   HG12  ILE 556          HG12      ILE 556  60.957  25.166  12.091
  881   HG13  ILE 556          HG11      ILE 556  59.893  26.054  13.160
  882   HG21  ILE 556          HG21      ILE 556  59.467  26.080   8.924
  883   HG22  ILE 556          HG22      ILE 556  59.929  24.619   9.794
  884   HG23  ILE 556          HG23      ILE 556  61.042  25.979   9.712
  885   HD11  ILE 556          HD11      ILE 556  58.570  23.899  11.582
  886   HD12  ILE 556          HD12      ILE 556  58.370  24.337  13.279
  887   HD13  ILE 556          HD13      ILE 556  59.740  23.356  12.781
  888    H    THR 557           HN       THR 557  60.948  29.677  10.042
  889    HA   THR 557           HA       THR 557  58.703  30.194   8.154
  890    HB   THR 557           HB       THR 557  59.536  32.380   7.968
  891    HG1  THR 557           HG1      THR 557  61.680  31.895   7.519
  892   HG21  THR 557          HG21      THR 557  59.713  33.110  10.242
  893   HG22  THR 557          HG22      THR 557  60.397  31.565  10.748
  894   HG23  THR 557          HG23      THR 557  58.703  31.662  10.268
  895    H    GLY 558           HN       GLY 558  59.061  28.567   6.651
  896    HA2  GLY 558           HA2      GLY 558  60.347  29.037   4.302
  897    HA3  GLY 558           HA1      GLY 558  61.627  28.287   5.267
  898    H    ARG 559           HN       ARG 559  61.488  26.127   5.760
  899    HA   ARG 559           HA       ARG 559  59.228  24.574   4.558
  900    HB2  ARG 559           HB2      ARG 559  62.192  24.079   4.795
  901    HB3  ARG 559           HB1      ARG 559  61.104  22.691   4.785
  902    HG2  ARG 559           HG2      ARG 559  60.798  24.830   2.687
  903    HG3  ARG 559           HG1      ARG 559  62.069  23.624   2.511
  904    HD2  ARG 559           HD2      ARG 559  60.542  21.847   2.344
  905    HD3  ARG 559           HD1      ARG 559  59.242  22.762   3.107
  906    HE   ARG 559           HE       ARG 559  59.772  24.171   0.779
  907   HH11  ARG 559          HH11      ARG 559  58.722  23.734  -1.174
  908   HH12  ARG 559          HH12      ARG 559  58.051  22.161  -1.448
  909   HH21  ARG 559          HH21      ARG 559  59.042  20.913   1.632
  910   HH22  ARG 559          HH22      ARG 559  58.232  20.563   0.142
  911    H    CYS 560           HN       CYS 560  58.407  22.847   5.911
  912    HA   CYS 560           HA       CYS 560  59.472  22.747   8.675
  913    HB2  CYS 560           HB2      CYS 560  57.218  23.028   9.646
  914    HB3  CYS 560           HB1      CYS 560  57.772  24.479   8.807
  915    HG   CYS 560           HG       CYS 560  55.269  23.065   8.124
  916    H    ILE 561           HN       ILE 561  59.627  20.793   9.360
  917    HA   ILE 561           HA       ILE 561  58.242  18.606   7.950
  918    HB   ILE 561           HB       ILE 561  60.333  18.641  10.145
  919   HG12  ILE 561          HG12      ILE 561  60.402  18.088   7.184
  920   HG13  ILE 561          HG11      ILE 561  61.100  19.483   7.988
  921   HG21  ILE 561          HG21      ILE 561  59.343  16.303   8.490
  922   HG22  ILE 561          HG22      ILE 561  58.867  16.580  10.168
  923   HG23  ILE 561          HG23      ILE 561  60.550  16.247   9.773
  924   HD11  ILE 561          HD11      ILE 561  62.510  17.858   9.335
  925   HD12  ILE 561          HD12      ILE 561  62.906  17.949   7.616
  926   HD13  ILE 561          HD13      ILE 561  61.955  16.591   8.234
  927    H    THR 562           HN       THR 562  56.842  17.257   8.994
  928    HA   THR 562           HA       THR 562  55.819  18.165  11.656
  929    HB   THR 562           HB       THR 562  54.130  16.734   9.619
  930    HG1  THR 562           HG1      THR 562  54.673  18.647   8.657
  931   HG21  THR 562          HG21      THR 562  53.379  18.533  11.926
  932   HG22  THR 562          HG22      THR 562  53.521  16.780  12.075
  933   HG23  THR 562          HG23      THR 562  52.310  17.481  10.997
  934    H    ALA 563           HN       ALA 563  55.300  16.616  13.127
  935    HA   ALA 563           HA       ALA 563  56.202  13.832  12.511
  936    HB1  ALA 563           HB1      ALA 563  57.762  15.188  13.937
  937    HB2  ALA 563           HB2      ALA 563  57.138  13.735  14.734
  938    HB3  ALA 563           HB3      ALA 563  56.465  15.320  15.127
  939    H    MET 564           HN       MET 564  55.366  13.719  15.547
  940    HA   MET 564           HA       MET 564  52.861  12.393  15.146
  941    HB2  MET 564           HB2      MET 564  53.733  13.557  17.780
  942    HB3  MET 564           HB1      MET 564  52.920  12.024  17.460
  943    HG2  MET 564           HG2      MET 564  55.074  11.364  16.190
  944    HG3  MET 564           HG1      MET 564  55.809  12.748  16.995
  945    HE1  MET 564           HE1      MET 564  55.904   9.235  17.090
  946    HE2  MET 564           HE2      MET 564  56.749   9.142  18.633
  947    HE3  MET 564           HE3      MET 564  57.255  10.325  17.430
  948    H    ALA 565           HN       ALA 565  53.145  15.186  14.286
  949    HA   ALA 565           HA       ALA 565  51.279  16.688  13.877
  950    HB1  ALA 565           HB1      ALA 565  49.771  17.344  15.621
  951    HB2  ALA 565           HB2      ALA 565  50.745  16.556  16.857
  952    HB3  ALA 565           HB3      ALA 565  49.851  15.586  15.679
  953    H    LYS 566           HN       LYS 566  53.964  16.401  15.827
  954    HA   LYS 566           HA       LYS 566  54.139  19.233  16.616
  955    HB2  LYS 566           HB2      LYS 566  55.809  16.768  16.897
  956    HB3  LYS 566           HB1      LYS 566  56.670  18.301  16.929
  957    HG2  LYS 566           HG2      LYS 566  55.452  19.073  18.814
  958    HG3  LYS 566           HG1      LYS 566  54.244  17.800  18.656
  959    HD2  LYS 566           HD2      LYS 566  57.124  17.008  19.043
  960    HD3  LYS 566           HD1      LYS 566  56.215  17.588  20.432
  961    HE2  LYS 566           HE2      LYS 566  54.709  15.794  20.366
  962    HE3  LYS 566           HE1      LYS 566  54.991  15.486  18.648
  963    HZ1  LYS 566           HZ1      LYS 566  57.404  15.202  20.087
  964    HZ2  LYS 566           HZ2      LYS 566  56.567  14.043  19.170
  965    HZ3  LYS 566           HZ3      LYS 566  56.206  14.249  20.817
  966    H    LYS 567           HN       LYS 567  55.974  20.570  15.781
  967    HA   LYS 567           HA       LYS 567  56.411  20.067  12.864
  968    HB2  LYS 567           HB2      LYS 567  56.964  22.670  14.242
  969    HB3  LYS 567           HB1      LYS 567  56.528  22.389  12.569
  970    HG2  LYS 567           HG2      LYS 567  54.691  22.047  14.965
  971    HG3  LYS 567           HG1      LYS 567  54.634  23.362  13.805
  972    HD2  LYS 567           HD2      LYS 567  54.169  20.426  13.140
  973    HD3  LYS 567           HD1      LYS 567  52.921  21.662  13.292
  974    HE2  LYS 567           HE2      LYS 567  54.296  22.953  11.491
  975    HE3  LYS 567           HE1      LYS 567  55.036  21.385  11.174
  976    HZ1  LYS 567           HZ1      LYS 567  52.180  22.126  10.967
  977    HZ2  LYS 567           HZ2      LYS 567  52.699  20.508  11.009
  978    HZ3  LYS 567           HZ3      LYS 567  53.198  21.531   9.748
  979    H    PHE 568           HN       PHE 568  58.714  21.090  12.202
  980    HA   PHE 568           HA       PHE 568  60.706  20.804  14.348
  981    HB2  PHE 568           HB2      PHE 568  59.971  18.548  12.599
  982    HB3  PHE 568           HB1      PHE 568  61.693  18.873  12.551
  983    HD1  PHE 568           HD1      PHE 568  62.907  19.124  14.838
  984    HD2  PHE 568           HD2      PHE 568  59.023  17.342  14.394
  985    HE1  PHE 568           HE1      PHE 568  63.175  17.992  17.028
  986    HE2  PHE 568           HE2      PHE 568  59.292  16.209  16.584
  987    HZ   PHE 568           HZ       PHE 568  61.368  16.534  17.901
  988    H    HIS 569           HN       HIS 569  62.494  21.966  13.834
  989    HA   HIS 569           HA       HIS 569  62.654  23.586  11.524
  990    HB2  HIS 569           HB2      HIS 569  64.639  22.596  13.526
  991    HB3  HIS 569           HB1      HIS 569  65.252  23.401  12.095
  992    HD2  HIS 569           HD2      HIS 569  63.668  26.066  11.805
  993    HE1  HIS 569           HE1      HIS 569  63.868  26.527  15.992
  994    HA   PRO 570           HA       PRO 570  63.197  20.022   8.703
  995    HB2  PRO 570           HB2      PRO 570  64.403  22.144   6.974
  996    HB3  PRO 570           HB1      PRO 570  63.151  20.952   6.585
  997    HG2  PRO 570           HG2      PRO 570  62.567  23.572   7.045
  998    HG3  PRO 570           HG1      PRO 570  61.446  22.264   7.437
  999    HD2  PRO 570           HD2      PRO 570  63.016  23.976   9.278
 1000    HD3  PRO 570           HD1      PRO 570  61.554  23.010   9.601
 1001    H    GLU 571           HN       GLU 571  65.583  21.980  10.151
 1002    HA   GLU 571           HA       GLU 571  67.829  20.363   9.047
 1003    HB2  GLU 571           HB2      GLU 571  68.176  22.696  10.918
 1004    HB3  GLU 571           HB1      GLU 571  69.248  22.121   9.644
 1005    HG2  GLU 571           HG2      GLU 571  67.415  22.779   7.996
 1006    HG3  GLU 571           HG1      GLU 571  66.645  23.611   9.349
 1007    H    HIS 572           HN       HIS 572  66.659  21.619  12.181
 1008    HA   HIS 572           HA       HIS 572  68.358  20.049  13.806
 1009    HB2  HIS 572           HB2      HIS 572  65.499  20.779  14.516
 1010    HB3  HIS 572           HB1      HIS 572  66.828  20.477  15.634
 1011    HD2  HIS 572           HD2      HIS 572  68.887  22.308  13.481
 1012    HE1  HIS 572           HE1      HIS 572  66.656  25.503  15.082
 1013    H    PHE 573           HN       PHE 573  66.104  18.934  11.634
 1014    HA   PHE 573           HA       PHE 573  65.980  16.277  13.023
 1015    HB2  PHE 573           HB2      PHE 573  63.761  17.666  12.734
 1016    HB3  PHE 573           HB1      PHE 573  63.891  17.178  11.049
 1017    HD1  PHE 573           HD1      PHE 573  63.515  14.888  10.364
 1018    HD2  PHE 573           HD2      PHE 573  63.536  15.958  14.525
 1019    HE1  PHE 573           HE1      PHE 573  62.577  12.666  10.942
 1020    HE2  PHE 573           HE2      PHE 573  62.598  13.737  15.101
 1021    HZ   PHE 573           HZ       PHE 573  62.119  12.091  13.310
 1022    H    VAL 574           HN       VAL 574  68.127  16.774  11.525
 1023    HA   VAL 574           HA       VAL 574  67.646  15.966   8.739
 1024    HB   VAL 574           HB       VAL 574  70.150  16.168   8.555
 1025   HG11  VAL 574          HG11      VAL 574  69.799  18.306   7.911
 1026   HG12  VAL 574          HG12      VAL 574  69.526  18.844   9.546
 1027   HG13  VAL 574          HG13      VAL 574  68.190  18.194   8.599
 1028   HG21  VAL 574          HG21      VAL 574  71.306  17.299  10.423
 1029   HG22  VAL 574          HG22      VAL 574  70.658  15.737  10.917
 1030   HG23  VAL 574          HG23      VAL 574  69.830  17.231  11.384
 1031    H    CYS 575           HN       CYS 575  69.415  14.285   7.938
 1032    HA   CYS 575           HA       CYS 575  69.029  11.792   9.454
 1033    HB2  CYS 575           HB2      CYS 575  69.123  11.054   7.299
 1034    HB3  CYS 575           HB1      CYS 575  69.839  12.563   6.751
 1035    H    ALA 576           HN       ALA 576  70.658  10.671  10.654
 1036    HA   ALA 576           HA       ALA 576  73.022  12.431  11.224
 1037    HB1  ALA 576           HB1      ALA 576  71.564  11.225  13.014
 1038    HB2  ALA 576           HB2      ALA 576  73.319  11.156  13.190
 1039    HB3  ALA 576           HB3      ALA 576  72.442   9.769  12.540
 1040    H    PHE 577           HN       PHE 577  73.740  11.947   9.014
 1041    HA   PHE 577           HA       PHE 577  75.892  10.003   9.088
 1042    HB2  PHE 577           HB2      PHE 577  74.077   8.683   7.891
 1043    HB3  PHE 577           HB1      PHE 577  73.981   9.973   6.701
 1044    HD1  PHE 577           HD1      PHE 577  74.449   7.585   5.378
 1045    HD2  PHE 577           HD2      PHE 577  77.446   9.811   7.556
 1046    HE1  PHE 577           HE1      PHE 577  76.225   6.526   4.059
 1047    HE2  PHE 577           HE2      PHE 577  79.187   8.729   6.213
 1048    HZ   PHE 577           HZ       PHE 577  78.589   7.098   4.474
 1049    H    CYS 578           HN       CYS 578  73.928  11.995   7.062
 1050    HA   CYS 578           HA       CYS 578  76.116  13.959   6.558
 1051    HB2  CYS 578           HB2      CYS 578  75.028  14.391   4.368
 1052    HB3  CYS 578           HB1      CYS 578  75.540  12.709   4.483
 1053    H    LEU 579           HN       LEU 579  75.229  14.806   8.549
 1054    HA   LEU 579           HA       LEU 579  72.626  15.444   9.199
 1055    HB2  LEU 579           HB2      LEU 579  75.036  17.165   9.793
 1056    HB3  LEU 579           HB1      LEU 579  73.554  17.071  10.731
 1057    HG   LEU 579           HG       LEU 579  74.303  14.401  10.641
 1058   HD11  LEU 579          HD11      LEU 579  76.610  14.122  10.828
 1059   HD12  LEU 579          HD12      LEU 579  76.892  15.806  11.260
 1060   HD13  LEU 579          HD13      LEU 579  76.520  15.376   9.594
 1061   HD21  LEU 579          HD21      LEU 579  73.571  15.506  12.669
 1062   HD22  LEU 579          HD22      LEU 579  75.013  16.521  12.694
 1063   HD23  LEU 579          HD23      LEU 579  75.150  14.787  12.984
 1064    H    LYS 580           HN       LYS 580  73.518  16.480   6.238
 1065    HA   LYS 580           HA       LYS 580  72.879  19.331   6.645
 1066    HB2  LYS 580           HB2      LYS 580  73.588  19.687   4.481
 1067    HB3  LYS 580           HB1      LYS 580  74.438  18.191   4.823
 1068    HG2  LYS 580           HG2      LYS 580  71.755  18.305   3.384
 1069    HG3  LYS 580           HG1      LYS 580  73.312  18.253   2.578
 1070    HD2  LYS 580           HD2      LYS 580  73.794  16.087   3.326
 1071    HD3  LYS 580           HD1      LYS 580  72.624  16.180   4.633
 1072    HE2  LYS 580           HE2      LYS 580  71.957  14.761   2.606
 1073    HE3  LYS 580           HE1      LYS 580  70.785  15.953   3.166
 1074    HZ1  LYS 580           HZ1      LYS 580  70.950  17.084   1.274
 1075    HZ2  LYS 580           HZ2      LYS 580  71.773  15.742   0.635
 1076    HZ3  LYS 580           HZ3      LYS 580  72.645  17.045   1.289
 1077    H    GLN 581           HN       GLN 581  71.011  16.504   5.326
 1078    HA   GLN 581           HA       GLN 581  68.627  18.015   5.984
 1079    HB2  GLN 581           HB2      GLN 581  69.305  19.007   3.809
 1080    HB3  GLN 581           HB1      GLN 581  68.983  17.450   3.052
 1081    HG2  GLN 581           HG2      GLN 581  66.984  18.718   2.792
 1082    HG3  GLN 581           HG1      GLN 581  66.643  17.614   4.108
 1083   HE21  GLN 581          HE21      GLN 581  66.954  18.566   6.379
 1084   HE22  GLN 581          HE22      GLN 581  66.637  20.212   6.580
 1085    H    LEU 582           HN       LEU 582  66.786  16.874   6.164
 1086    HA   LEU 582           HA       LEU 582  66.667  14.094   5.126
 1087    HB2  LEU 582           HB2      LEU 582  67.442  14.203   7.534
 1088    HB3  LEU 582           HB1      LEU 582  65.855  14.833   7.936
 1089    HG   LEU 582           HG       LEU 582  64.825  12.776   7.072
 1090   HD11  LEU 582          HD11      LEU 582  66.076  11.770   5.431
 1091   HD12  LEU 582          HD12      LEU 582  66.755  10.872   6.785
 1092   HD13  LEU 582          HD13      LEU 582  67.610  12.272   6.134
 1093   HD21  LEU 582          HD21      LEU 582  65.252  12.702   9.385
 1094   HD22  LEU 582          HD22      LEU 582  66.987  12.594   9.162
 1095   HD23  LEU 582          HD23      LEU 582  65.972  11.206   8.798
 1096    H    ASN 583           HN       ASN 583  64.319  13.258   5.433
 1097    HA   ASN 583           HA       ASN 583  62.286  15.428   5.482
 1098    HB2  ASN 583           HB2      ASN 583  62.971  13.715   3.091
 1099    HB3  ASN 583           HB1      ASN 583  61.323  14.294   3.312
 1100   HD21  ASN 583          HD21      ASN 583  62.590  15.234   1.092
 1101   HD22  ASN 583          HD22      ASN 583  63.063  16.846   1.298
 1102    H    LYS 584           HN       LYS 584  60.359  14.712   6.303
 1103    HA   LYS 584           HA       LYS 584  60.165  12.307   7.751
 1104    HB2  LYS 584           HB2      LYS 584  57.681  12.785   7.665
 1105    HB3  LYS 584           HB1      LYS 584  58.687  14.120   8.231
 1106    HG2  LYS 584           HG2      LYS 584  58.466  15.331   6.233
 1107    HG3  LYS 584           HG1      LYS 584  58.053  13.904   5.285
 1108    HD2  LYS 584           HD2      LYS 584  56.013  15.060   5.488
 1109    HD3  LYS 584           HD1      LYS 584  55.907  13.809   6.717
 1110    HE2  LYS 584           HE2      LYS 584  55.195  15.823   7.774
 1111    HE3  LYS 584           HE1      LYS 584  56.831  15.533   8.359
 1112    HZ1  LYS 584           HZ1      LYS 584  57.700  17.157   6.958
 1113    HZ2  LYS 584           HZ2      LYS 584  56.269  17.858   7.547
 1114    HZ3  LYS 584           HZ3      LYS 584  56.315  17.204   5.980
 1115    H    GLY 585           HN       GLY 585  59.689  12.914   4.388
 1116    HA2  GLY 585           HA2      GLY 585  58.173  10.438   3.924
 1117    HA3  GLY 585           HA1      GLY 585  58.684  11.595   2.699
 1118    H    THR 586           HN       THR 586  61.399  11.473   4.111
 1119    HA   THR 586           HA       THR 586  62.326   8.848   3.007
 1120    HB   THR 586           HB       THR 586  64.016   9.859   1.755
 1121    HG1  THR 586           HG1      THR 586  64.985  11.684   2.347
 1122   HG21  THR 586          HG21      THR 586  61.709  10.515   0.957
 1123   HG22  THR 586          HG22      THR 586  62.996  11.612   0.452
 1124   HG23  THR 586          HG23      THR 586  61.931  12.054   1.789
 1125    H    PHE 587           HN       PHE 587  61.794  10.000   5.784
 1126    HA   PHE 587           HA       PHE 587  64.559  10.004   6.886
 1127    HB2  PHE 587           HB2      PHE 587  63.660  11.313   8.487
 1128    HB3  PHE 587           HB1      PHE 587  62.120  11.173   7.705
 1129    HD1  PHE 587           HD1      PHE 587  60.363   9.774   8.600
 1130    HD2  PHE 587           HD2      PHE 587  64.299   9.753  10.320
 1131    HE1  PHE 587           HE1      PHE 587  59.507   8.494  10.544
 1132    HE2  PHE 587           HE2      PHE 587  63.443   8.475  12.265
 1133    HZ   PHE 587           HZ       PHE 587  61.047   7.844  12.376
 1134    H    LYS 588           HN       LYS 588  65.455   8.160   7.191
 1135    HA   LYS 588           HA       LYS 588  63.877   5.779   8.047
 1136    HB2  LYS 588           HB2      LYS 588  65.752   6.150   5.972
 1137    HB3  LYS 588           HB1      LYS 588  66.661   5.350   7.210
 1138    HG2  LYS 588           HG2      LYS 588  65.587   3.819   5.528
 1139    HG3  LYS 588           HG1      LYS 588  65.256   3.440   7.202
 1140    HD2  LYS 588           HD2      LYS 588  63.328   3.337   5.435
 1141    HD3  LYS 588           HD1      LYS 588  63.000   4.004   7.016
 1142    HE2  LYS 588           HE2      LYS 588  62.697   6.133   6.173
 1143    HE3  LYS 588           HE1      LYS 588  63.897   5.927   4.924
 1144    HZ1  LYS 588           HZ1      LYS 588  61.185   5.755   4.633
 1145    HZ2  LYS 588           HZ2      LYS 588  61.732   4.148   4.550
 1146    HZ3  LYS 588           HZ3      LYS 588  62.357   5.318   3.488
 1147    H    GLU 589           HN       GLU 589  65.099   4.386   9.666
 1148    HA   GLU 589           HA       GLU 589  67.071   5.860  11.289
 1149    HB2  GLU 589           HB2      GLU 589  65.194   6.777  12.341
 1150    HB3  GLU 589           HB1      GLU 589  64.259   5.293  12.206
 1151    HG2  GLU 589           HG2      GLU 589  65.525   4.241  13.943
 1152    HG3  GLU 589           HG1      GLU 589  66.761   5.504  13.916
 1153    H    GLN 590           HN       GLN 590  68.008   4.612  12.889
 1154    HA   GLN 590           HA       GLN 590  67.446   1.798  13.224
 1155    HB2  GLN 590           HB2      GLN 590  68.844   2.107  10.994
 1156    HB3  GLN 590           HB1      GLN 590  70.183   2.405  12.084
 1157    HG2  GLN 590           HG2      GLN 590  70.466   0.148  12.208
 1158    HG3  GLN 590           HG1      GLN 590  68.980   0.088  13.141
 1159   HE21  GLN 590          HE21      GLN 590  69.058   0.928   9.667
 1160   HE22  GLN 590          HE22      GLN 590  68.341  -0.505   9.117
 1161    H    ASN 591           HN       ASN 591  68.560   1.103  15.144
 1162    HA   ASN 591           HA       ASN 591  69.379   1.544  17.286
 1163    HB2  ASN 591           HB2      ASN 591  71.650   3.121  16.880
 1164    HB3  ASN 591           HB1      ASN 591  71.614   1.371  16.855
 1165   HD21  ASN 591          HD21      ASN 591  70.545   0.684  14.503
 1166   HD22  ASN 591          HD22      ASN 591  71.367   1.374  13.191
 1167    H    ASP 592           HN       ASP 592  67.517   3.572  15.989
 1168    HA   ASP 592           HA       ASP 592  66.401   5.443  16.886
 1169    HB2  ASP 592           HB2      ASP 592  68.698   6.020  18.737
 1170    HB3  ASP 592           HB1      ASP 592  66.978   6.329  18.968
 1171    H    LYS 593           HN       LYS 593  69.408   5.439  15.424
 1172    HA   LYS 593           HA       LYS 593  69.788   8.343  15.408
 1173    HB2  LYS 593           HB2      LYS 593  71.185   6.128  13.925
 1174    HB3  LYS 593           HB1      LYS 593  71.727   7.796  14.037
 1175    HG2  LYS 593           HG2      LYS 593  71.520   7.306  16.658
 1176    HG3  LYS 593           HG1      LYS 593  71.737   5.642  16.123
 1177    HD2  LYS 593           HD2      LYS 593  73.792   6.320  14.899
 1178    HD3  LYS 593           HD1      LYS 593  73.591   7.961  15.512
 1179    HE2  LYS 593           HE2      LYS 593  73.730   5.597  17.386
 1180    HE3  LYS 593           HE1      LYS 593  75.195   6.390  16.801
 1181    HZ1  LYS 593           HZ1      LYS 593  74.757   7.570  18.698
 1182    HZ2  LYS 593           HZ2      LYS 593  73.070   7.449  18.534
 1183    HZ3  LYS 593           HZ3      LYS 593  73.948   8.523  17.552
 1184    HA   PRO 594           HA       PRO 594  66.893   8.550  11.826
 1185    HB2  PRO 594           HB2      PRO 594  68.231  11.188  11.474
 1186    HB3  PRO 594           HB1      PRO 594  66.513  10.811  11.572
 1187    HG2  PRO 594           HG2      PRO 594  67.891  12.002  13.596
 1188    HG3  PRO 594           HG1      PRO 594  66.490  10.957  13.877
 1189    HD2  PRO 594           HD2      PRO 594  69.367  10.404  14.402
 1190    HD3  PRO 594           HD1      PRO 594  67.924   9.647  15.120
 1191    H    TYR 595           HN       TYR 595  67.196   8.778   9.445
 1192    HA   TYR 595           HA       TYR 595  69.866   9.101   8.328
 1193    HB2  TYR 595           HB2      TYR 595  68.693   6.308   8.356
 1194    HB3  TYR 595           HB1      TYR 595  70.074   6.817   7.398
 1195    HD1  TYR 595           HD1      TYR 595  69.099   5.271  10.399
 1196    HD2  TYR 595           HD2      TYR 595  72.048   7.938   8.786
 1197    HE1  TYR 595           HE1      TYR 595  70.641   4.663  12.225
 1198    HE2  TYR 595           HE2      TYR 595  73.596   7.316  10.624
 1199    HH   TYR 595           HH       TYR 595  73.881   6.131  12.464
 1200    H    CYS 596           HN       CYS 596  69.699   9.390   6.070
 1201    HA   CYS 596           HA       CYS 596  67.022   9.486   4.906
 1202    HB2  CYS 596           HB2      CYS 596  69.561   9.265   3.272
 1203    HB3  CYS 596           HB1      CYS 596  68.074  10.115   2.878
 1204    H    GLN 597           HN       GLN 597  66.280   7.847   3.285
 1205    HA   GLN 597           HA       GLN 597  66.873   5.199   4.150
 1206    HB2  GLN 597           HB2      GLN 597  64.843   5.266   3.011
 1207    HB3  GLN 597           HB1      GLN 597  65.423   6.426   1.852
 1208    HG2  GLN 597           HG2      GLN 597  65.206   4.518   0.528
 1209    HG3  GLN 597           HG1      GLN 597  66.887   4.412   0.998
 1210   HE21  GLN 597          HE21      GLN 597  66.087   3.695   3.823
 1211   HE22  GLN 597          HE22      GLN 597  65.611   2.084   3.746
 1212    H    ASN 598           HN       ASN 598  67.839   6.885   1.175
 1213    HA   ASN 598           HA       ASN 598  69.690   5.066   0.167
 1214    HB2  ASN 598           HB2      ASN 598  70.353   7.997   0.170
 1215    HB3  ASN 598           HB1      ASN 598  70.488   6.826  -1.138
 1216   HD21  ASN 598          HD21      ASN 598  68.031   5.708  -1.299
 1217   HD22  ASN 598          HD22      ASN 598  66.847   6.874  -1.619
 1218    H    CYS 599           HN       CYS 599  69.980   7.070   3.005
 1219    HA   CYS 599           HA       CYS 599  72.863   6.832   3.177
 1220    HB2  CYS 599           HB2      CYS 599  70.706   8.013   4.851
 1221    HB3  CYS 599           HB1      CYS 599  72.166   7.536   5.704
 1222    H    PHE 600           HN       PHE 600  70.345   5.517   5.426
 1223    HA   PHE 600           HA       PHE 600  72.276   3.647   6.456
 1224    HB2  PHE 600           HB2      PHE 600  69.954   4.545   7.478
 1225    HB3  PHE 600           HB1      PHE 600  69.381   3.009   6.844
 1226    HD1  PHE 600           HD1      PHE 600  71.944   4.580   9.041
 1227    HD2  PHE 600           HD2      PHE 600  69.964   0.955   7.903
 1228    HE1  PHE 600           HE1      PHE 600  72.994   3.416  10.952
 1229    HE2  PHE 600           HE2      PHE 600  71.033  -0.222   9.816
 1230    HZ   PHE 600           HZ       PHE 600  72.544   1.011  11.340
 1231    H    LEU 601           HN       LEU 601  69.641   3.251   4.047
 1232    HA   LEU 601           HA       LEU 601  69.796   0.445   3.839
 1233    HB2  LEU 601           HB2      LEU 601  68.296   0.819   2.167
 1234    HB3  LEU 601           HB1      LEU 601  68.582   2.533   2.346
 1235    HG   LEU 601           HG       LEU 601  70.468   2.339   0.701
 1236   HD11  LEU 601          HD11      LEU 601  71.263   0.279   0.209
 1237   HD12  LEU 601          HD12      LEU 601  69.764  -0.069  -0.645
 1238   HD13  LEU 601          HD13      LEU 601  69.930  -0.502   1.055
 1239   HD21  LEU 601          HD21      LEU 601  68.876   1.838  -1.273
 1240   HD22  LEU 601          HD22      LEU 601  68.430   3.146  -0.182
 1241   HD23  LEU 601          HD23      LEU 601  67.643   1.576  -0.040
 1242    H    LYS 602           HN       LYS 602  71.823   2.949   2.383
 1243    HA   LYS 602           HA       LYS 602  73.526   1.297   0.853
 1244    HB2  LYS 602           HB2      LYS 602  73.664   3.723   0.732
 1245    HB3  LYS 602           HB1      LYS 602  74.154   3.810   2.420
 1246    HG2  LYS 602           HG2      LYS 602  76.068   4.042   0.909
 1247    HG3  LYS 602           HG1      LYS 602  76.213   2.583   1.882
 1248    HD2  LYS 602           HD2      LYS 602  75.721   1.169   0.080
 1249    HD3  LYS 602           HD1      LYS 602  74.908   2.445  -0.829
 1250    HE2  LYS 602           HE2      LYS 602  77.881   2.401  -0.241
 1251    HE3  LYS 602           HE1      LYS 602  77.152   1.857  -1.746
 1252    HZ1  LYS 602           HZ1      LYS 602  77.908   4.146  -1.905
 1253    HZ2  LYS 602           HZ2      LYS 602  76.902   4.584  -0.607
 1254    HZ3  LYS 602           HZ3      LYS 602  76.223   4.052  -2.071
 1255    H    LEU 603           HN       LEU 603  73.225   1.716   4.289
 1256    HA   LEU 603           HA       LEU 603  75.774   0.296   4.817
 1257    HB2  LEU 603           HB2      LEU 603  73.814   1.241   6.894
 1258    HB3  LEU 603           HB1      LEU 603  75.559   1.020   7.045
 1259    HG   LEU 603           HG       LEU 603  74.171   3.103   5.349
 1260   HD11  LEU 603          HD11      LEU 603  75.976   3.541   7.720
 1261   HD12  LEU 603          HD12      LEU 603  74.226   3.393   7.892
 1262   HD13  LEU 603          HD13      LEU 603  74.911   4.705   6.933
 1263   HD21  LEU 603          HD21      LEU 603  76.170   2.516   4.217
 1264   HD22  LEU 603          HD22      LEU 603  77.066   2.373   5.724
 1265   HD23  LEU 603          HD23      LEU 603  76.571   3.960   5.143
 1266    H    PHE 604           HN       PHE 604  72.362  -0.111   5.928
 1267    HA   PHE 604           HA       PHE 604  72.983  -2.998   6.395
 1268    HB2  PHE 604           HB2      PHE 604  70.903  -1.109   7.517
 1269    HB3  PHE 604           HB1      PHE 604  70.582  -2.839   7.507
 1270    HD1  PHE 604           HD1      PHE 604  73.371  -0.456   8.406
 1271    HD2  PHE 604           HD2      PHE 604  71.306  -4.119   9.321
 1272    HE1  PHE 604           HE1      PHE 604  74.800  -0.768  10.403
 1273    HE2  PHE 604           HE2      PHE 604  72.738  -4.420  11.320
 1274    HZ   PHE 604           HZ       PHE 604  74.483  -2.747  11.861
 1275    H    CYS 605           HN       CYS 605  72.551  -1.953   3.678
 1276    HA   CYS 605           HA       CYS 605  70.043  -2.301   2.549
 1277    HB2  CYS 605           HB2      CYS 605  71.851  -1.811   1.065
 1278    HB3  CYS 605           HB1      CYS 605  72.745  -3.245   1.563
 1279    HG   CYS 605           HG       CYS 605  71.560  -3.787  -0.713
  Start of MODEL    9
    1    H    MET   1           HT1      MET   1  96.509 -20.819   6.554
    2    HA   MET   1           HA       MET   1  94.015 -21.376   7.328
    3    HB2  MET   1           HB2      MET   1  95.842 -22.897   6.471
    4    HB3  MET   1           HB1      MET   1  96.456 -22.993   8.119
    5    HG2  MET   1           HG2      MET   1  94.049 -23.698   8.766
    6    HG3  MET   1           HG1      MET   1  93.811 -23.971   7.042
    7    HE1  MET   1           HE1      MET   1  94.135 -26.044   5.989
    8    HE2  MET   1           HE2      MET   1  95.589 -27.031   6.117
    9    HE3  MET   1           HE3      MET   1  95.716 -25.349   5.607
   10    H    ALA   2           HN       ALA   2  95.797 -22.939   9.747
   11    HA   ALA   2           HA       ALA   2  95.082 -20.995  11.873
   12    HB1  ALA   2           HB1      ALA   2  94.129 -23.866  11.975
   13    HB2  ALA   2           HB2      ALA   2  93.099 -22.538  11.441
   14    HB3  ALA   2           HB3      ALA   2  93.725 -22.559  13.089
   15    H    LEU   3           HN       LEU   3  96.123 -24.352  11.348
   16    HA   LEU   3           HA       LEU   3  97.681 -24.846  13.567
   17    HB2  LEU   3           HB2      LEU   3  98.152 -25.479  10.654
   18    HB3  LEU   3           HB1      LEU   3  99.211 -26.107  11.915
   19    HG   LEU   3           HG       LEU   3  96.203 -26.484  11.888
   20   HD11  LEU   3          HD11      LEU   3  96.878 -28.882  11.259
   21   HD12  LEU   3          HD12      LEU   3  98.448 -28.204  10.825
   22   HD13  LEU   3          HD13      LEU   3  96.992 -27.667   9.986
   23   HD21  LEU   3          HD21      LEU   3  96.800 -26.893  14.089
   24   HD22  LEU   3          HD22      LEU   3  98.446 -27.370  13.679
   25   HD23  LEU   3          HD23      LEU   3  97.111 -28.490  13.418
   26    H    ASP   4           HN       ASP   4  99.342 -24.063  10.624
   27    HA   ASP   4           HA       ASP   4 101.192 -22.794  10.145
   28    HB2  ASP   4           HB2      ASP   4  99.865 -20.867  10.616
   29    HB3  ASP   4           HB1      ASP   4  99.996 -21.125  12.348
   30    H    GLY   5           HN       GLY   5 100.812 -24.434  13.000
   31    HA2  GLY   5           HA2      GLY   5 102.832 -25.690  13.765
   32    HA3  GLY   5           HA1      GLY   5 103.714 -24.170  13.645
   33    H    ILE   6           HN       ILE   6 101.002 -23.039  14.590
   34    HA   ILE   6           HA       ILE   6 101.519 -23.399  17.524
   35    HB   ILE   6           HB       ILE   6 100.229 -20.961  17.311
   36   HG12  ILE   6          HG12      ILE   6 100.472 -21.325  14.743
   37   HG13  ILE   6          HG11      ILE   6 100.932 -19.774  15.405
   38   HG21  ILE   6          HG21      ILE   6 102.577 -19.981  17.430
   39   HG22  ILE   6          HG22      ILE   6 103.155 -21.643  17.311
   40   HG23  ILE   6          HG23      ILE   6 102.138 -21.158  18.668
   41   HD11  ILE   6          HD11      ILE   6 103.137 -20.058  14.896
   42   HD12  ILE   6          HD12      ILE   6 102.517 -21.238  13.746
   43   HD13  ILE   6          HD13      ILE   6 103.127 -21.772  15.305
   44    H    ARG   7           HN       ARG   7  98.742 -21.536  16.668
   45    HA   ARG   7           HA       ARG   7  96.934 -23.838  16.637
   46    HB2  ARG   7           HB2      ARG   7  95.690 -22.878  18.650
   47    HB3  ARG   7           HB1      ARG   7  97.193 -23.722  18.972
   48    HG2  ARG   7           HG2      ARG   7  97.464 -20.788  18.509
   49    HG3  ARG   7           HG1      ARG   7  96.621 -21.257  19.982
   50    HD2  ARG   7           HD2      ARG   7  98.536 -22.702  20.602
   51    HD3  ARG   7           HD1      ARG   7  99.378 -22.168  19.154
   52    HE   ARG   7           HE       ARG   7  99.835 -20.112  20.226
   53   HH11  ARG   7          HH11      ARG   7  99.792 -18.750  22.028
   54   HH12  ARG   7          HH12      ARG   7  98.708 -19.097  23.334
   55   HH21  ARG   7          HH21      ARG   7  97.396 -21.937  21.839
   56   HH22  ARG   7          HH22      ARG   7  97.351 -20.901  23.226
   57    H    MET   8           HN       MET   8  95.806 -20.793  17.930
   58    HA   MET   8           HA       MET   8  94.985 -19.888  15.223
   59    HB2  MET   8           HB2      MET   8  92.666 -19.566  16.893
   60    HB3  MET   8           HB1      MET   8  92.836 -20.537  15.445
   61    HG2  MET   8           HG2      MET   8  93.681 -22.423  16.714
   62    HG3  MET   8           HG1      MET   8  93.667 -21.505  18.206
   63    HE1  MET   8           HE1      MET   8  91.092 -19.985  18.580
   64    HE2  MET   8           HE2      MET   8  91.879 -21.132  19.662
   65    HE3  MET   8           HE3      MET   8  90.151 -21.270  19.349
   66    HA   PRO   9           HA       PRO   9  94.277 -16.132  18.358
   67    HB2  PRO   9           HB2      PRO   9  96.127 -17.313  20.424
   68    HB3  PRO   9           HB1      PRO   9  94.831 -16.114  20.642
   69    HG2  PRO   9           HG2      PRO   9  94.396 -18.616  21.290
   70    HG3  PRO   9           HG1      PRO   9  93.165 -17.700  20.395
   71    HD2  PRO   9           HD2      PRO   9  94.998 -19.833  19.380
   72    HD3  PRO   9           HD1      PRO   9  93.347 -19.449  18.921
   73    H    ASP  10           HN       ASP  10  97.085 -18.161  18.184
   74    HA   ASP  10           HA       ASP  10  98.788 -15.855  17.282
   75    HB2  ASP  10           HB2      ASP  10  99.463 -17.256  19.359
   76    HB3  ASP  10           HB1      ASP  10  99.821 -18.543  18.209
   77    H    GLY  11           HN       GLY  11  97.432 -18.939  16.555
   78    HA2  GLY  11           HA2      GLY  11  99.045 -19.314  14.116
   79    HA3  GLY  11           HA1      GLY  11  97.781 -20.385  14.709
   80    H    CYS  12           HN       CYS  12  96.732 -17.187  14.805
   81    HA   CYS  12           HA       CYS  12  95.776 -17.071  12.029
   82    HB2  CYS  12           HB2      CYS  12  94.171 -18.616  13.100
   83    HB3  CYS  12           HB1      CYS  12  93.827 -17.394  14.324
   84    HG   CYS  12           HG       CYS  12  93.184 -16.958  11.289
   85    H    TYR  13           HN       TYR  13  94.540 -15.718  15.119
   86    HA   TYR  13           HA       TYR  13  95.685 -13.089  14.525
   87    HB2  TYR  13           HB2      TYR  13  92.790 -13.734  13.980
   88    HB3  TYR  13           HB1      TYR  13  93.215 -12.110  14.520
   89    HD1  TYR  13           HD1      TYR  13  92.785 -14.142  11.673
   90    HD2  TYR  13           HD2      TYR  13  95.348 -11.077  13.255
   91    HE1  TYR  13           HE1      TYR  13  93.504 -13.556   9.374
   92    HE2  TYR  13           HE2      TYR  13  96.066 -10.493  10.955
   93    HH   TYR  13           HH       TYR  13  94.461 -11.346   8.257
   94    H    ALA  14           HN       ALA  14  92.584 -13.615  16.063
   95    HA   ALA  14           HA       ALA  14  93.506 -13.999  18.752
   96    HB1  ALA  14           HB1      ALA  14  94.336 -11.684  18.470
   97    HB2  ALA  14           HB2      ALA  14  93.013 -11.742  19.634
   98    HB3  ALA  14           HB3      ALA  14  92.719 -11.169  17.992
   99    H    ASP  15           HN       ASP  15  91.131 -12.696  16.561
  100    HA   ASP  15           HA       ASP  15  89.029 -14.289  17.864
  101    HB2  ASP  15           HB2      ASP  15  89.074 -12.003  18.987
  102    HB3  ASP  15           HB1      ASP  15  88.642 -11.322  17.417
  103    H    GLY  16           HN       GLY  16  90.613 -13.454  15.210
  104    HA2  GLY  16           HA2      GLY  16  90.112 -13.887  12.938
  105    HA3  GLY  16           HA1      GLY  16  88.438 -14.194  13.404
  106    H    THR  17           HN       THR  17  89.609 -11.338  14.748
  107    HA   THR  17           HA       THR  17  88.064  -9.760  12.736
  108    HB   THR  17           HB       THR  17  87.481  -9.745  15.247
  109    HG1  THR  17           HG1      THR  17  86.549  -8.199  14.110
  110   HG21  THR  17          HG21      THR  17  89.720  -7.739  15.425
  111   HG22  THR  17          HG22      THR  17  89.979  -9.431  15.853
  112   HG23  THR  17          HG23      THR  17  88.790  -8.470  16.733
  113    H    TRP  18           HN       TRP  18  89.179  -8.589  11.357
  114    HA   TRP  18           HA       TRP  18  91.928  -7.646  12.084
  115    HB2  TRP  18           HB2      TRP  18  92.148  -7.597   9.473
  116    HB3  TRP  18           HB1      TRP  18  92.379  -9.110  10.326
  117    HD1  TRP  18           HD1      TRP  18  89.856 -10.570  10.539
  118    HE1  TRP  18           HE1      TRP  18  88.257 -11.026   8.535
  119    HE3  TRP  18           HE3      TRP  18  91.283  -6.865   7.355
  120    HZ2  TRP  18           HZ2      TRP  18  87.726  -9.998   5.976
  121    HZ3  TRP  18           HZ3      TRP  18  90.215  -6.659   5.144
  122    HH2  TRP  18           HH2      TRP  18  88.429  -8.191   4.456
  123    H    GLU  19           HN       GLU  19  92.143  -5.482  12.098
  124    HA   GLU  19           HA       GLU  19  89.862  -3.825  11.363
  125    HB2  GLU  19           HB2      GLU  19  91.896  -2.024  11.936
  126    HB3  GLU  19           HB1      GLU  19  90.775  -2.684  13.119
  127    HG2  GLU  19           HG2      GLU  19  93.173  -2.937  13.773
  128    HG3  GLU  19           HG1      GLU  19  92.299  -4.466  13.660
  129    H    LEU  20           HN       LEU  20  89.632  -2.558   9.573
  130    HA   LEU  20           HA       LEU  20  91.584  -2.952   7.413
  131    HB2  LEU  20           HB2      LEU  20  88.798  -2.490   7.514
  132    HB3  LEU  20           HB1      LEU  20  89.444  -0.997   6.864
  133    HG   LEU  20           HG       LEU  20  88.998  -2.326   4.968
  134   HD11  LEU  20          HD11      LEU  20  91.865  -3.163   5.234
  135   HD12  LEU  20          HD12      LEU  20  91.490  -1.439   5.270
  136   HD13  LEU  20          HD13      LEU  20  91.023  -2.426   3.882
  137   HD21  LEU  20          HD21      LEU  20  88.783  -4.456   6.377
  138   HD22  LEU  20          HD22      LEU  20  90.522  -4.647   6.125
  139   HD23  LEU  20          HD23      LEU  20  89.420  -4.621   4.744
  140    H    SER  21           HN       SER  21  93.111  -1.378   6.866
  141    HA   SER  21           HA       SER  21  93.338   0.930   8.654
  142    HB2  SER  21           HB2      SER  21  95.217  -0.490   7.375
  143    HB3  SER  21           HB1      SER  21  94.950   0.741   6.145
  144    HG   SER  21           HG       SER  21  96.351   0.931   8.379
  145    H    VAL  22           HN       VAL  22  92.993   3.092   8.072
  146    HA   VAL  22           HA       VAL  22  91.878   3.600   5.369
  147    HB   VAL  22           HB       VAL  22  90.444   4.074   7.980
  148   HG11  VAL  22          HG11      VAL  22  88.804   5.408   6.579
  149   HG12  VAL  22          HG12      VAL  22  90.045   5.497   5.328
  150   HG13  VAL  22          HG13      VAL  22  90.322   6.236   6.910
  151   HG21  VAL  22          HG21      VAL  22  89.635   2.960   5.281
  152   HG22  VAL  22          HG22      VAL  22  88.583   3.079   6.694
  153   HG23  VAL  22          HG23      VAL  22  89.985   2.004   6.728
  154    H    HIS  23           HN       HIS  23  93.044   5.164   4.542
  155    HA   HIS  23           HA       HIS  23  94.377   7.161   6.267
  156    HB2  HIS  23           HB2      HIS  23  94.466   6.379   3.358
  157    HB3  HIS  23           HB1      HIS  23  95.137   7.929   3.867
  158    HD1  HIS  23           HD1      HIS  23  97.405   7.900   5.001
  159    HD2  HIS  23           HD2      HIS  23  95.784   4.078   4.610
  160    HE1  HIS  23           HE1      HIS  23  99.224   6.276   5.687
  161    H    VAL  24           HN       VAL  24  92.854   8.673   6.956
  162    HA   VAL  24           HA       VAL  24  90.641   9.472   5.283
  163    HB   VAL  24           HB       VAL  24  91.644  11.278   7.476
  164   HG11  VAL  24          HG11      VAL  24  89.462  11.593   6.201
  165   HG12  VAL  24          HG12      VAL  24  89.289  11.490   7.956
  166   HG13  VAL  24          HG13      VAL  24  88.907  10.097   6.952
  167   HG21  VAL  24          HG21      VAL  24  92.086   9.158   8.508
  168   HG22  VAL  24          HG22      VAL  24  90.610   8.453   7.845
  169   HG23  VAL  24          HG23      VAL  24  90.514   9.671   9.119
  170    H    THR  25           HN       THR  25  91.078  10.467   3.369
  171    HA   THR  25           HA       THR  25  93.488  12.029   2.969
  172    HB   THR  25           HB       THR  25  92.858  12.129   0.723
  173    HG1  THR  25           HG1      THR  25  90.916  12.670   0.147
  174   HG21  THR  25          HG21      THR  25  91.180   9.809   1.688
  175   HG22  THR  25          HG22      THR  25  92.941   9.761   1.625
  176   HG23  THR  25          HG23      THR  25  92.009   9.956   0.138
  177    H    ASP  26           HN       ASP  26  90.020  12.955   2.864
  178    HA   ASP  26           HA       ASP  26  90.470  15.748   2.656
  179    HB2  ASP  26           HB2      ASP  26  88.259  14.716   2.311
  180    HB3  ASP  26           HB1      ASP  26  88.181  14.303   4.025
  181    H    LEU  27           HN       LEU  27  91.531  13.807   5.090
  182    HA   LEU  27           HA       LEU  27  91.563  16.065   7.050
  183    HB2  LEU  27           HB2      LEU  27  90.447  13.362   7.325
  184    HB3  LEU  27           HB1      LEU  27  91.540  13.766   8.634
  185    HG   LEU  27           HG       LEU  27  89.368  15.685   7.772
  186   HD11  LEU  27          HD11      LEU  27  88.133  13.691   8.240
  187   HD12  LEU  27          HD12      LEU  27  88.035  14.678   9.699
  188   HD13  LEU  27          HD13      LEU  27  89.148  13.308   9.631
  189   HD21  LEU  27          HD21      LEU  27  89.715  16.666   9.899
  190   HD22  LEU  27          HD22      LEU  27  91.345  16.252   9.362
  191   HD23  LEU  27          HD23      LEU  27  90.515  15.226  10.531
  192    H    ASN  28           HN       ASN  28  93.122  13.334   5.579
  193    HA   ASN  28           HA       ASN  28  95.401  12.831   5.391
  194    HB2  ASN  28           HB2      ASN  28  95.668  15.394   5.725
  195    HB3  ASN  28           HB1      ASN  28  96.091  14.994   7.384
  196   HD21  ASN  28          HD21      ASN  28  97.181  12.335   6.278
  197   HD22  ASN  28          HD22      ASN  28  98.722  12.743   5.706
  198    H    ARG  29           HN       ARG  29  93.467  12.159   7.805
  199    HA   ARG  29           HA       ARG  29  95.499  11.384   9.796
  200    HB2  ARG  29           HB2      ARG  29  92.492  11.108   9.741
  201    HB3  ARG  29           HB1      ARG  29  93.521  10.595  11.080
  202    HG2  ARG  29           HG2      ARG  29  94.326  12.875  11.377
  203    HG3  ARG  29           HG1      ARG  29  93.388  13.413   9.992
  204    HD2  ARG  29           HD2      ARG  29  92.011  13.965  11.831
  205    HD3  ARG  29           HD1      ARG  29  91.346  12.437  11.248
  206    HE   ARG  29           HE       ARG  29  93.369  12.006  13.276
  207   HH11  ARG  29          HH11      ARG  29  92.629  11.268  15.280
  208   HH12  ARG  29          HH12      ARG  29  90.951  11.424  15.681
  209   HH21  ARG  29          HH21      ARG  29  90.099  12.916  12.669
  210   HH22  ARG  29          HH22      ARG  29  89.519  12.358  14.203
  211    H    ASP  30           HN       ASP  30  94.814   9.116  10.747
  212    HA   ASP  30           HA       ASP  30  94.366   7.146   8.575
  213    HB2  ASP  30           HB2      ASP  30  96.665   7.154  10.548
  214    HB3  ASP  30           HB1      ASP  30  96.171   5.726   9.636
  215    H    VAL  31           HN       VAL  31  92.691   5.949   9.216
  216    HA   VAL  31           HA       VAL  31  92.341   5.424  12.154
  217    HB   VAL  31           HB       VAL  31  90.144   5.686  10.085
  218   HG11  VAL  31          HG11      VAL  31  88.784   5.914  12.219
  219   HG12  VAL  31          HG12      VAL  31  90.225   5.418  13.101
  220   HG13  VAL  31          HG13      VAL  31  89.480   4.317  11.943
  221   HG21  VAL  31          HG21      VAL  31  89.696   7.886  11.156
  222   HG22  VAL  31          HG22      VAL  31  91.294   7.856  10.410
  223   HG23  VAL  31          HG23      VAL  31  91.133   7.685  12.158
  224    H    THR  32           HN       THR  32  91.315   3.426  12.674
  225    HA   THR  32           HA       THR  32  91.423   1.328  10.549
  226    HB   THR  32           HB       THR  32  92.210   0.139  13.037
  227    HG1  THR  32           HG1      THR  32  94.097   2.079  12.506
  228   HG21  THR  32          HG21      THR  32  92.929  -0.393  10.615
  229   HG22  THR  32          HG22      THR  32  94.157  -0.531  11.871
  230   HG23  THR  32          HG23      THR  32  94.123   0.890  10.828
  231    H    LEU  33           HN       LEU  33  89.649   0.012  10.604
  232    HA   LEU  33           HA       LEU  33  87.748   0.300  12.903
  233    HB2  LEU  33           HB2      LEU  33  87.426   0.097   9.933
  234    HB3  LEU  33           HB1      LEU  33  86.152  -0.561  10.941
  235    HG   LEU  33           HG       LEU  33  85.828   1.849  10.229
  236   HD11  LEU  33          HD11      LEU  33  86.038   1.826  13.228
  237   HD12  LEU  33          HD12      LEU  33  84.958   0.671  12.445
  238   HD13  LEU  33          HD13      LEU  33  84.734   2.398  12.191
  239   HD21  LEU  33          HD21      LEU  33  87.902   2.522  12.306
  240   HD22  LEU  33          HD22      LEU  33  87.199   3.558  11.081
  241   HD23  LEU  33          HD23      LEU  33  88.358   2.316  10.618
  242    H    ARG  34           HN       ARG  34  87.860  -1.491  14.136
  243    HA   ARG  34           HA       ARG  34  88.873  -4.017  13.411
  244    HB2  ARG  34           HB2      ARG  34  88.116  -2.893  15.755
  245    HB3  ARG  34           HB1      ARG  34  86.686  -3.839  15.445
  246    HG2  ARG  34           HG2      ARG  34  88.188  -5.169  16.757
  247    HG3  ARG  34           HG1      ARG  34  88.071  -5.849  15.132
  248    HD2  ARG  34           HD2      ARG  34  90.423  -5.245  16.398
  249    HD3  ARG  34           HD1      ARG  34  90.245  -5.441  14.674
  250    HE   ARG  34           HE       ARG  34  89.703  -2.819  14.906
  251   HH11  ARG  34          HH11      ARG  34  91.157  -1.116  15.146
  252   HH12  ARG  34          HH12      ARG  34  92.695  -1.401  15.889
  253   HH21  ARG  34          HH21      ARG  34  92.123  -4.775  16.422
  254   HH22  ARG  34          HH22      ARG  34  93.238  -3.465  16.611
  255    H    VAL  35           HN       VAL  35  88.010  -5.264  11.820
  256    HA   VAL  35           HA       VAL  35  85.053  -5.685  11.776
  257    HB   VAL  35           HB       VAL  35  85.178  -5.597   9.257
  258   HG11  VAL  35          HG11      VAL  35  84.215  -3.742  10.524
  259   HG12  VAL  35          HG12      VAL  35  85.169  -3.096   9.189
  260   HG13  VAL  35          HG13      VAL  35  85.823  -3.081  10.829
  261   HG21  VAL  35          HG21      VAL  35  87.076  -4.291   8.310
  262   HG22  VAL  35          HG22      VAL  35  87.592  -5.831   8.995
  263   HG23  VAL  35          HG23      VAL  35  87.862  -4.336   9.886
  264    H    THR  36           HN       THR  36  84.816  -7.329   9.700
  265    HA   THR  36           HA       THR  36  86.830  -9.492   9.899
  266    HB   THR  36           HB       THR  36  84.842 -11.110  10.130
  267    HG1  THR  36           HG1      THR  36  83.373  -9.232   9.755
  268   HG21  THR  36          HG21      THR  36  86.212 -11.003  12.028
  269   HG22  THR  36          HG22      THR  36  84.623 -10.590  12.663
  270   HG23  THR  36          HG23      THR  36  85.800  -9.320  12.350
  271    H    GLY  37           HN       GLY  37  86.015 -11.244   8.195
  272    HA2  GLY  37           HA2      GLY  37  85.498  -9.759   5.734
  273    HA3  GLY  37           HA1      GLY  37  85.857 -11.480   5.852
  274    H    GLU  38           HN       GLU  38  83.386  -9.555   7.459
  275    HA   GLU  38           HA       GLU  38  81.258 -10.836   5.841
  276    HB2  GLU  38           HB2      GLU  38  79.991 -11.366   7.961
  277    HB3  GLU  38           HB1      GLU  38  81.410 -12.373   7.681
  278    HG2  GLU  38           HG2      GLU  38  82.676 -11.283   9.323
  279    HG3  GLU  38           HG1      GLU  38  81.639  -9.857   9.320
  280    H    VAL  39           HN       VAL  39  82.600  -8.084   6.997
  281    HA   VAL  39           HA       VAL  39  80.081  -6.768   7.788
  282    HB   VAL  39           HB       VAL  39  81.377  -4.928   8.442
  283   HG11  VAL  39          HG11      VAL  39  81.745  -7.113   9.682
  284   HG12  VAL  39          HG12      VAL  39  82.981  -5.879   9.912
  285   HG13  VAL  39          HG13      VAL  39  83.276  -7.233   8.817
  286   HG21  VAL  39          HG21      VAL  39  83.767  -4.636   7.774
  287   HG22  VAL  39          HG22      VAL  39  82.678  -4.539   6.404
  288   HG23  VAL  39          HG23      VAL  39  83.605  -6.017   6.694
  289    H    HIS  40           HN       HIS  40  78.932  -5.405   6.471
  290    HA   HIS  40           HA       HIS  40  79.550  -5.460   3.619
  291    HB2  HIS  40           HB2      HIS  40  77.516  -3.548   4.734
  292    HB3  HIS  40           HB1      HIS  40  77.430  -4.573   3.300
  293    HD1  HIS  40           HD1      HIS  40  78.010  -7.321   4.504
  294    HD2  HIS  40           HD2      HIS  40  75.450  -4.555   6.286
  295    HE1  HIS  40           HE1      HIS  40  76.464  -8.644   6.013
  296    H    ILE  41           HN       ILE  41  80.411  -3.738   2.389
  297    HA   ILE  41           HA       ILE  41  82.307  -2.026   3.495
  298    HB   ILE  41           HB       ILE  41  80.580  -1.224   1.146
  299   HG12  ILE  41          HG12      ILE  41  82.995  -3.072   1.186
  300   HG13  ILE  41          HG11      ILE  41  81.330  -3.563   0.871
  301   HG21  ILE  41          HG21      ILE  41  82.210   0.434   2.043
  302   HG22  ILE  41          HG22      ILE  41  82.613  -0.093   0.410
  303   HG23  ILE  41          HG23      ILE  41  83.503  -0.738   1.788
  304   HD11  ILE  41          HD11      ILE  41  81.501  -1.618  -0.972
  305   HD12  ILE  41          HD12      ILE  41  82.030  -3.268  -1.301
  306   HD13  ILE  41          HD13      ILE  41  83.214  -2.040  -0.870
  307    H    GLY  42           HN       GLY  42  79.014  -1.023   2.562
  308    HA2  GLY  42           HA2      GLY  42  79.081   1.558   3.675
  309    HA3  GLY  42           HA1      GLY  42  77.611   0.611   3.495
  310    H    GLY  43           HN       GLY  43  79.233  -1.460   5.156
  311    HA2  GLY  43           HA2      GLY  43  78.020  -0.767   7.708
  312    HA3  GLY  43           HA1      GLY  43  79.064  -2.158   7.394
  313    H    VAL  44           HN       VAL  44  81.136  -0.447   6.215
  314    HA   VAL  44           HA       VAL  44  82.529   0.314   8.693
  315    HB   VAL  44           HB       VAL  44  83.257   0.026   5.773
  316   HG11  VAL  44          HG11      VAL  44  84.380   2.080   6.281
  317   HG12  VAL  44          HG12      VAL  44  85.595   0.817   6.477
  318   HG13  VAL  44          HG13      VAL  44  84.821   1.523   7.896
  319   HG21  VAL  44          HG21      VAL  44  84.645  -1.003   8.259
  320   HG22  VAL  44          HG22      VAL  44  84.826  -1.579   6.602
  321   HG23  VAL  44          HG23      VAL  44  83.322  -1.869   7.476
  322    H    MET  45           HN       MET  45  81.180   1.832   5.789
  323    HA   MET  45           HA       MET  45  82.023   4.480   6.030
  324    HB2  MET  45           HB2      MET  45  79.389   3.236   5.271
  325    HB3  MET  45           HB1      MET  45  79.519   4.989   5.321
  326    HG2  MET  45           HG2      MET  45  81.666   4.532   3.805
  327    HG3  MET  45           HG1      MET  45  80.802   3.050   3.423
  328    HE1  MET  45           HE1      MET  45  78.351   3.044   2.014
  329    HE2  MET  45           HE2      MET  45  77.323   4.460   2.240
  330    HE3  MET  45           HE3      MET  45  77.935   3.609   3.637
  331    H    LEU  46           HN       LEU  46  79.508   2.792   7.868
  332    HA   LEU  46           HA       LEU  46  78.798   5.190   9.364
  333    HB2  LEU  46           HB2      LEU  46  77.587   2.723   8.858
  334    HB3  LEU  46           HB1      LEU  46  77.963   2.631  10.576
  335    HG   LEU  46           HG       LEU  46  76.534   5.000   9.313
  336   HD11  LEU  46          HD11      LEU  46  75.165   2.925  11.009
  337   HD12  LEU  46          HD12      LEU  46  75.308   2.696   9.268
  338   HD13  LEU  46          HD13      LEU  46  74.461   4.107   9.902
  339   HD21  LEU  46          HD21      LEU  46  77.099   4.117  12.151
  340   HD22  LEU  46          HD22      LEU  46  75.884   5.331  11.761
  341   HD23  LEU  46          HD23      LEU  46  77.578   5.623  11.369
  342    H    LYS  47           HN       LYS  47  80.335   2.093  10.425
  343    HA   LYS  47           HA       LYS  47  80.969   2.854  13.029
  344    HB2  LYS  47           HB2      LYS  47  82.881   1.362  11.217
  345    HB3  LYS  47           HB1      LYS  47  82.818   1.303  12.978
  346    HG2  LYS  47           HG2      LYS  47  80.746   0.145  12.977
  347    HG3  LYS  47           HG1      LYS  47  80.467   0.503  11.275
  348    HD2  LYS  47           HD2      LYS  47  82.147  -1.014  10.560
  349    HD3  LYS  47           HD1      LYS  47  82.860  -1.110  12.168
  350    HE2  LYS  47           HE2      LYS  47  80.113  -2.146  11.409
  351    HE3  LYS  47           HE1      LYS  47  81.556  -3.140  11.628
  352    HZ1  LYS  47           HZ1      LYS  47  81.637  -1.962  13.917
  353    HZ2  LYS  47           HZ2      LYS  47  80.571  -3.265  13.682
  354    HZ3  LYS  47           HZ3      LYS  47  79.990  -1.669  13.638
  355    H    LEU  48           HN       LEU  48  83.202   3.251  10.253
  356    HA   LEU  48           HA       LEU  48  85.207   4.707  11.478
  357    HB2  LEU  48           HB2      LEU  48  85.422   4.060   9.168
  358    HB3  LEU  48           HB1      LEU  48  84.014   5.005   8.709
  359    HG   LEU  48           HG       LEU  48  85.301   7.095   9.331
  360   HD11  LEU  48          HD11      LEU  48  87.612   5.157   9.500
  361   HD12  LEU  48          HD12      LEU  48  86.928   6.047  10.859
  362   HD13  LEU  48          HD13      LEU  48  87.731   6.913   9.552
  363   HD21  LEU  48          HD21      LEU  48  86.720   7.036   7.334
  364   HD22  LEU  48          HD22      LEU  48  85.161   6.273   7.010
  365   HD23  LEU  48          HD23      LEU  48  86.591   5.278   7.290
  366    H    VAL  49           HN       VAL  49  82.063   5.926  10.383
  367    HA   VAL  49           HA       VAL  49  82.701   8.686  11.102
  368    HB   VAL  49           HB       VAL  49  80.078   7.319  10.459
  369   HG11  VAL  49          HG11      VAL  49  80.758  10.231  10.915
  370   HG12  VAL  49          HG12      VAL  49  79.578   9.257  11.794
  371   HG13  VAL  49          HG13      VAL  49  79.284   9.691  10.113
  372   HG21  VAL  49          HG21      VAL  49  80.332   8.229   8.270
  373   HG22  VAL  49          HG22      VAL  49  81.909   7.546   8.668
  374   HG23  VAL  49          HG23      VAL  49  81.647   9.286   8.783
  375    H    GLU  50           HN       GLU  50  80.823   6.025  12.550
  376    HA   GLU  50           HA       GLU  50  79.661   7.283  14.740
  377    HB2  GLU  50           HB2      GLU  50  81.021   4.589  14.567
  378    HB3  GLU  50           HB1      GLU  50  80.122   5.110  15.988
  379    HG2  GLU  50           HG2      GLU  50  78.936   5.109  13.204
  380    HG3  GLU  50           HG1      GLU  50  78.786   3.744  14.312
  381    H    LYS  51           HN       LYS  51  83.023   6.267  14.356
  382    HA   LYS  51           HA       LYS  51  83.797   7.073  17.025
  383    HB2  LYS  51           HB2      LYS  51  85.513   6.614  14.582
  384    HB3  LYS  51           HB1      LYS  51  86.055   6.630  16.262
  385    HG2  LYS  51           HG2      LYS  51  84.347   4.779  16.690
  386    HG3  LYS  51           HG1      LYS  51  84.198   4.653  14.941
  387    HD2  LYS  51           HD2      LYS  51  86.645   4.152  16.638
  388    HD3  LYS  51           HD1      LYS  51  85.800   3.026  15.593
  389    HE2  LYS  51           HE2      LYS  51  87.690   3.634  14.330
  390    HE3  LYS  51           HE1      LYS  51  86.415   4.658  13.673
  391    HZ1  LYS  51           HZ1      LYS  51  88.738   5.611  14.468
  392    HZ2  LYS  51           HZ2      LYS  51  87.914   5.691  15.952
  393    HZ3  LYS  51           HZ3      LYS  51  87.305   6.508  14.593
  394    H    LEU  52           HN       LEU  52  83.759   8.578  13.834
  395    HA   LEU  52           HA       LEU  52  85.250  10.917  14.655
  396    HB2  LEU  52           HB2      LEU  52  84.532   9.784  12.233
  397    HB3  LEU  52           HB1      LEU  52  83.425  11.145  12.317
  398    HG   LEU  52           HG       LEU  52  85.574  12.505  12.982
  399   HD11  LEU  52          HD11      LEU  52  87.651  11.638  12.237
  400   HD12  LEU  52          HD12      LEU  52  86.873  10.322  11.356
  401   HD13  LEU  52          HD13      LEU  52  86.897  10.310  13.119
  402   HD21  LEU  52          HD21      LEU  52  84.322  12.869  10.901
  403   HD22  LEU  52          HD22      LEU  52  85.113  11.475  10.165
  404   HD23  LEU  52          HD23      LEU  52  86.055  12.909  10.573
  405    H    ASP  53           HN       ASP  53  81.902  10.680  13.524
  406    HA   ASP  53           HA       ASP  53  79.981  11.829  14.077
  407    HB2  ASP  53           HB2      ASP  53  81.386  11.537  16.701
  408    HB3  ASP  53           HB1      ASP  53  79.750  12.132  16.544
  409    H    VAL  54           HN       VAL  54  81.232  13.613  12.829
  410    HA   VAL  54           HA       VAL  54  81.335  15.991  14.586
  411    HB   VAL  54           HB       VAL  54  83.464  16.522  14.028
  412   HG11  VAL  54          HG11      VAL  54  83.589  14.306  15.006
  413   HG12  VAL  54          HG12      VAL  54  84.921  14.591  13.889
  414   HG13  VAL  54          HG13      VAL  54  83.556  13.591  13.394
  415   HG21  VAL  54          HG21      VAL  54  84.529  15.591  11.799
  416   HG22  VAL  54          HG22      VAL  54  83.452  16.980  11.751
  417   HG23  VAL  54          HG23      VAL  54  82.841  15.375  11.337
  418    H    LYS  55           HN       LYS  55  79.290  14.991  12.846
  419    HA   LYS  55           HA       LYS  55  77.934  15.668  11.050
  420    HB2  LYS  55           HB2      LYS  55  77.915  17.474  13.013
  421    HB3  LYS  55           HB1      LYS  55  78.602  18.492  11.755
  422    HG2  LYS  55           HG2      LYS  55  76.301  18.833  11.498
  423    HG3  LYS  55           HG1      LYS  55  76.656  17.635  10.277
  424    HD2  LYS  55           HD2      LYS  55  75.713  15.873  11.575
  425    HD3  LYS  55           HD1      LYS  55  75.699  16.856  13.034
  426    HE2  LYS  55           HE2      LYS  55  74.000  18.322  12.078
  427    HE3  LYS  55           HE1      LYS  55  74.057  17.431  10.557
  428    HZ1  LYS  55           HZ1      LYS  55  73.629  15.466  12.324
  429    HZ2  LYS  55           HZ2      LYS  55  72.397  16.265  11.470
  430    HZ3  LYS  55           HZ3      LYS  55  72.780  16.738  13.056
  431    H    LYS  56           HN       LYS  56  80.998  15.584  10.504
  432    HA   LYS  56           HA       LYS  56  81.356  17.669   8.478
  433    HB2  LYS  56           HB2      LYS  56  83.349  16.739   9.512
  434    HB3  LYS  56           HB1      LYS  56  82.905  15.109   9.025
  435    HG2  LYS  56           HG2      LYS  56  83.144  15.789   6.641
  436    HG3  LYS  56           HG1      LYS  56  83.617  17.404   7.168
  437    HD2  LYS  56           HD2      LYS  56  85.071  14.837   7.876
  438    HD3  LYS  56           HD1      LYS  56  85.579  15.975   6.631
  439    HE2  LYS  56           HE2      LYS  56  85.440  17.725   8.627
  440    HE3  LYS  56           HE1      LYS  56  85.647  16.280   9.616
  441    HZ1  LYS  56           HZ1      LYS  56  87.798  16.934   9.200
  442    HZ2  LYS  56           HZ2      LYS  56  87.467  17.429   7.609
  443    HZ3  LYS  56           HZ3      LYS  56  87.549  15.775   7.987
  444    H    ASP  57           HN       ASP  57  81.328  17.307   6.192
  445    HA   ASP  57           HA       ASP  57  79.171  15.818   5.193
  446    HB2  ASP  57           HB2      ASP  57  81.677  16.405   3.605
  447    HB3  ASP  57           HB1      ASP  57  80.020  16.294   3.015
  448    H    TRP  58           HN       TRP  58  79.258  13.719   6.102
  449    HA   TRP  58           HA       TRP  58  81.552  11.980   5.640
  450    HB2  TRP  58           HB2      TRP  58  78.723  11.285   6.434
  451    HB3  TRP  58           HB1      TRP  58  80.128  10.259   6.617
  452    HD1  TRP  58           HD1      TRP  58  82.136  12.367   7.896
  453    HE1  TRP  58           HE1      TRP  58  81.726  13.198  10.320
  454    HE3  TRP  58           HE3      TRP  58  77.165  11.316   8.359
  455    HZ2  TRP  58           HZ2      TRP  58  79.566  13.371  12.179
  456    HZ3  TRP  58           HZ3      TRP  58  75.956  11.823  10.460
  457    HH2  TRP  58           HH2      TRP  58  77.151  12.852  12.372
  458    H    SER  59           HN       SER  59  78.287  12.395   4.349
  459    HA   SER  59           HA       SER  59  78.219  10.285   2.486
  460    HB2  SER  59           HB2      SER  59  76.306  11.803   3.011
  461    HB3  SER  59           HB1      SER  59  77.106  13.082   2.106
  462    HG   SER  59           HG       SER  59  76.858  11.926   0.255
  463    H    ASP  60           HN       ASP  60  79.406  13.622   2.029
  464    HA   ASP  60           HA       ASP  60  80.252  13.319  -0.671
  465    HB2  ASP  60           HB2      ASP  60  80.124  15.511   0.446
  466    HB3  ASP  60           HB1      ASP  60  81.436  15.041   1.528
  467    H    HIS  61           HN       HIS  61  81.265  11.605   1.965
  468    HA   HIS  61           HA       HIS  61  83.958  11.070   0.794
  469    HB2  HIS  61           HB2      HIS  61  83.048  11.191   3.667
  470    HB3  HIS  61           HB1      HIS  61  84.525  10.381   3.179
  471    HD1  HIS  61           HD1      HIS  61  82.978  13.737   2.218
  472    HD2  HIS  61           HD2      HIS  61  86.599  12.161   3.554
  473    HE1  HIS  61           HE1      HIS  61  84.602  15.677   2.340
  474    H    ALA  62           HN       ALA  62  84.581   8.892   0.693
  475    HA   ALA  62           HA       ALA  62  82.804   6.794   1.727
  476    HB1  ALA  62           HB1      ALA  62  81.864   7.618  -0.532
  477    HB2  ALA  62           HB2      ALA  62  82.140   5.884  -0.364
  478    HB3  ALA  62           HB3      ALA  62  83.293   6.879  -1.255
  479    H    LEU  63           HN       LEU  63  83.777   4.558   0.737
  480    HA   LEU  63           HA       LEU  63  86.693   4.754   1.252
  481    HB2  LEU  63           HB2      LEU  63  84.808   2.391   1.109
  482    HB3  LEU  63           HB1      LEU  63  86.540   2.246   1.370
  483    HG   LEU  63           HG       LEU  63  85.333   2.160   3.480
  484   HD11  LEU  63          HD11      LEU  63  86.597   4.877   3.563
  485   HD12  LEU  63          HD12      LEU  63  87.593   3.487   3.127
  486   HD13  LEU  63          HD13      LEU  63  86.764   3.524   4.681
  487   HD21  LEU  63          HD21      LEU  63  83.836   3.786   4.241
  488   HD22  LEU  63          HD22      LEU  63  83.448   3.702   2.524
  489   HD23  LEU  63          HD23      LEU  63  84.452   5.015   3.140
  490    H    TRP  64           HN       TRP  64  88.246   4.198  -0.203
  491    HA   TRP  64           HA       TRP  64  87.411   3.141  -2.881
  492    HB2  TRP  64           HB2      TRP  64  87.931   5.114  -3.895
  493    HB3  TRP  64           HB1      TRP  64  88.177   5.828  -2.324
  494    HD1  TRP  64           HD1      TRP  64  90.880   4.904  -1.364
  495    HE1  TRP  64           HE1      TRP  64  93.048   5.356  -2.670
  496    HE3  TRP  64           HE3      TRP  64  88.952   5.743  -6.019
  497    HZ2  TRP  64           HZ2      TRP  64  93.864   6.029  -5.325
  498    HZ3  TRP  64           HZ3      TRP  64  90.448   6.309  -7.912
  499    HH2  TRP  64           HH2      TRP  64  92.899   6.455  -7.572
  500    H    TRP  65           HN       TRP  65  89.012   1.796  -3.836
  501    HA   TRP  65           HA       TRP  65  91.142   0.915  -1.932
  502    HB2  TRP  65           HB2      TRP  65  89.307  -0.665  -2.865
  503    HB3  TRP  65           HB1      TRP  65  90.198  -0.589  -4.379
  504    HD1  TRP  65           HD1      TRP  65  92.941  -0.364  -2.185
  505    HE1  TRP  65           HE1      TRP  65  93.933  -2.654  -1.564
  506    HE3  TRP  65           HE3      TRP  65  89.061  -3.402  -3.534
  507    HZ2  TRP  65           HZ2      TRP  65  93.178  -5.410  -1.607
  508    HZ3  TRP  65           HZ3      TRP  65  89.228  -5.856  -3.234
  509    HH2  TRP  65           HH2      TRP  65  91.279  -6.864  -2.273
  510    H    GLU  66           HN       GLU  66  92.758   2.483  -2.553
  511    HA   GLU  66           HA       GLU  66  93.394   3.194  -5.201
  512    HB2  GLU  66           HB2      GLU  66  95.694   3.717  -4.310
  513    HB3  GLU  66           HB1      GLU  66  94.358   4.463  -3.450
  514    HG2  GLU  66           HG2      GLU  66  94.438   2.554  -1.813
  515    HG3  GLU  66           HG1      GLU  66  95.894   2.014  -2.636
  516    H    LYS  67           HN       LYS  67  94.092   0.174  -3.565
  517    HA   LYS  67           HA       LYS  67  96.291  -0.611  -5.252
  518    HB2  LYS  67           HB2      LYS  67  94.176  -2.288  -3.919
  519    HB3  LYS  67           HB1      LYS  67  95.526  -2.956  -4.796
  520    HG2  LYS  67           HG2      LYS  67  95.646  -2.642  -2.170
  521    HG3  LYS  67           HG1      LYS  67  97.055  -2.419  -3.161
  522    HD2  LYS  67           HD2      LYS  67  96.768  -0.011  -3.106
  523    HD3  LYS  67           HD1      LYS  67  95.251  -0.185  -2.221
  524    HE2  LYS  67           HE2      LYS  67  97.225   0.363  -0.765
  525    HE3  LYS  67           HE1      LYS  67  96.396  -1.128  -0.319
  526    HZ1  LYS  67           HZ1      LYS  67  99.016  -0.976  -0.690
  527    HZ2  LYS  67           HZ2      LYS  67  98.537  -1.381  -2.269
  528    HZ3  LYS  67           HZ3      LYS  67  98.125  -2.392  -0.968
  529    H    LYS  68           HN       LYS  68  92.972  -0.101  -5.626
  530    HA   LYS  68           HA       LYS  68  92.926  -1.334  -8.347
  531    HB2  LYS  68           HB2      LYS  68  90.389  -0.958  -6.785
  532    HB3  LYS  68           HB1      LYS  68  90.786  -2.179  -7.988
  533    HG2  LYS  68           HG2      LYS  68  92.116  -2.148  -5.261
  534    HG3  LYS  68           HG1      LYS  68  90.582  -2.944  -5.541
  535    HD2  LYS  68           HD2      LYS  68  91.538  -4.411  -7.190
  536    HD3  LYS  68           HD1      LYS  68  93.053  -3.507  -7.192
  537    HE2  LYS  68           HE2      LYS  68  93.713  -4.355  -5.120
  538    HE3  LYS  68           HE1      LYS  68  92.064  -4.696  -4.608
  539    HZ1  LYS  68           HZ1      LYS  68  93.894  -6.318  -6.136
  540    HZ2  LYS  68           HZ2      LYS  68  92.327  -6.250  -6.789
  541    HZ3  LYS  68           HZ3      LYS  68  92.562  -6.779  -5.192
  542    H    ARG  69           HN       ARG  69  92.642   1.501  -6.485
  543    HA   ARG  69           HA       ARG  69  91.885   3.661  -6.991
  544    HB2  ARG  69           HB2      ARG  69  92.527   2.571  -9.750
  545    HB3  ARG  69           HB1      ARG  69  91.941   4.210  -9.514
  546    HG2  ARG  69           HG2      ARG  69  94.250   4.552  -9.474
  547    HG3  ARG  69           HG1      ARG  69  93.915   4.364  -7.757
  548    HD2  ARG  69           HD2      ARG  69  95.738   2.926  -8.088
  549    HD3  ARG  69           HD1      ARG  69  94.362   1.833  -8.191
  550    HE   ARG  69           HE       ARG  69  94.925   1.460 -10.444
  551   HH11  ARG  69          HH11      ARG  69  96.084   1.882 -12.339
  552   HH12  ARG  69          HH12      ARG  69  97.046   3.318 -12.448
  553   HH21  ARG  69          HH21      ARG  69  96.246   4.416  -9.259
  554   HH22  ARG  69          HH22      ARG  69  97.138   4.752 -10.705
  555    H    THR  70           HN       THR  70  89.926   1.897  -6.363
  556    HA   THR  70           HA       THR  70  87.743   2.384  -8.373
  557    HB   THR  70           HB       THR  70  88.467   0.001  -7.715
  558    HG1  THR  70           HG1      THR  70  85.945  -0.231  -7.147
  559   HG21  THR  70          HG21      THR  70  87.924  -0.880  -5.635
  560   HG22  THR  70          HG22      THR  70  86.744   0.387  -5.300
  561   HG23  THR  70          HG23      THR  70  88.469   0.740  -5.202
  562    H    TRP  71           HN       TRP  71  85.581   1.987  -6.894
  563    HA   TRP  71           HA       TRP  71  85.729   3.843  -4.564
  564    HB2  TRP  71           HB2      TRP  71  83.233   4.335  -5.313
  565    HB3  TRP  71           HB1      TRP  71  84.560   5.234  -6.027
  566    HD1  TRP  71           HD1      TRP  71  83.910   1.626  -7.126
  567    HE1  TRP  71           HE1      TRP  71  83.052   1.644  -9.517
  568    HE3  TRP  71           HE3      TRP  71  83.311   6.652  -7.818
  569    HZ2  TRP  71           HZ2      TRP  71  82.235   3.517 -11.519
  570    HZ3  TRP  71           HZ3      TRP  71  82.495   7.522  -9.990
  571    HH2  TRP  71           HH2      TRP  71  81.956   5.962 -11.841
  572    H    LEU  72           HN       LEU  72  85.681   2.293  -3.033
  573    HA   LEU  72           HA       LEU  72  84.361  -0.180  -3.276
  574    HB2  LEU  72           HB2      LEU  72  85.119   1.418  -0.850
  575    HB3  LEU  72           HB1      LEU  72  84.624  -0.262  -0.785
  576    HG   LEU  72           HG       LEU  72  86.866   0.762  -2.517
  577   HD11  LEU  72          HD11      LEU  72  88.295  -0.433  -0.720
  578   HD12  LEU  72          HD12      LEU  72  86.877  -0.247   0.313
  579   HD13  LEU  72          HD13      LEU  72  87.672   1.177  -0.363
  580   HD21  LEU  72          HD21      LEU  72  85.681  -1.922  -1.973
  581   HD22  LEU  72          HD22      LEU  72  87.434  -1.848  -2.126
  582   HD23  LEU  72          HD23      LEU  72  86.412  -1.283  -3.448
  583    H    LEU  73           HN       LEU  73  82.355   0.250  -4.139
  584    HA   LEU  73           HA       LEU  73  80.290   1.165  -2.176
  585    HB2  LEU  73           HB2      LEU  73  78.888   1.793  -4.168
  586    HB3  LEU  73           HB1      LEU  73  80.325   2.784  -3.961
  587    HG   LEU  73           HG       LEU  73  81.378   0.947  -5.610
  588   HD11  LEU  73          HD11      LEU  73  79.457  -0.471  -5.881
  589   HD12  LEU  73          HD12      LEU  73  79.690   0.413  -7.387
  590   HD13  LEU  73          HD13      LEU  73  78.430   0.913  -6.258
  591   HD21  LEU  73          HD21      LEU  73  80.940   2.453  -7.475
  592   HD22  LEU  73          HD22      LEU  73  81.238   3.393  -6.016
  593   HD23  LEU  73          HD23      LEU  73  79.590   3.174  -6.598
  594    H    LYS  74           HN       LYS  74  81.623  -1.510  -3.491
  595    HA   LYS  74           HA       LYS  74  79.290  -2.934  -4.410
  596    HB2  LYS  74           HB2      LYS  74  81.481  -4.548  -3.170
  597    HB3  LYS  74           HB1      LYS  74  80.653  -4.777  -4.700
  598    HG2  LYS  74           HG2      LYS  74  82.752  -2.681  -4.141
  599    HG3  LYS  74           HG1      LYS  74  83.031  -4.193  -4.982
  600    HD2  LYS  74           HD2      LYS  74  82.092  -3.461  -6.941
  601    HD3  LYS  74           HD1      LYS  74  80.779  -2.626  -6.124
  602    HE2  LYS  74           HE2      LYS  74  81.992  -0.869  -7.070
  603    HE3  LYS  74           HE1      LYS  74  82.612  -0.919  -5.432
  604    HZ1  LYS  74           HZ1      LYS  74  83.937  -2.591  -7.419
  605    HZ2  LYS  74           HZ2      LYS  74  84.594  -1.763  -6.090
  606    HZ3  LYS  74           HZ3      LYS  74  84.203  -0.919  -7.512
  607    H    THR  75           HN       THR  75  78.836  -1.578  -1.862
  608    HA   THR  75           HA       THR  75  79.030  -3.217   0.400
  609    HB   THR  75           HB       THR  75  76.601  -1.538  -0.269
  610    HG1  THR  75           HG1      THR  75  77.953   0.048   0.942
  611   HG21  THR  75          HG21      THR  75  76.761  -1.161   2.255
  612   HG22  THR  75          HG22      THR  75  77.898  -2.501   2.284
  613   HG23  THR  75          HG23      THR  75  76.242  -2.762   1.739
  614    H    HIS  76           HN       HIS  76  77.456  -3.974  -2.465
  615    HA   HIS  76           HA       HIS  76  75.104  -5.291  -1.749
  616    HB2  HIS  76           HB2      HIS  76  75.837  -5.105  -4.073
  617    HB3  HIS  76           HB1      HIS  76  77.198  -6.179  -3.750
  618    HD1  HIS  76           HD1      HIS  76  74.254  -7.262  -1.917
  619    HD2  HIS  76           HD2      HIS  76  75.735  -7.847  -5.770
  620    HE1  HIS  76           HE1      HIS  76  73.032  -9.271  -2.857
  621    H    TRP  77           HN       TRP  77  78.103  -7.165  -2.282
  622    HA   TRP  77           HA       TRP  77  77.120  -9.134  -0.308
  623    HB2  TRP  77           HB2      TRP  77  78.183  -9.592  -2.675
  624    HB3  TRP  77           HB1      TRP  77  79.692  -9.441  -1.811
  625    HD1  TRP  77           HD1      TRP  77  78.189 -10.775   0.910
  626    HE1  TRP  77           HE1      TRP  77  78.054 -13.346   0.959
  627    HE3  TRP  77           HE3      TRP  77  78.917 -11.792  -4.044
  628    HZ2  TRP  77           HZ2      TRP  77  78.232 -15.546  -0.859
  629    HZ3  TRP  77           HZ3      TRP  77  78.929 -14.134  -4.855
  630    HH2  TRP  77           HH2      TRP  77  78.587 -16.010  -3.271
  631    H    THR  78           HN       THR  78  80.616  -9.166  -0.361
  632    HA   THR  78           HA       THR  78  80.786  -7.264   1.898
  633    HB   THR  78           HB       THR  78  81.916  -9.811   2.802
  634    HG1  THR  78           HG1      THR  78  79.175 -10.023   2.732
  635   HG21  THR  78          HG21      THR  78  81.435  -8.376   4.559
  636   HG22  THR  78          HG22      THR  78  79.998  -9.396   4.572
  637   HG23  THR  78          HG23      THR  78  79.924  -7.801   3.841
  638    H    LEU  79           HN       LEU  79  83.143  -8.161   2.998
  639    HA   LEU  79           HA       LEU  79  85.126  -7.157   1.136
  640    HB2  LEU  79           HB2      LEU  79  85.322  -8.565   3.804
  641    HB3  LEU  79           HB1      LEU  79  86.726  -7.982   2.934
  642    HG   LEU  79           HG       LEU  79  85.955  -5.686   3.104
  643   HD11  LEU  79          HD11      LEU  79  83.857  -5.268   4.513
  644   HD12  LEU  79          HD12      LEU  79  83.483  -6.969   4.260
  645   HD13  LEU  79          HD13      LEU  79  83.587  -5.872   2.881
  646   HD21  LEU  79          HD21      LEU  79  85.722  -5.565   5.694
  647   HD22  LEU  79          HD22      LEU  79  87.185  -6.300   5.038
  648   HD23  LEU  79          HD23      LEU  79  85.886  -7.325   5.657
  649    H    ASP  80           HN       ASP  80  84.668 -10.236   2.785
  650    HA   ASP  80           HA       ASP  80  86.512 -11.900   1.626
  651    HB2  ASP  80           HB2      ASP  80  84.778 -12.496   3.311
  652    HB3  ASP  80           HB1      ASP  80  83.595 -12.571   2.009
  653    H    LYS  81           HN       LYS  81  83.344 -11.085   0.213
  654    HA   LYS  81           HA       LYS  81  83.653 -12.747  -2.039
  655    HB2  LYS  81           HB2      LYS  81  81.472 -12.144  -2.107
  656    HB3  LYS  81           HB1      LYS  81  81.780 -10.755  -1.084
  657    HG2  LYS  81           HG2      LYS  81  82.509 -10.646  -3.998
  658    HG3  LYS  81           HG1      LYS  81  80.850 -10.410  -3.522
  659    HD2  LYS  81           HD2      LYS  81  81.766  -8.660  -1.884
  660    HD3  LYS  81           HD1      LYS  81  83.250  -8.761  -2.778
  661    HE2  LYS  81           HE2      LYS  81  81.744  -8.401  -4.879
  662    HE3  LYS  81           HE1      LYS  81  80.577  -7.799  -3.704
  663    HZ1  LYS  81           HZ1      LYS  81  81.998  -6.041  -4.615
  664    HZ2  LYS  81           HZ2      LYS  81  83.366  -6.824  -3.983
  665    HZ3  LYS  81           HZ3      LYS  81  82.181  -6.201  -2.937
  666    H    TYR  82           HN       TYR  82  84.835  -9.579  -1.312
  667    HA   TYR  82           HA       TYR  82  85.779  -9.108  -4.050
  668    HB2  TYR  82           HB2      TYR  82  85.108  -7.443  -2.017
  669    HB3  TYR  82           HB1      TYR  82  86.838  -7.521  -1.748
  670    HD1  TYR  82           HD1      TYR  82  84.921  -5.193  -2.776
  671    HD2  TYR  82           HD2      TYR  82  87.672  -7.879  -4.687
  672    HE1  TYR  82           HE1      TYR  82  85.257  -3.552  -4.603
  673    HE2  TYR  82           HE2      TYR  82  88.008  -6.240  -6.512
  674    HH   TYR  82           HH       TYR  82  86.834  -4.355  -7.525
  675    H    GLY  83           HN       GLY  83  87.248  -9.814  -0.871
  676    HA2  GLY  83           HA2      GLY  83  89.056 -11.562  -0.843
  677    HA3  GLY  83           HA1      GLY  83  89.699 -10.825  -2.312
  678    H    ILE  84           HN       ILE  84  88.458  -8.481  -0.296
  679    HA   ILE  84           HA       ILE  84  90.963  -7.219   0.204
  680    HB   ILE  84           HB       ILE  84  88.250  -6.923   1.533
  681   HG12  ILE  84          HG12      ILE  84  89.480  -4.988  -0.422
  682   HG13  ILE  84          HG11      ILE  84  88.721  -6.457  -1.026
  683   HG21  ILE  84          HG21      ILE  84  90.619  -5.046   1.603
  684   HG22  ILE  84          HG22      ILE  84  90.029  -5.986   2.965
  685   HG23  ILE  84          HG23      ILE  84  89.029  -4.719   2.277
  686   HD11  ILE  84          HD11      ILE  84  86.604  -5.865  -0.128
  687   HD12  ILE  84          HD12      ILE  84  87.226  -4.364  -0.811
  688   HD13  ILE  84          HD13      ILE  84  87.307  -4.641   0.929
  689    H    GLN  85           HN       GLN  85  91.955  -6.896   2.386
  690    HA   GLN  85           HA       GLN  85  91.268  -8.873   4.449
  691    HB2  GLN  85           HB2      GLN  85  93.028  -9.782   2.601
  692    HB3  GLN  85           HB1      GLN  85  94.148  -8.983   3.698
  693    HG2  GLN  85           HG2      GLN  85  94.050 -11.073   4.733
  694    HG3  GLN  85           HG1      GLN  85  92.692 -10.297   5.565
  695   HE21  GLN  85          HE21      GLN  85  90.737 -10.338   3.595
  696   HE22  GLN  85          HE22      GLN  85  90.339 -11.935   3.210
  697    H    ALA  86           HN       ALA  86  93.616  -8.649   5.966
  698    HA   ALA  86           HA       ALA  86  93.354  -5.956   7.035
  699    HB1  ALA  86           HB1      ALA  86  93.946  -8.280   8.177
  700    HB2  ALA  86           HB2      ALA  86  94.593  -6.774   8.828
  701    HB3  ALA  86           HB3      ALA  86  95.597  -7.799   7.798
  702    H    ASP  87           HN       ASP  87  95.336  -7.433   4.655
  703    HA   ASP  87           HA       ASP  87  97.514  -5.464   4.941
  704    HB2  ASP  87           HB2      ASP  87  98.252  -6.692   2.751
  705    HB3  ASP  87           HB1      ASP  87  98.342  -7.558   4.285
  706    H    ALA  88           HN       ALA  88  94.474  -5.266   3.764
  707    HA   ALA  88           HA       ALA  88  95.188  -3.740   1.300
  708    HB1  ALA  88           HB1      ALA  88  92.476  -3.696   1.390
  709    HB2  ALA  88           HB2      ALA  88  92.784  -5.134   2.372
  710    HB3  ALA  88           HB3      ALA  88  93.379  -5.055   0.716
  711    H    LYS  89           HN       LYS  89  95.635  -1.605   1.704
  712    HA   LYS  89           HA       LYS  89  94.302  -0.248   3.993
  713    HB2  LYS  89           HB2      LYS  89  96.358   1.056   2.222
  714    HB3  LYS  89           HB1      LYS  89  96.002   1.363   3.920
  715    HG2  LYS  89           HG2      LYS  89  97.228  -1.212   2.886
  716    HG3  LYS  89           HG1      LYS  89  98.149   0.135   3.526
  717    HD2  LYS  89           HD2      LYS  89  97.314  -0.142   5.709
  718    HD3  LYS  89           HD1      LYS  89  95.946  -1.104   5.163
  719    HE2  LYS  89           HE2      LYS  89  97.646  -2.529   6.222
  720    HE3  LYS  89           HE1      LYS  89  97.449  -2.918   4.513
  721    HZ1  LYS  89           HZ1      LYS  89  99.455  -2.007   3.972
  722    HZ2  LYS  89           HZ2      LYS  89  99.809  -2.567   5.537
  723    HZ3  LYS  89           HZ3      LYS  89  99.457  -0.925   5.278
  724    H    LEU  90           HN       LEU  90  92.600   0.949   3.701
  725    HA   LEU  90           HA       LEU  90  91.913   1.929   0.963
  726    HB2  LEU  90           HB2      LEU  90  89.923   1.961   3.211
  727    HB3  LEU  90           HB1      LEU  90  89.657   1.728   1.486
  728    HG   LEU  90           HG       LEU  90  90.971  -0.259   3.335
  729   HD11  LEU  90          HD11      LEU  90  88.679  -0.242   3.912
  730   HD12  LEU  90          HD12      LEU  90  88.826  -1.567   2.758
  731   HD13  LEU  90          HD13      LEU  90  88.176  -0.013   2.238
  732   HD21  LEU  90          HD21      LEU  90  90.467  -1.767   1.265
  733   HD22  LEU  90          HD22      LEU  90  91.853  -0.686   1.183
  734   HD23  LEU  90          HD23      LEU  90  90.347  -0.243   0.380
  735    H    GLN  91           HN       GLN  91  90.447   3.984   1.226
  736    HA   GLN  91           HA       GLN  91  91.662   5.897   3.166
  737    HB2  GLN  91           HB2      GLN  91  90.952   6.568   0.295
  738    HB3  GLN  91           HB1      GLN  91  91.810   7.585   1.447
  739    HG2  GLN  91           HG2      GLN  91  93.814   6.411   1.208
  740    HG3  GLN  91           HG1      GLN  91  93.016   4.934   0.703
  741   HE21  GLN  91          HE21      GLN  91  91.774   7.724  -0.807
  742   HE22  GLN  91          HE22      GLN  91  92.548   7.529  -2.293
  743    H    PHE  92           HN       PHE  92  90.149   7.847   3.384
  744    HA   PHE  92           HA       PHE  92  87.298   7.024   2.904
  745    HB2  PHE  92           HB2      PHE  92  87.806   6.986   5.270
  746    HB3  PHE  92           HB1      PHE  92  88.481   8.595   5.214
  747    HD1  PHE  92           HD1      PHE  92  87.062  10.459   5.628
  748    HD2  PHE  92           HD2      PHE  92  85.354   6.688   4.494
  749    HE1  PHE  92           HE1      PHE  92  84.796  11.355   6.070
  750    HE2  PHE  92           HE2      PHE  92  83.084   7.587   4.925
  751    HZ   PHE  92           HZ       PHE  92  82.805   9.919   5.717
  752    H    THR  93           HN       THR  93  87.175   8.052   0.937
  753    HA   THR  93           HA       THR  93  86.978  11.016   1.036
  754    HB   THR  93           HB       THR  93  89.059  11.099   0.020
  755    HG1  THR  93           HG1      THR  93  88.615  10.348  -2.378
  756   HG21  THR  93          HG21      THR  93  89.565   8.739   0.396
  757   HG22  THR  93          HG22      THR  93  90.036   9.186  -1.242
  758   HG23  THR  93          HG23      THR  93  88.549   8.279  -0.970
  759    HA   PRO  94           HA       PRO  94  83.311  10.748  -1.413
  760    HB2  PRO  94           HB2      PRO  94  84.371  11.938  -3.855
  761    HB3  PRO  94           HB1      PRO  94  83.308  12.677  -2.648
  762    HG2  PRO  94           HG2      PRO  94  86.231  12.904  -2.953
  763    HG3  PRO  94           HG1      PRO  94  85.098  13.986  -2.127
  764    HD2  PRO  94           HD2      PRO  94  86.847  12.452  -0.753
  765    HD3  PRO  94           HD1      PRO  94  85.230  12.807  -0.116
  766    H    TYR 541           HT1      TYR 541  58.394  41.386  14.365
  767    HA   TYR 541           HA       TYR 541  57.633  39.420  15.906
  768    HB2  TYR 541           HB2      TYR 541  57.741  40.860  17.937
  769    HB3  TYR 541           HB1      TYR 541  56.503  41.903  17.235
  770    HD1  TYR 541           HD1      TYR 541  57.166  38.324  18.120
  771    HD2  TYR 541           HD2      TYR 541  54.228  41.411  17.584
  772    HE1  TYR 541           HE1      TYR 541  55.407  36.799  18.972
  773    HE2  TYR 541           HE2      TYR 541  52.469  39.885  18.435
  774    HH   TYR 541           HH       TYR 541  53.106  36.495  19.019
  775    H    HIS 542           HN       HIS 542  57.050  39.539  13.504
  776    HA   HIS 542           HA       HIS 542  54.925  41.153  12.538
  777    HB2  HIS 542           HB2      HIS 542  55.505  38.321  11.653
  778    HB3  HIS 542           HB1      HIS 542  54.846  39.642  10.696
  779    HD1  HIS 542           HD1      HIS 542  58.064  38.404  12.200
  780    HD2  HIS 542           HD2      HIS 542  56.760  41.489   9.718
  781    HE1  HIS 542           HE1      HIS 542  60.146  39.486  11.247
  782    H    GLU 543           HN       GLU 543  52.900  39.625  11.613
  783    HA   GLU 543           HA       GLU 543  51.579  38.617  14.101
  784    HB2  GLU 543           HB2      GLU 543  50.089  40.240  13.450
  785    HB3  GLU 543           HB1      GLU 543  50.738  40.299  11.819
  786    HG2  GLU 543           HG2      GLU 543  48.366  39.546  11.886
  787    HG3  GLU 543           HG1      GLU 543  49.437  38.335  11.185
  788    H    ARG 544           HN       ARG 544  52.327  37.871  10.752
  789    HA   ARG 544           HA       ARG 544  50.869  35.347  10.818
  790    HB2  ARG 544           HB2      ARG 544  52.934  35.891   8.712
  791    HB3  ARG 544           HB1      ARG 544  51.373  35.099   8.568
  792    HG2  ARG 544           HG2      ARG 544  50.871  37.133   7.568
  793    HG3  ARG 544           HG1      ARG 544  50.436  37.499   9.236
  794    HD2  ARG 544           HD2      ARG 544  51.831  39.299   8.922
  795    HD3  ARG 544           HD1      ARG 544  53.098  38.119   9.259
  796    HE   ARG 544           HE       ARG 544  52.712  37.875   6.537
  797   HH11  ARG 544          HH11      ARG 544  53.854  39.114   5.028
  798   HH12  ARG 544          HH12      ARG 544  54.485  40.658   5.495
  799   HH21  ARG 544          HH21      ARG 544  53.286  40.461   8.743
  800   HH22  ARG 544          HH22      ARG 544  54.164  41.420   7.599
  801    H    ARG 545           HN       ARG 545  51.809  34.143  12.525
  802    HA   ARG 545           HA       ARG 545  54.663  33.759  12.760
  803    HB2  ARG 545           HB2      ARG 545  52.286  32.268  13.916
  804    HB3  ARG 545           HB1      ARG 545  53.949  31.899  14.321
  805    HG2  ARG 545           HG2      ARG 545  53.386  33.365  16.050
  806    HG3  ARG 545           HG1      ARG 545  54.150  34.439  14.899
  807    HD2  ARG 545           HD2      ARG 545  52.264  35.683  14.771
  808    HD3  ARG 545           HD1      ARG 545  51.329  34.296  14.240
  809    HE   ARG 545           HE       ARG 545  51.110  35.558  16.761
  810   HH11  ARG 545          HH11      ARG 545  50.289  34.562  18.590
  811   HH12  ARG 545          HH12      ARG 545  50.251  32.833  18.682
  812   HH21  ARG 545          HH21      ARG 545  51.654  32.366  15.553
  813   HH22  ARG 545          HH22      ARG 545  51.023  31.593  16.966
  814    H    GLY 546           HN       GLY 546  54.732  30.906  13.109
  815    HA2  GLY 546           HA2      GLY 546  54.009  29.767  10.468
  816    HA3  GLY 546           HA1      GLY 546  55.725  29.807  10.886
  817    H    SER 547           HN       SER 547  56.525  28.301  12.338
  818    HA   SER 547           HA       SER 547  54.736  26.740  14.048
  819    HB2  SER 547           HB2      SER 547  55.852  25.638  11.491
  820    HB3  SER 547           HB1      SER 547  55.785  24.574  12.894
  821    HG   SER 547           HG       SER 547  53.708  24.452  12.632
  822    H    LEU 548           HN       LEU 548  55.969  26.686  15.882
  823    HA   LEU 548           HA       LEU 548  58.749  27.231  15.898
  824    HB2  LEU 548           HB2      LEU 548  56.705  26.394  17.864
  825    HB3  LEU 548           HB1      LEU 548  58.336  25.892  18.284
  826    HG   LEU 548           HG       LEU 548  59.058  28.305  17.866
  827   HD11  LEU 548          HD11      LEU 548  57.323  29.215  16.568
  828   HD12  LEU 548          HD12      LEU 548  57.084  29.941  18.150
  829   HD13  LEU 548          HD13      LEU 548  56.069  28.596  17.635
  830   HD21  LEU 548          HD21      LEU 548  58.498  28.999  20.043
  831   HD22  LEU 548          HD22      LEU 548  58.490  27.239  20.140
  832   HD23  LEU 548          HD23      LEU 548  56.968  28.121  20.024
  833    H    CYS 549           HN       CYS 549  60.549  25.946  15.757
  834    HA   CYS 549           HA       CYS 549  60.122  23.146  14.942
  835    HB2  CYS 549           HB2      CYS 549  61.859  24.174  13.719
  836    HB3  CYS 549           HB1      CYS 549  62.464  25.040  15.117
  837    H    SER 550           HN       SER 550  59.538  21.965  16.690
  838    HA   SER 550           HA       SER 550  60.129  22.419  19.364
  839    HB2  SER 550           HB2      SER 550  58.494  20.800  18.906
  840    HB3  SER 550           HB1      SER 550  59.580  19.830  17.920
  841    HG   SER 550           HG       SER 550  60.368  18.953  19.672
  842    H    GLY 551           HN       GLY 551  61.859  22.386  20.518
  843    HA2  GLY 551           HA2      GLY 551  63.947  21.267  21.275
  844    HA3  GLY 551           HA1      GLY 551  64.281  20.885  19.580
  845    H    CYS 552           HN       CYS 552  63.303  23.365  18.581
  846    HA   CYS 552           HA       CYS 552  65.549  25.187  19.335
  847    HB2  CYS 552           HB2      CYS 552  63.939  24.659  16.854
  848    HB3  CYS 552           HB1      CYS 552  64.654  26.248  17.074
  849    H    GLN 553           HN       GLN 553  62.104  24.836  18.808
  850    HA   GLN 553           HA       GLN 553  60.317  26.167  19.309
  851    HB2  GLN 553           HB2      GLN 553  62.143  27.034  21.532
  852    HB3  GLN 553           HB1      GLN 553  60.427  27.437  21.435
  853    HG2  GLN 553           HG2      GLN 553  61.493  24.614  21.338
  854    HG3  GLN 553           HG1      GLN 553  60.915  25.380  22.803
  855   HE21  GLN 553          HE21      GLN 553  59.914  24.253  19.599
  856   HE22  GLN 553          HE22      GLN 553  58.260  24.128  19.960
  857    H    LYS 554           HN       LYS 554  61.346  27.042  17.265
  858    HA   LYS 554           HA       LYS 554  61.180  29.990  17.444
  859    HB2  LYS 554           HB2      LYS 554  63.291  28.498  15.865
  860    HB3  LYS 554           HB1      LYS 554  62.993  30.227  15.743
  861    HG2  LYS 554           HG2      LYS 554  63.747  28.811  18.311
  862    HG3  LYS 554           HG1      LYS 554  64.901  29.630  17.267
  863    HD2  LYS 554           HD2      LYS 554  63.283  31.685  17.532
  864    HD3  LYS 554           HD1      LYS 554  62.696  30.809  18.945
  865    HE2  LYS 554           HE2      LYS 554  64.439  32.275  19.709
  866    HE3  LYS 554           HE1      LYS 554  65.098  30.640  19.723
  867    HZ1  LYS 554           HZ1      LYS 554  66.681  31.316  18.355
  868    HZ2  LYS 554           HZ2      LYS 554  66.022  32.881  18.312
  869    HZ3  LYS 554           HZ3      LYS 554  65.521  31.714  17.183
  870    HA   PRO 555           HA       PRO 555  57.997  28.836  14.424
  871    HB2  PRO 555           HB2      PRO 555  58.605  31.481  13.228
  872    HB3  PRO 555           HB1      PRO 555  57.054  30.805  13.732
  873    HG2  PRO 555           HG2      PRO 555  58.421  32.703  15.179
  874    HG3  PRO 555           HG1      PRO 555  57.284  31.560  15.900
  875    HD2  PRO 555           HD2      PRO 555  60.218  31.658  16.187
  876    HD3  PRO 555           HD1      PRO 555  59.036  30.726  17.139
  877    H    ILE 556           HN       ILE 556  58.076  27.763  12.593
  878    HA   ILE 556           HA       ILE 556  60.532  27.809  10.928
  879    HB   ILE 556           HB       ILE 556  58.119  25.971  11.072
  880   HG12  ILE 556          HG12      ILE 556  60.969  25.172  11.654
  881   HG13  ILE 556          HG11      ILE 556  60.065  26.017  12.892
  882   HG21  ILE 556          HG21      ILE 556  58.870  25.931   8.806
  883   HG22  ILE 556          HG22      ILE 556  59.562  24.509   9.584
  884   HG23  ILE 556          HG23      ILE 556  60.564  25.928   9.295
  885   HD11  ILE 556          HD11      ILE 556  58.619  23.747  11.613
  886   HD12  ILE 556          HD12      ILE 556  58.703  24.217  13.310
  887   HD13  ILE 556          HD13      ILE 556  60.020  23.309  12.585
  888    H    THR 557           HN       THR 557  60.235  29.642   9.598
  889    HA   THR 557           HA       THR 557  57.624  29.950   8.196
  890    HB   THR 557           HB       THR 557  58.221  32.194   7.857
  891    HG1  THR 557           HG1      THR 557  60.618  32.599   8.548
  892   HG21  THR 557          HG21      THR 557  57.921  31.440  10.275
  893   HG22  THR 557          HG22      THR 557  58.782  32.966  10.053
  894   HG23  THR 557          HG23      THR 557  59.679  31.489  10.409
  895    H    GLY 558           HN       GLY 558  57.826  28.323   6.659
  896    HA2  GLY 558           HA2      GLY 558  58.578  28.865   4.101
  897    HA3  GLY 558           HA1      GLY 558  60.079  28.236   4.795
  898    H    ARG 559           HN       ARG 559  60.216  26.079   5.311
  899    HA   ARG 559           HA       ARG 559  57.904  24.332   4.565
  900    HB2  ARG 559           HB2      ARG 559  60.888  24.084   4.223
  901    HB3  ARG 559           HB1      ARG 559  59.938  22.611   4.423
  902    HG2  ARG 559           HG2      ARG 559  59.050  24.687   2.428
  903    HG3  ARG 559           HG1      ARG 559  60.362  23.590   2.005
  904    HD2  ARG 559           HD2      ARG 559  58.990  21.686   2.144
  905    HD3  ARG 559           HD1      ARG 559  57.785  22.507   3.136
  906    HE   ARG 559           HE       ARG 559  57.741  23.907   0.744
  907   HH11  ARG 559          HH11      ARG 559  56.368  23.346  -0.963
  908   HH12  ARG 559          HH12      ARG 559  55.799  21.715  -1.098
  909   HH21  ARG 559          HH21      ARG 559  57.485  20.613   1.725
  910   HH22  ARG 559          HH22      ARG 559  56.432  20.168   0.424
  911    H    CYS 560           HN       CYS 560  57.461  22.601   6.056
  912    HA   CYS 560           HA       CYS 560  59.049  22.589   8.560
  913    HB2  CYS 560           HB2      CYS 560  57.014  22.747   9.949
  914    HB3  CYS 560           HB1      CYS 560  57.300  24.218   9.016
  915    HG   CYS 560           HG       CYS 560  55.187  23.835   7.769
  916    H    ILE 561           HN       ILE 561  59.450  20.654   9.198
  917    HA   ILE 561           HA       ILE 561  57.940  18.380   8.083
  918    HB   ILE 561           HB       ILE 561  60.426  18.544   9.806
  919   HG12  ILE 561          HG12      ILE 561  59.920  17.945   6.898
  920   HG13  ILE 561          HG11      ILE 561  60.689  19.388   7.528
  921   HG21  ILE 561          HG21      ILE 561  59.166  16.150   8.438
  922   HG22  ILE 561          HG22      ILE 561  59.153  16.425  10.182
  923   HG23  ILE 561          HG23      ILE 561  60.674  16.137   9.346
  924   HD11  ILE 561          HD11      ILE 561  62.455  17.928   6.793
  925   HD12  ILE 561          HD12      ILE 561  61.734  16.547   7.633
  926   HD13  ILE 561          HD13      ILE 561  62.445  17.878   8.559
  927    H    THR 562           HN       THR 562  56.863  16.954   9.388
  928    HA   THR 562           HA       THR 562  56.317  17.845  12.192
  929    HB   THR 562           HB       THR 562  54.378  16.252  10.528
  930    HG1  THR 562           HG1      THR 562  54.864  18.335   9.589
  931   HG21  THR 562          HG21      THR 562  54.246  16.335  13.063
  932   HG22  THR 562          HG22      THR 562  52.804  16.910  12.220
  933   HG23  THR 562          HG23      THR 562  53.945  18.068  12.906
  934    H    ALA 563           HN       ALA 563  56.193  16.295  13.751
  935    HA   ALA 563           HA       ALA 563  57.152  13.565  13.001
  936    HB1  ALA 563           HB1      ALA 563  58.503  13.581  15.001
  937    HB2  ALA 563           HB2      ALA 563  57.809  15.126  15.502
  938    HB3  ALA 563           HB3      ALA 563  58.859  15.051  14.083
  939    H    MET 564           HN       MET 564  56.923  13.465  16.144
  940    HA   MET 564           HA       MET 564  54.490  11.960  16.242
  941    HB2  MET 564           HB2      MET 564  55.754  13.242  18.654
  942    HB3  MET 564           HB1      MET 564  55.011  11.648  18.506
  943    HG2  MET 564           HG2      MET 564  56.931  11.116  16.855
  944    HG3  MET 564           HG1      MET 564  57.700  12.565  17.500
  945    HE1  MET 564           HE1      MET 564  59.694  11.696  18.440
  946    HE2  MET 564           HE2      MET 564  59.403  10.087  17.786
  947    HE3  MET 564           HE3      MET 564  59.883  10.271  19.471
  948    H    ALA 565           HN       ALA 565  54.402  14.743  15.317
  949    HA   ALA 565           HA       ALA 565  52.391  16.101  15.252
  950    HB1  ALA 565           HB1      ALA 565  51.410  14.941  17.301
  951    HB2  ALA 565           HB2      ALA 565  51.187  16.686  17.240
  952    HB3  ALA 565           HB3      ALA 565  52.431  16.001  18.280
  953    H    LYS 566           HN       LYS 566  55.405  16.043  16.661
  954    HA   LYS 566           HA       LYS 566  55.528  18.893  17.387
  955    HB2  LYS 566           HB2      LYS 566  57.397  16.557  17.349
  956    HB3  LYS 566           HB1      LYS 566  58.135  18.148  17.205
  957    HG2  LYS 566           HG2      LYS 566  57.272  18.864  19.292
  958    HG3  LYS 566           HG1      LYS 566  56.131  17.524  19.376
  959    HD2  LYS 566           HD2      LYS 566  59.070  16.893  19.194
  960    HD3  LYS 566           HD1      LYS 566  58.423  17.448  20.732
  961    HE2  LYS 566           HE2      LYS 566  57.030  15.578  20.973
  962    HE3  LYS 566           HE1      LYS 566  56.993  15.254  19.235
  963    HZ1  LYS 566           HZ1      LYS 566  58.470  13.848  20.880
  964    HZ2  LYS 566           HZ2      LYS 566  59.578  15.106  20.603
  965    HZ3  LYS 566           HZ3      LYS 566  58.983  14.191  19.300
  966    H    LYS 567           HN       LYS 567  57.126  20.312  16.220
  967    HA   LYS 567           HA       LYS 567  57.018  19.803  13.269
  968    HB2  LYS 567           HB2      LYS 567  57.624  22.456  14.532
  969    HB3  LYS 567           HB1      LYS 567  56.927  22.131  12.958
  970    HG2  LYS 567           HG2      LYS 567  55.561  21.683  15.636
  971    HG3  LYS 567           HG1      LYS 567  55.215  22.983  14.509
  972    HD2  LYS 567           HD2      LYS 567  54.837  20.017  13.933
  973    HD3  LYS 567           HD1      LYS 567  53.556  21.175  14.283
  974    HE2  LYS 567           HE2      LYS 567  54.536  22.520  12.272
  975    HE3  LYS 567           HE1      LYS 567  55.303  20.991  11.848
  976    HZ1  LYS 567           HZ1      LYS 567  52.637  20.481  12.510
  977    HZ2  LYS 567           HZ2      LYS 567  53.399  20.303  11.002
  978    HZ3  LYS 567           HZ3      LYS 567  52.657  21.775  11.414
  979    H    PHE 568           HN       PHE 568  59.076  20.956  12.186
  980    HA   PHE 568           HA       PHE 568  61.441  20.898  13.921
  981    HB2  PHE 568           HB2      PHE 568  60.565  18.466  12.686
  982    HB3  PHE 568           HB1      PHE 568  62.011  18.960  11.822
  983    HD1  PHE 568           HD1      PHE 568  63.800  20.105  13.668
  984    HD2  PHE 568           HD2      PHE 568  61.018  16.907  14.375
  985    HE1  PHE 568           HE1      PHE 568  65.210  19.289  15.537
  986    HE2  PHE 568           HE2      PHE 568  62.430  16.093  16.244
  987    HZ   PHE 568           HZ       PHE 568  64.526  17.284  16.824
  988    H    HIS 569           HN       HIS 569  63.074  22.070  13.032
  989    HA   HIS 569           HA       HIS 569  62.637  23.671  10.728
  990    HB2  HIS 569           HB2      HIS 569  65.031  22.870  12.318
  991    HB3  HIS 569           HB1      HIS 569  65.304  23.671  10.783
  992    HD2  HIS 569           HD2      HIS 569  63.493  26.213  10.764
  993    HE1  HIS 569           HE1      HIS 569  64.469  26.813  14.826
  994    HA   PRO 570           HA       PRO 570  62.818  20.098   7.886
  995    HB2  PRO 570           HB2      PRO 570  63.619  22.258   5.974
  996    HB3  PRO 570           HB1      PRO 570  62.388  20.996   5.793
  997    HG2  PRO 570           HG2      PRO 570  61.724  23.571   6.346
  998    HG3  PRO 570           HG1      PRO 570  60.782  22.205   6.953
  999    HD2  PRO 570           HD2      PRO 570  62.566  24.042   8.449
 1000    HD3  PRO 570           HD1      PRO 570  61.241  23.012   9.049
 1001    H    GLU 571           HN       GLU 571  65.378  22.158   8.839
 1002    HA   GLU 571           HA       GLU 571  67.419  20.537   7.389
 1003    HB2  GLU 571           HB2      GLU 571  68.024  22.979   9.046
 1004    HB3  GLU 571           HB1      GLU 571  68.888  22.339   7.649
 1005    HG2  GLU 571           HG2      GLU 571  66.773  22.836   6.303
 1006    HG3  GLU 571           HG1      GLU 571  66.238  23.765   7.708
 1007    H    HIS 572           HN       HIS 572  66.828  21.927  10.630
 1008    HA   HIS 572           HA       HIS 572  68.851  20.468  11.983
 1009    HB2  HIS 572           HB2      HIS 572  66.168  21.153  13.212
 1010    HB3  HIS 572           HB1      HIS 572  67.714  20.977  14.038
 1011    HD2  HIS 572           HD2      HIS 572  69.169  22.797  11.423
 1012    HE1  HIS 572           HE1      HIS 572  67.115  25.936  13.345
 1013    H    PHE 573           HN       PHE 573  66.252  19.211  10.338
 1014    HA   PHE 573           HA       PHE 573  66.381  16.663  11.921
 1015    HB2  PHE 573           HB2      PHE 573  64.130  17.966  11.880
 1016    HB3  PHE 573           HB1      PHE 573  64.039  17.464  10.194
 1017    HD1  PHE 573           HD1      PHE 573  64.475  16.156  13.663
 1018    HD2  PHE 573           HD2      PHE 573  63.318  15.278   9.620
 1019    HE1  PHE 573           HE1      PHE 573  63.668  13.923  14.379
 1020    HE2  PHE 573           HE2      PHE 573  62.510  13.045  10.336
 1021    HZ   PHE 573           HZ       PHE 573  62.685  12.368  12.715
 1022    H    VAL 574           HN       VAL 574  68.291  17.084  10.107
 1023    HA   VAL 574           HA       VAL 574  67.449  16.031   7.499
 1024    HB   VAL 574           HB       VAL 574  69.861  16.267   6.918
 1025   HG11  VAL 574          HG11      VAL 574  69.146  18.290   6.206
 1026   HG12  VAL 574          HG12      VAL 574  69.579  18.979   7.750
 1027   HG13  VAL 574          HG13      VAL 574  67.944  18.371   7.480
 1028   HG21  VAL 574          HG21      VAL 574  71.318  17.483   8.524
 1029   HG22  VAL 574          HG22      VAL 574  70.790  15.924   9.165
 1030   HG23  VAL 574          HG23      VAL 574  70.020  17.419   9.727
 1031    H    CYS 575           HN       CYS 575  69.144  14.307   6.644
 1032    HA   CYS 575           HA       CYS 575  68.951  11.963   8.399
 1033    HB2  CYS 575           HB2      CYS 575  68.783  11.075   6.319
 1034    HB3  CYS 575           HB1      CYS 575  69.456  12.529   5.593
 1035    H    ALA 576           HN       ALA 576  70.745  10.847   9.398
 1036    HA   ALA 576           HA       ALA 576  73.158  12.611   9.616
 1037    HB1  ALA 576           HB1      ALA 576  73.691  11.392  11.562
 1038    HB2  ALA 576           HB2      ALA 576  72.774   9.975  11.048
 1039    HB3  ALA 576           HB3      ALA 576  71.925  11.421  11.600
 1040    H    PHE 577           HN       PHE 577  73.615  12.127   7.374
 1041    HA   PHE 577           HA       PHE 577  75.675  10.070   7.076
 1042    HB2  PHE 577           HB2      PHE 577  73.617   8.930   6.126
 1043    HB3  PHE 577           HB1      PHE 577  73.438  10.282   5.015
 1044    HD1  PHE 577           HD1      PHE 577  75.901   7.627   6.053
 1045    HD2  PHE 577           HD2      PHE 577  74.543  10.278   2.949
 1046    HE1  PHE 577           HE1      PHE 577  77.450   6.554   4.456
 1047    HE2  PHE 577           HE2      PHE 577  76.099   9.193   1.355
 1048    HZ   PHE 577           HZ       PHE 577  77.551   7.334   2.107
 1049    H    CYS 578           HN       CYS 578  73.573  12.457   5.792
 1050    HA   CYS 578           HA       CYS 578  75.803  14.201   4.860
 1051    HB2  CYS 578           HB2      CYS 578  73.884  15.020   3.221
 1052    HB3  CYS 578           HB1      CYS 578  74.827  13.596   2.797
 1053    H    LEU 579           HN       LEU 579  75.205  16.519   5.237
 1054    HA   LEU 579           HA       LEU 579  73.248  16.792   7.464
 1055    HB2  LEU 579           HB2      LEU 579  75.056  19.079   6.817
 1056    HB3  LEU 579           HB1      LEU 579  74.575  18.428   8.376
 1057    HG   LEU 579           HG       LEU 579  76.937  18.091   8.065
 1058   HD11  LEU 579          HD11      LEU 579  75.327  16.181   8.956
 1059   HD12  LEU 579          HD12      LEU 579  77.058  15.906   8.768
 1060   HD13  LEU 579          HD13      LEU 579  75.936  15.323   7.540
 1061   HD21  LEU 579          HD21      LEU 579  76.391  17.833   5.355
 1062   HD22  LEU 579          HD22      LEU 579  76.863  16.197   5.817
 1063   HD23  LEU 579          HD23      LEU 579  77.944  17.550   6.133
 1064    H    LYS 580           HN       LYS 580  72.832  17.105   4.230
 1065    HA   LYS 580           HA       LYS 580  71.840  19.919   4.360
 1066    HB2  LYS 580           HB2      LYS 580  72.085  20.023   2.074
 1067    HB3  LYS 580           HB1      LYS 580  73.310  18.836   2.482
 1068    HG2  LYS 580           HG2      LYS 580  70.513  18.123   1.508
 1069    HG3  LYS 580           HG1      LYS 580  71.938  18.212   0.492
 1070    HD2  LYS 580           HD2      LYS 580  72.983  16.386   1.568
 1071    HD3  LYS 580           HD1      LYS 580  71.876  16.441   2.936
 1072    HE2  LYS 580           HE2      LYS 580  71.435  14.604   1.226
 1073    HE3  LYS 580           HE1      LYS 580  70.063  15.632   1.643
 1074    HZ1  LYS 580           HZ1      LYS 580  70.196  15.377  -0.732
 1075    HZ2  LYS 580           HZ2      LYS 580  71.811  15.906  -0.743
 1076    HZ3  LYS 580           HZ3      LYS 580  70.564  16.982  -0.326
 1077    H    GLN 581           HN       GLN 581  70.276  16.676   3.634
 1078    HA   GLN 581           HA       GLN 581  67.818  17.948   4.499
 1079    HB2  GLN 581           HB2      GLN 581  68.138  18.813   2.184
 1080    HB3  GLN 581           HB1      GLN 581  67.834  17.177   1.603
 1081    HG2  GLN 581           HG2      GLN 581  65.721  18.276   1.555
 1082    HG3  GLN 581           HG1      GLN 581  65.669  17.277   2.992
 1083   HE21  GLN 581          HE21      GLN 581  66.209  18.436   5.103
 1084   HE22  GLN 581          HE22      GLN 581  65.807  20.072   5.222
 1085    H    LEU 582           HN       LEU 582  66.186  16.715   5.015
 1086    HA   LEU 582           HA       LEU 582  66.104  13.876   4.179
 1087    HB2  LEU 582           HB2      LEU 582  67.140  14.154   6.471
 1088    HB3  LEU 582           HB1      LEU 582  65.594  14.781   7.016
 1089    HG   LEU 582           HG       LEU 582  64.525  12.653   6.373
 1090   HD11  LEU 582          HD11      LEU 582  65.620  11.527   4.710
 1091   HD12  LEU 582          HD12      LEU 582  66.498  10.780   6.040
 1092   HD13  LEU 582          HD13      LEU 582  67.199  12.152   5.174
 1093   HD21  LEU 582          HD21      LEU 582  65.929  11.219   8.068
 1094   HD22  LEU 582          HD22      LEU 582  65.112  12.679   8.623
 1095   HD23  LEU 582          HD23      LEU 582  66.838  12.715   8.292
 1096    H    ASN 583           HN       ASN 583  63.812  13.010   4.781
 1097    HA   ASN 583           HA       ASN 583  61.759  15.157   4.940
 1098    HB2  ASN 583           HB2      ASN 583  62.221  13.346   2.565
 1099    HB3  ASN 583           HB1      ASN 583  60.600  13.932   2.924
 1100   HD21  ASN 583          HD21      ASN 583  61.743  14.735   0.547
 1101   HD22  ASN 583          HD22      ASN 583  62.177  16.369   0.630
 1102    H    LYS 584           HN       LYS 584  60.116  14.484   6.197
 1103    HA   LYS 584           HA       LYS 584  60.082  12.086   7.622
 1104    HB2  LYS 584           HB2      LYS 584  57.611  12.593   7.908
 1105    HB3  LYS 584           HB1      LYS 584  58.707  13.916   8.308
 1106    HG2  LYS 584           HG2      LYS 584  58.135  15.168   6.426
 1107    HG3  LYS 584           HG1      LYS 584  57.722  13.746   5.464
 1108    HD2  LYS 584           HD2      LYS 584  55.667  14.871   5.934
 1109    HD3  LYS 584           HD1      LYS 584  55.705  13.454   6.975
 1110    HE2  LYS 584           HE2      LYS 584  55.005  15.231   8.388
 1111    HE3  LYS 584           HE1      LYS 584  56.710  15.002   8.767
 1112    HZ1  LYS 584           HZ1      LYS 584  56.078  17.347   8.421
 1113    HZ2  LYS 584           HZ2      LYS 584  55.686  16.981   6.809
 1114    HZ3  LYS 584           HZ3      LYS 584  57.287  16.820   7.354
 1115    H    GLY 585           HN       GLY 585  59.252  12.642   4.337
 1116    HA2  GLY 585           HA2      GLY 585  57.545  10.256   4.106
 1117    HA3  GLY 585           HA1      GLY 585  57.996  11.349   2.800
 1118    H    THR 586           HN       THR 586  60.824  11.155   3.830
 1119    HA   THR 586           HA       THR 586  61.520   8.401   2.895
 1120    HB   THR 586           HB       THR 586  63.041   9.190   1.306
 1121    HG1  THR 586           HG1      THR 586  64.244  10.850   1.728
 1122   HG21  THR 586          HG21      THR 586  61.870  10.825  -0.048
 1123   HG22  THR 586          HG22      THR 586  60.991  11.427   1.360
 1124   HG23  THR 586          HG23      THR 586  60.661   9.809   0.740
 1125    H    PHE 587           HN       PHE 587  61.384   9.765   5.549
 1126    HA   PHE 587           HA       PHE 587  64.252  10.008   6.257
 1127    HB2  PHE 587           HB2      PHE 587  63.609  10.939   8.286
 1128    HB3  PHE 587           HB1      PHE 587  62.351  11.500   7.206
 1129    HD1  PHE 587           HD1      PHE 587  62.746  10.466  10.405
 1130    HD2  PHE 587           HD2      PHE 587  60.462   9.362   6.938
 1131    HE1  PHE 587           HE1      PHE 587  61.036   9.420  11.860
 1132    HE2  PHE 587           HE2      PHE 587  58.755   8.319   8.394
 1133    HZ   PHE 587           HZ       PHE 587  59.040   8.346  10.855
 1134    H    LYS 588           HN       LYS 588  65.262   8.176   6.407
 1135    HA   LYS 588           HA       LYS 588  64.009   5.796   7.665
 1136    HB2  LYS 588           HB2      LYS 588  65.647   6.172   5.397
 1137    HB3  LYS 588           HB1      LYS 588  66.731   5.518   6.583
 1138    HG2  LYS 588           HG2      LYS 588  65.642   3.791   5.121
 1139    HG3  LYS 588           HG1      LYS 588  65.444   3.524   6.839
 1140    HD2  LYS 588           HD2      LYS 588  63.409   3.201   5.212
 1141    HD3  LYS 588           HD1      LYS 588  63.156   3.946   6.770
 1142    HE2  LYS 588           HE2      LYS 588  62.799   6.061   5.835
 1143    HE3  LYS 588           HE1      LYS 588  63.767   5.701   4.424
 1144    HZ1  LYS 588           HZ1      LYS 588  62.068   4.708   3.378
 1145    HZ2  LYS 588           HZ2      LYS 588  61.135   5.695   4.399
 1146    HZ3  LYS 588           HZ3      LYS 588  61.408   4.068   4.803
 1147    H    GLU 589           HN       GLU 589  65.561   4.582   9.192
 1148    HA   GLU 589           HA       GLU 589  67.477   6.362  10.577
 1149    HB2  GLU 589           HB2      GLU 589  65.611   7.095  11.773
 1150    HB3  GLU 589           HB1      GLU 589  64.825   5.522  11.731
 1151    HG2  GLU 589           HG2      GLU 589  66.317   4.646  13.393
 1152    HG3  GLU 589           HG1      GLU 589  67.394   6.041  13.265
 1153    H    GLN 590           HN       GLN 590  68.698   5.319  12.135
 1154    HA   GLN 590           HA       GLN 590  68.556   2.423  12.486
 1155    HB2  GLN 590           HB2      GLN 590  69.877   3.005  10.276
 1156    HB3  GLN 590           HB1      GLN 590  71.141   3.529  11.376
 1157    HG2  GLN 590           HG2      GLN 590  71.757   1.306  11.160
 1158    HG3  GLN 590           HG1      GLN 590  70.641   1.155  12.515
 1159   HE21  GLN 590          HE21      GLN 590  71.379  -0.293   9.640
 1160   HE22  GLN 590          HE22      GLN 590  69.857  -0.918   9.226
 1161    H    ASN 591           HN       ASN 591  69.742   1.865  14.387
 1162    HA   ASN 591           HA       ASN 591  70.470   2.367  16.548
 1163    HB2  ASN 591           HB2      ASN 591  72.614   4.029  16.298
 1164    HB3  ASN 591           HB1      ASN 591  72.684   2.313  15.950
 1165   HD21  ASN 591          HD21      ASN 591  71.914   1.822  13.587
 1166   HD22  ASN 591          HD22      ASN 591  72.526   2.845  12.387
 1167    H    ASP 592           HN       ASP 592  68.424   4.243  15.331
 1168    HA   ASP 592           HA       ASP 592  67.175   6.000  16.292
 1169    HB2  ASP 592           HB2      ASP 592  69.496   6.804  18.026
 1170    HB3  ASP 592           HB1      ASP 592  67.770   6.970  18.334
 1171    H    LYS 593           HN       LYS 593  70.054   6.200  14.662
 1172    HA   LYS 593           HA       LYS 593  70.233   9.123  14.569
 1173    HB2  LYS 593           HB2      LYS 593  71.693   7.039  12.967
 1174    HB3  LYS 593           HB1      LYS 593  72.140   8.726  13.165
 1175    HG2  LYS 593           HG2      LYS 593  72.108   8.125  15.740
 1176    HG3  LYS 593           HG1      LYS 593  72.299   6.476  15.152
 1177    HD2  LYS 593           HD2      LYS 593  74.345   7.050  13.997
 1178    HD3  LYS 593           HD1      LYS 593  74.119   8.766  14.343
 1179    HE2  LYS 593           HE2      LYS 593  74.343   6.695  16.535
 1180    HE3  LYS 593           HE1      LYS 593  75.753   7.518  15.868
 1181    HZ1  LYS 593           HZ1      LYS 593  75.069   8.770  17.722
 1182    HZ2  LYS 593           HZ2      LYS 593  73.434   8.724  17.262
 1183    HZ3  LYS 593           HZ3      LYS 593  74.546   9.646  16.367
 1184    HA   PRO 594           HA       PRO 594  67.114   9.159  11.221
 1185    HB2  PRO 594           HB2      PRO 594  68.559  11.673  10.523
 1186    HB3  PRO 594           HB1      PRO 594  66.829  11.407  10.743
 1187    HG2  PRO 594           HG2      PRO 594  68.361  12.697  12.572
 1188    HG3  PRO 594           HG1      PRO 594  66.960  11.719  13.036
 1189    HD2  PRO 594           HD2      PRO 594  69.854  11.124  13.403
 1190    HD3  PRO 594           HD1      PRO 594  68.446  10.478  14.280
 1191    H    TYR 595           HN       TYR 595  67.235   9.159   8.781
 1192    HA   TYR 595           HA       TYR 595  69.824   9.117   7.469
 1193    HB2  TYR 595           HB2      TYR 595  68.597   6.571   8.443
 1194    HB3  TYR 595           HB1      TYR 595  69.378   6.543   6.874
 1195    HD1  TYR 595           HD1      TYR 595  71.741   7.892   6.902
 1196    HD2  TYR 595           HD2      TYR 595  69.938   5.881  10.233
 1197    HE1  TYR 595           HE1      TYR 595  73.981   7.604   7.948
 1198    HE2  TYR 595           HE2      TYR 595  72.173   5.603  11.270
 1199    HH   TYR 595           HH       TYR 595  74.336   6.015  11.109
 1200    H    CYS 596           HN       CYS 596  69.540   9.174   5.202
 1201    HA   CYS 596           HA       CYS 596  66.772   9.251   4.191
 1202    HB2  CYS 596           HB2      CYS 596  69.270   9.096   2.476
 1203    HB3  CYS 596           HB1      CYS 596  67.700   9.756   2.050
 1204    H    GLN 597           HN       GLN 597  66.028   7.562   2.620
 1205    HA   GLN 597           HA       GLN 597  66.802   4.969   3.519
 1206    HB2  GLN 597           HB2      GLN 597  64.688   4.941   2.522
 1207    HB3  GLN 597           HB1      GLN 597  65.168   6.027   1.251
 1208    HG2  GLN 597           HG2      GLN 597  64.974   4.033   0.064
 1209    HG3  GLN 597           HG1      GLN 597  66.672   3.985   0.494
 1210   HE21  GLN 597          HE21      GLN 597  66.149   3.398   3.345
 1211   HE22  GLN 597          HE22      GLN 597  65.630   1.804   3.409
 1212    H    ASN 598           HN       ASN 598  67.496   6.627   0.443
 1213    HA   ASN 598           HA       ASN 598  69.354   4.876  -0.648
 1214    HB2  ASN 598           HB2      ASN 598  70.001   7.808  -0.706
 1215    HB3  ASN 598           HB1      ASN 598  70.001   6.639  -2.020
 1216   HD21  ASN 598          HD21      ASN 598  67.592   5.605  -2.182
 1217   HD22  ASN 598          HD22      ASN 598  66.372   6.772  -2.301
 1218    H    CYS 599           HN       CYS 599  69.750   6.990   2.110
 1219    HA   CYS 599           HA       CYS 599  72.644   6.599   2.235
 1220    HB2  CYS 599           HB2      CYS 599  70.609   7.860   4.084
 1221    HB3  CYS 599           HB1      CYS 599  72.291   7.650   4.553
 1222    H    PHE 600           HN       PHE 600  70.009   5.756   4.527
 1223    HA   PHE 600           HA       PHE 600  71.463   3.892   6.043
 1224    HB2  PHE 600           HB2      PHE 600  69.460   4.269   7.095
 1225    HB3  PHE 600           HB1      PHE 600  68.612   4.542   5.582
 1226    HD1  PHE 600           HD1      PHE 600  67.722   2.621   4.283
 1227    HD2  PHE 600           HD2      PHE 600  69.515   2.097   8.146
 1228    HE1  PHE 600           HE1      PHE 600  66.711   0.363   4.443
 1229    HE2  PHE 600           HE2      PHE 600  68.501  -0.160   8.309
 1230    HZ   PHE 600           HZ       PHE 600  67.101  -1.028   6.458
 1231    H    LEU 601           HN       LEU 601  69.302   3.173   3.264
 1232    HA   LEU 601           HA       LEU 601  69.691   0.418   3.178
 1233    HB2  LEU 601           HB2      LEU 601  68.484   0.599   1.257
 1234    HB3  LEU 601           HB1      LEU 601  68.508   2.329   1.542
 1235    HG   LEU 601           HG       LEU 601  70.641   2.439   0.174
 1236   HD11  LEU 601          HD11      LEU 601  70.370   0.083  -1.394
 1237   HD12  LEU 601          HD12      LEU 601  70.343  -0.459   0.280
 1238   HD13  LEU 601          HD13      LEU 601  71.695   0.496  -0.313
 1239   HD21  LEU 601          HD21      LEU 601  69.481   2.471  -1.906
 1240   HD22  LEU 601          HD22      LEU 601  68.257   2.830  -0.696
 1241   HD23  LEU 601          HD23      LEU 601  68.360   1.215  -1.387
 1242    H    LYS 602           HN       LYS 602  71.807   2.952   1.873
 1243    HA   LYS 602           HA       LYS 602  73.692   1.203   0.676
 1244    HB2  LYS 602           HB2      LYS 602  73.529   3.763   0.475
 1245    HB3  LYS 602           HB1      LYS 602  74.415   3.818   1.991
 1246    HG2  LYS 602           HG2      LYS 602  76.116   3.950   0.402
 1247    HG3  LYS 602           HG1      LYS 602  76.108   2.235   0.789
 1248    HD2  LYS 602           HD2      LYS 602  74.432   2.075  -1.236
 1249    HD3  LYS 602           HD1      LYS 602  75.087   3.645  -1.669
 1250    HE2  LYS 602           HE2      LYS 602  77.387   2.672  -1.613
 1251    HE3  LYS 602           HE1      LYS 602  76.683   1.099  -1.248
 1252    HZ1  LYS 602           HZ1      LYS 602  75.577   1.061  -3.323
 1253    HZ2  LYS 602           HZ2      LYS 602  77.184   1.507  -3.644
 1254    HZ3  LYS 602           HZ3      LYS 602  75.958   2.682  -3.647
 1255    H    LEU 603           HN       LEU 603  73.086   1.868   4.019
 1256    HA   LEU 603           HA       LEU 603  75.756   0.875   4.832
 1257    HB2  LEU 603           HB2      LEU 603  73.499   1.478   6.730
 1258    HB3  LEU 603           HB1      LEU 603  75.240   1.608   6.996
 1259    HG   LEU 603           HG       LEU 603  73.549   3.363   5.212
 1260   HD11  LEU 603          HD11      LEU 603  73.930   5.093   6.757
 1261   HD12  LEU 603          HD12      LEU 603  75.263   4.233   7.529
 1262   HD13  LEU 603          HD13      LEU 603  73.599   3.692   7.775
 1263   HD21  LEU 603          HD21      LEU 603  75.760   4.633   4.975
 1264   HD22  LEU 603          HD22      LEU 603  75.632   3.119   4.085
 1265   HD23  LEU 603          HD23      LEU 603  76.538   3.177   5.595
 1266    H    PHE 604           HN       PHE 604  72.356  -0.060   5.540
 1267    HA   PHE 604           HA       PHE 604  73.332  -2.763   6.303
 1268    HB2  PHE 604           HB2      PHE 604  70.778  -1.221   6.678
 1269    HB3  PHE 604           HB1      PHE 604  70.695  -2.982   6.707
 1270    HD1  PHE 604           HD1      PHE 604  73.350  -0.615   7.923
 1271    HD2  PHE 604           HD2      PHE 604  70.470  -3.635   8.950
 1272    HE1  PHE 604           HE1      PHE 604  74.188  -0.623  10.254
 1273    HE2  PHE 604           HE2      PHE 604  71.310  -3.640  11.283
 1274    HZ   PHE 604           HZ       PHE 604  73.169  -2.135  11.934
 1275    H    CYS 605           HN       CYS 605  72.812  -1.408   3.442
 1276    HA   CYS 605           HA       CYS 605  72.138  -3.958   2.186
 1277    HB2  CYS 605           HB2      CYS 605  70.177  -1.677   2.263
 1278    HB3  CYS 605           HB1      CYS 605  70.227  -2.734   0.852
 1279    HG   CYS 605           HG       CYS 605  69.863  -3.989   3.686
  Start of MODEL   10
    1    H    MET   1           HT1      MET   1  96.666 -31.565  18.414
    2    HA   MET   1           HA       MET   1  96.357 -32.516  16.038
    3    HB2  MET   1           HB2      MET   1  94.651 -31.487  17.650
    4    HB3  MET   1           HB1      MET   1  94.876 -29.982  16.762
    5    HG2  MET   1           HG2      MET   1  94.319 -31.208  14.650
    6    HG3  MET   1           HG1      MET   1  93.965 -32.638  15.617
    7    HE1  MET   1           HE1      MET   1  92.411 -31.131  18.321
    8    HE2  MET   1           HE2      MET   1  92.615 -32.694  17.534
    9    HE3  MET   1           HE3      MET   1  91.009 -31.979  17.654
   10    H    ALA   2           HN       ALA   2  95.294 -29.460  15.140
   11    HA   ALA   2           HA       ALA   2  97.782 -28.762  13.662
   12    HB1  ALA   2           HB1      ALA   2  96.158 -28.473  11.595
   13    HB2  ALA   2           HB2      ALA   2  95.185 -29.674  12.445
   14    HB3  ALA   2           HB3      ALA   2  96.833 -30.062  11.958
   15    H    LEU   3           HN       LEU   3  94.381 -28.003  14.309
   16    HA   LEU   3           HA       LEU   3  94.472 -25.238  13.643
   17    HB2  LEU   3           HB2      LEU   3  92.834 -26.717  15.689
   18    HB3  LEU   3           HB1      LEU   3  92.482 -25.106  15.063
   19    HG   LEU   3           HG       LEU   3  92.561 -26.226  12.708
   20   HD11  LEU   3          HD11      LEU   3  91.580 -28.687  13.061
   21   HD12  LEU   3          HD12      LEU   3  92.564 -28.622  14.520
   22   HD13  LEU   3          HD13      LEU   3  93.309 -28.399  12.939
   23   HD21  LEU   3          HD21      LEU   3  90.541 -25.341  13.645
   24   HD22  LEU   3          HD22      LEU   3  90.367 -26.735  14.711
   25   HD23  LEU   3          HD23      LEU   3  90.171 -26.927  12.969
   26    H    ASP   4           HN       ASP   4  94.207 -26.645  16.866
   27    HA   ASP   4           HA       ASP   4  95.333 -24.279  18.087
   28    HB2  ASP   4           HB2      ASP   4  93.639 -25.664  19.243
   29    HB3  ASP   4           HB1      ASP   4  94.778 -27.012  19.264
   30    H    GLY   5           HN       GLY   5  96.860 -26.155  16.172
   31    HA2  GLY   5           HA2      GLY   5  99.004 -27.394  17.608
   32    HA3  GLY   5           HA1      GLY   5  99.085 -26.846  15.929
   33    H    ILE   6           HN       ILE   6  98.100 -24.219  17.127
   34    HA   ILE   6           HA       ILE   6 100.800 -23.139  17.826
   35    HB   ILE   6           HB       ILE   6  99.197 -20.972  17.073
   36   HG12  ILE   6          HG12      ILE   6  97.480 -22.719  16.366
   37   HG13  ILE   6          HG11      ILE   6  97.945 -21.543  15.143
   38   HG21  ILE   6          HG21      ILE   6 101.452 -21.189  16.331
   39   HG22  ILE   6          HG22      ILE   6 100.437 -21.122  14.891
   40   HG23  ILE   6          HG23      ILE   6 101.080 -22.669  15.446
   41   HD11  ILE   6          HD11      ILE   6  99.653 -23.947  15.101
   42   HD12  ILE   6          HD12      ILE   6  98.791 -23.152  13.788
   43   HD13  ILE   6          HD13      ILE   6  97.950 -24.300  14.824
   44    H    ARG   7           HN       ARG   7  97.858 -21.294  18.237
   45    HA   ARG   7           HA       ARG   7  97.696 -21.909  21.110
   46    HB2  ARG   7           HB2      ARG   7  97.907 -19.420  21.628
   47    HB3  ARG   7           HB1      ARG   7  99.392 -20.273  21.228
   48    HG2  ARG   7           HG2      ARG   7  97.999 -19.099  18.878
   49    HG3  ARG   7           HG1      ARG   7  98.607 -17.922  20.037
   50    HD2  ARG   7           HD2      ARG   7 100.846 -18.719  19.820
   51    HD3  ARG   7           HD1      ARG   7 100.319 -20.165  18.962
   52    HE   ARG   7           HE       ARG   7  99.441 -18.091  17.352
   53   HH11  ARG   7          HH11      ARG   7 100.700 -17.204  15.702
   54   HH12  ARG   7          HH12      ARG   7 102.426 -17.325  15.786
   55   HH21  ARG   7          HH21      ARG   7 102.424 -19.048  18.795
   56   HH22  ARG   7          HH22      ARG   7 103.402 -18.369  17.538
   57    H    MET   8           HN       MET   8  96.632 -18.797  19.972
   58    HA   MET   8           HA       MET   8  93.943 -19.843  19.329
   59    HB2  MET   8           HB2      MET   8  93.420 -17.722  21.169
   60    HB3  MET   8           HB1      MET   8  93.053 -19.423  21.357
   61    HG2  MET   8           HG2      MET   8  95.166 -19.883  22.387
   62    HG3  MET   8           HG1      MET   8  95.792 -18.287  22.026
   63    HE1  MET   8           HE1      MET   8  95.662 -17.980  25.732
   64    HE2  MET   8           HE2      MET   8  96.536 -18.585  24.326
   65    HE3  MET   8           HE3      MET   8  95.503 -19.674  25.248
   66    HA   PRO   9           HA       PRO   9  93.956 -15.024  18.180
   67    HB2  PRO   9           HB2      PRO   9  96.968 -14.870  18.198
   68    HB3  PRO   9           HB1      PRO   9  95.780 -13.558  18.386
   69    HG2  PRO   9           HG2      PRO   9  96.986 -14.532  20.502
   70    HG3  PRO   9           HG1      PRO   9  95.244 -14.198  20.540
   71    HD2  PRO   9           HD2      PRO   9  96.630 -16.843  20.389
   72    HD3  PRO   9           HD1      PRO   9  95.114 -16.398  21.166
   73    H    ASP  10           HN       ASP  10  96.506 -17.278  17.479
   74    HA   ASP  10           HA       ASP  10  96.054 -16.982  14.526
   75    HB2  ASP  10           HB2      ASP  10  98.391 -16.564  15.543
   76    HB3  ASP  10           HB1      ASP  10  98.443 -18.303  15.824
   77    H    GLY  11           HN       GLY  11  96.039 -19.103  17.256
   78    HA2  GLY  11           HA2      GLY  11  95.672 -21.516  15.596
   79    HA3  GLY  11           HA1      GLY  11  95.750 -21.467  17.352
   80    H    CYS  12           HN       CYS  12  93.715 -19.045  16.250
   81    HA   CYS  12           HA       CYS  12  91.307 -20.628  15.881
   82    HB2  CYS  12           HB2      CYS  12  91.491 -20.979  18.258
   83    HB3  CYS  12           HB1      CYS  12  91.816 -19.268  18.533
   84    HG   CYS  12           HG       CYS  12  89.268 -19.656  18.984
   85    H    TYR  13           HN       TYR  13  92.841 -17.506  16.460
   86    HA   TYR  13           HA       TYR  13  92.213 -15.349  15.851
   87    HB2  TYR  13           HB2      TYR  13  90.809 -16.988  13.720
   88    HB3  TYR  13           HB1      TYR  13  90.866 -15.229  13.712
   89    HD1  TYR  13           HD1      TYR  13  92.780 -18.318  13.233
   90    HD2  TYR  13           HD2      TYR  13  92.995 -14.031  13.390
   91    HE1  TYR  13           HE1      TYR  13  95.011 -18.391  12.154
   92    HE2  TYR  13           HE2      TYR  13  95.227 -14.104  12.311
   93    HH   TYR  13           HH       TYR  13  97.159 -16.030  12.212
   94    H    ALA  14           HN       ALA  14  89.220 -16.221  14.473
   95    HA   ALA  14           HA       ALA  14  87.375 -16.598  16.441
   96    HB1  ALA  14           HB1      ALA  14  87.901 -14.880  17.914
   97    HB2  ALA  14           HB2      ALA  14  86.794 -13.996  16.865
   98    HB3  ALA  14           HB3      ALA  14  88.538 -13.848  16.636
   99    H    ASP  15           HN       ASP  15  88.201 -14.324  13.881
  100    HA   ASP  15           HA       ASP  15  85.959 -15.246  12.290
  101    HB2  ASP  15           HB2      ASP  15  84.967 -13.594  13.959
  102    HB3  ASP  15           HB1      ASP  15  85.916 -12.354  13.140
  103    H    GLY  16           HN       GLY  16  88.994 -14.278  12.456
  104    HA2  GLY  16           HA2      GLY  16  90.524 -13.704  10.744
  105    HA3  GLY  16           HA1      GLY  16  89.157 -13.583   9.628
  106    H    THR  17           HN       THR  17  89.730 -11.962  12.718
  107    HA   THR  17           HA       THR  17  88.820  -9.436  11.644
  108    HB   THR  17           HB       THR  17  89.770  -8.666  14.001
  109    HG1  THR  17           HG1      THR  17  90.861 -10.302  14.773
  110   HG21  THR  17          HG21      THR  17  87.711  -9.768  15.072
  111   HG22  THR  17          HG22      THR  17  87.412 -10.477  13.485
  112   HG23  THR  17          HG23      THR  17  87.426  -8.723  13.680
  113    H    TRP  18           HN       TRP  18  89.997  -8.050  10.551
  114    HA   TRP  18           HA       TRP  18  92.859  -7.629  11.177
  115    HB2  TRP  18           HB2      TRP  18  92.848  -7.365   8.431
  116    HB3  TRP  18           HB1      TRP  18  93.406  -8.792   9.284
  117    HD1  TRP  18           HD1      TRP  18  89.797  -7.600   8.484
  118    HE1  TRP  18           HE1      TRP  18  88.571  -9.545   7.326
  119    HE3  TRP  18           HE3      TRP  18  93.583 -11.019   8.263
  120    HZ2  TRP  18           HZ2      TRP  18  89.122 -12.203   6.424
  121    HZ3  TRP  18           HZ3      TRP  18  93.205 -13.248   7.249
  122    HH2  TRP  18           HH2      TRP  18  90.981 -13.844   6.329
  123    H    GLU  19           HN       GLU  19  93.114  -5.440  11.467
  124    HA   GLU  19           HA       GLU  19  90.918  -3.675  10.798
  125    HB2  GLU  19           HB2      GLU  19  93.102  -1.997  11.413
  126    HB3  GLU  19           HB1      GLU  19  91.836  -2.513  12.518
  127    HG2  GLU  19           HG2      GLU  19  94.093  -2.992  13.384
  128    HG3  GLU  19           HG1      GLU  19  93.137  -4.457  13.156
  129    H    LEU  20           HN       LEU  20  90.608  -2.464   9.049
  130    HA   LEU  20           HA       LEU  20  92.528  -2.711   6.846
  131    HB2  LEU  20           HB2      LEU  20  89.729  -2.414   7.032
  132    HB3  LEU  20           HB1      LEU  20  90.269  -0.870   6.391
  133    HG   LEU  20           HG       LEU  20  89.832  -2.235   4.505
  134   HD11  LEU  20          HD11      LEU  20  92.772  -2.758   4.627
  135   HD12  LEU  20          HD12      LEU  20  92.220  -1.088   4.736
  136   HD13  LEU  20          HD13      LEU  20  91.791  -2.074   3.339
  137   HD21  LEU  20          HD21      LEU  20  91.142  -4.393   6.140
  138   HD22  LEU  20          HD22      LEU  20  91.147  -4.529   4.387
  139   HD23  LEU  20          HD23      LEU  20  89.621  -4.424   5.255
  140    H    SER  21           HN       SER  21  93.986  -1.142   6.333
  141    HA   SER  21           HA       SER  21  94.235   1.160   8.116
  142    HB2  SER  21           HB2      SER  21  96.089  -0.270   6.849
  143    HB3  SER  21           HB1      SER  21  95.801   0.918   5.575
  144    HG   SER  21           HG       SER  21  97.413   1.641   6.995
  145    H    VAL  22           HN       VAL  22  93.974   3.305   7.580
  146    HA   VAL  22           HA       VAL  22  92.794   3.883   4.907
  147    HB   VAL  22           HB       VAL  22  91.636   4.705   7.588
  148   HG11  VAL  22          HG11      VAL  22  91.227   5.990   4.866
  149   HG12  VAL  22          HG12      VAL  22  91.761   6.785   6.353
  150   HG13  VAL  22          HG13      VAL  22  90.116   6.188   6.222
  151   HG21  VAL  22          HG21      VAL  22  90.898   2.620   6.361
  152   HG22  VAL  22          HG22      VAL  22  90.363   3.681   5.047
  153   HG23  VAL  22          HG23      VAL  22  89.626   3.809   6.654
  154    H    HIS  23           HN       HIS  23  92.974   6.013   4.241
  155    HA   HIS  23           HA       HIS  23  94.995   7.709   5.645
  156    HB2  HIS  23           HB2      HIS  23  94.831   6.762   2.783
  157    HB3  HIS  23           HB1      HIS  23  95.477   8.370   3.107
  158    HD1  HIS  23           HD1      HIS  23  96.031   4.804   4.364
  159    HD2  HIS  23           HD2      HIS  23  98.180   8.309   3.680
  160    HE1  HIS  23           HE1      HIS  23  98.452   4.268   4.872
  161    H    VAL  24           HN       VAL  24  93.413   9.072   6.453
  162    HA   VAL  24           HA       VAL  24  91.097   9.801   4.877
  163    HB   VAL  24           HB       VAL  24  92.197  11.280   7.268
  164   HG11  VAL  24          HG11      VAL  24  89.851  11.837   7.627
  165   HG12  VAL  24          HG12      VAL  24  89.369  10.791   6.296
  166   HG13  VAL  24          HG13      VAL  24  90.284  12.263   5.973
  167   HG21  VAL  24          HG21      VAL  24  90.789   9.717   8.614
  168   HG22  VAL  24          HG22      VAL  24  92.136   8.904   7.818
  169   HG23  VAL  24          HG23      VAL  24  90.508   8.766   7.156
  170    H    THR  25           HN       THR  25  91.792  10.708   2.917
  171    HA   THR  25           HA       THR  25  93.834  12.726   2.764
  172    HB   THR  25           HB       THR  25  93.422  12.749   0.501
  173    HG1  THR  25           HG1      THR  25  90.989  12.383  -0.056
  174   HG21  THR  25          HG21      THR  25  91.578  10.430   1.105
  175   HG22  THR  25          HG22      THR  25  93.325  10.323   1.302
  176   HG23  THR  25          HG23      THR  25  92.636  10.640  -0.289
  177    H    ASP  26           HN       ASP  26  93.242  15.054   2.000
  178    HA   ASP  26           HA       ASP  26  92.129  17.086   2.435
  179    HB2  ASP  26           HB2      ASP  26  89.810  15.692   3.761
  180    HB3  ASP  26           HB1      ASP  26  89.813  17.108   2.712
  181    H    LEU  27           HN       LEU  27  91.802  14.556   4.895
  182    HA   LEU  27           HA       LEU  27  92.341  16.480   7.075
  183    HB2  LEU  27           HB2      LEU  27  90.723  14.294   7.004
  184    HB3  LEU  27           HB1      LEU  27  92.183  13.526   7.552
  185    HG   LEU  27           HG       LEU  27  92.291  14.984   9.495
  186   HD11  LEU  27          HD11      LEU  27  89.990  16.373   9.784
  187   HD12  LEU  27          HD12      LEU  27  90.177  16.484   8.034
  188   HD13  LEU  27          HD13      LEU  27  91.452  17.071   9.100
  189   HD21  LEU  27          HD21      LEU  27  89.443  14.002   9.204
  190   HD22  LEU  27          HD22      LEU  27  90.408  14.088  10.678
  191   HD23  LEU  27          HD23      LEU  27  90.811  12.912   9.427
  192    H    ASN  28           HN       ASN  28  93.681  13.863   5.236
  193    HA   ASN  28           HA       ASN  28  95.885  13.194   4.903
  194    HB2  ASN  28           HB2      ASN  28  96.356  15.718   5.266
  195    HB3  ASN  28           HB1      ASN  28  96.839  15.258   6.893
  196   HD21  ASN  28          HD21      ASN  28  97.653  12.545   5.611
  197   HD22  ASN  28          HD22      ASN  28  99.197  12.864   4.988
  198    H    ARG  29           HN       ARG  29  94.052  12.701   7.525
  199    HA   ARG  29           HA       ARG  29  96.190  11.715   9.292
  200    HB2  ARG  29           HB2      ARG  29  93.174  11.587   9.429
  201    HB3  ARG  29           HB1      ARG  29  94.245  10.905  10.656
  202    HG2  ARG  29           HG2      ARG  29  95.242  13.096  11.048
  203    HG3  ARG  29           HG1      ARG  29  94.253  13.798   9.777
  204    HD2  ARG  29           HD2      ARG  29  92.966  14.329  11.646
  205    HD3  ARG  29           HD1      ARG  29  92.264  12.772  11.202
  206    HE   ARG  29           HE       ARG  29  94.495  12.528  13.065
  207   HH11  ARG  29          HH11      ARG  29  93.949  11.798  15.135
  208   HH12  ARG  29          HH12      ARG  29  92.289  11.805  15.630
  209   HH21  ARG  29          HH21      ARG  29  91.124  13.099  12.630
  210   HH22  ARG  29          HH22      ARG  29  90.688  12.541  14.210
  211    H    ASP  30           HN       ASP  30  95.552   9.408  10.158
  212    HA   ASP  30           HA       ASP  30  94.784   7.594   7.964
  213    HB2  ASP  30           HB2      ASP  30  97.446   7.567   9.404
  214    HB3  ASP  30           HB1      ASP  30  96.789   6.128   8.622
  215    H    VAL  31           HN       VAL  31  93.348   6.219   8.789
  216    HA   VAL  31           HA       VAL  31  93.529   5.532  11.722
  217    HB   VAL  31           HB       VAL  31  90.972   5.858  10.164
  218   HG11  VAL  31          HG11      VAL  31  91.660   5.815  13.115
  219   HG12  VAL  31          HG12      VAL  31  90.827   4.543  12.220
  220   HG13  VAL  31          HG13      VAL  31  90.047   6.107  12.465
  221   HG21  VAL  31          HG21      VAL  31  90.809   8.106  11.280
  222   HG22  VAL  31          HG22      VAL  31  92.123   8.025  10.107
  223   HG23  VAL  31          HG23      VAL  31  92.472   7.912  11.831
  224    H    THR  32           HN       THR  32  92.568   3.484  12.308
  225    HA   THR  32           HA       THR  32  92.415   1.518  10.048
  226    HB   THR  32           HB       THR  32  93.209   0.191  12.488
  227    HG1  THR  32           HG1      THR  32  94.485   2.629  11.934
  228   HG21  THR  32          HG21      THR  32  95.096   0.863  10.240
  229   HG22  THR  32          HG22      THR  32  93.778  -0.284   9.990
  230   HG23  THR  32          HG23      THR  32  95.008  -0.608  11.209
  231    H    LEU  33           HN       LEU  33  90.707   0.077  10.143
  232    HA   LEU  33           HA       LEU  33  88.786   0.351  12.427
  233    HB2  LEU  33           HB2      LEU  33  88.471   0.350   9.463
  234    HB3  LEU  33           HB1      LEU  33  87.226  -0.485  10.364
  235    HG   LEU  33           HG       LEU  33  86.821   1.978   9.823
  236   HD11  LEU  33          HD11      LEU  33  85.600   0.626  11.551
  237   HD12  LEU  33          HD12      LEU  33  85.646   2.359  11.866
  238   HD13  LEU  33          HD13      LEU  33  86.710   1.275  12.758
  239   HD21  LEU  33          HD21      LEU  33  89.228   2.581  10.551
  240   HD22  LEU  33          HD22      LEU  33  88.603   2.520  12.199
  241   HD23  LEU  33          HD23      LEU  33  87.930   3.648  11.055
  242    H    ARG  34           HN       ARG  34  88.866  -1.460  13.601
  243    HA   ARG  34           HA       ARG  34  89.848  -3.979  12.746
  244    HB2  ARG  34           HB2      ARG  34  89.537  -3.217  15.143
  245    HB3  ARG  34           HB1      ARG  34  87.811  -3.492  14.928
  246    HG2  ARG  34           HG2      ARG  34  88.719  -5.484  15.927
  247    HG3  ARG  34           HG1      ARG  34  88.346  -5.853  14.246
  248    HD2  ARG  34           HD2      ARG  34  90.578  -5.975  13.630
  249    HD3  ARG  34           HD1      ARG  34  91.112  -4.886  14.910
  250    HE   ARG  34           HE       ARG  34  90.872  -7.761  15.128
  251   HH11  ARG  34          HH11      ARG  34  91.284  -8.649  17.165
  252   HH12  ARG  34          HH12      ARG  34  91.275  -7.623  18.561
  253   HH21  ARG  34          HH21      ARG  34  90.539  -4.747  16.770
  254   HH22  ARG  34          HH22      ARG  34  90.854  -5.415  18.337
  255    H    VAL  35           HN       VAL  35  88.925  -4.870  10.953
  256    HA   VAL  35           HA       VAL  35  85.951  -5.288  10.968
  257    HB   VAL  35           HB       VAL  35  86.107  -5.120   8.467
  258   HG11  VAL  35          HG11      VAL  35  86.860  -2.779  10.227
  259   HG12  VAL  35          HG12      VAL  35  85.262  -3.203   9.606
  260   HG13  VAL  35          HG13      VAL  35  86.497  -2.581   8.511
  261   HG21  VAL  35          HG21      VAL  35  88.115  -4.045   7.523
  262   HG22  VAL  35          HG22      VAL  35  88.527  -5.579   8.288
  263   HG23  VAL  35          HG23      VAL  35  88.875  -4.062   9.113
  264    H    THR  36           HN       THR  36  85.687  -6.850   8.830
  265    HA   THR  36           HA       THR  36  87.590  -9.118   9.026
  266    HB   THR  36           HB       THR  36  85.441 -10.611   9.103
  267    HG1  THR  36           HG1      THR  36  83.719  -9.618  10.135
  268   HG21  THR  36          HG21      THR  36  86.515  -9.065  11.461
  269   HG22  THR  36          HG22      THR  36  86.982 -10.678  10.921
  270   HG23  THR  36          HG23      THR  36  85.391 -10.413  11.631
  271    H    GLY  37           HN       GLY  37  87.049 -10.688   7.184
  272    HA2  GLY  37           HA2      GLY  37  86.563  -9.112   4.796
  273    HA3  GLY  37           HA1      GLY  37  86.924 -10.832   4.821
  274    H    GLU  38           HN       GLU  38  84.339  -8.924   6.304
  275    HA   GLU  38           HA       GLU  38  82.328 -10.136   4.545
  276    HB2  GLU  38           HB2      GLU  38  81.091 -11.217   6.275
  277    HB3  GLU  38           HB1      GLU  38  82.752 -11.768   6.448
  278    HG2  GLU  38           HG2      GLU  38  82.307 -11.200   8.660
  279    HG3  GLU  38           HG1      GLU  38  82.917  -9.655   8.070
  280    H    VAL  39           HN       VAL  39  83.520  -7.510   6.161
  281    HA   VAL  39           HA       VAL  39  80.960  -6.379   7.014
  282    HB   VAL  39           HB       VAL  39  82.174  -4.469   7.687
  283   HG11  VAL  39          HG11      VAL  39  84.142  -6.731   7.963
  284   HG12  VAL  39          HG12      VAL  39  82.654  -6.617   8.900
  285   HG13  VAL  39          HG13      VAL  39  83.896  -5.377   9.068
  286   HG21  VAL  39          HG21      VAL  39  83.412  -3.890   5.721
  287   HG22  VAL  39          HG22      VAL  39  84.314  -5.409   5.771
  288   HG23  VAL  39          HG23      VAL  39  84.603  -4.171   6.989
  289    H    HIS  40           HN       HIS  40  79.726  -4.933   5.856
  290    HA   HIS  40           HA       HIS  40  80.215  -4.820   2.971
  291    HB2  HIS  40           HB2      HIS  40  78.092  -3.139   4.269
  292    HB3  HIS  40           HB1      HIS  40  78.029  -4.080   2.777
  293    HD1  HIS  40           HD1      HIS  40  77.870  -4.495   6.534
  294    HD2  HIS  40           HD2      HIS  40  77.131  -6.720   3.087
  295    HE1  HIS  40           HE1      HIS  40  76.731  -6.627   7.289
  296    H    ILE  41           HN       ILE  41  80.916  -3.012   1.817
  297    HA   ILE  41           HA       ILE  41  82.699  -1.185   2.930
  298    HB   ILE  41           HB       ILE  41  80.814  -0.631   0.618
  299   HG12  ILE  41          HG12      ILE  41  83.621  -1.775   0.537
  300   HG13  ILE  41          HG11      ILE  41  82.161  -2.764   0.511
  301   HG21  ILE  41          HG21      ILE  41  81.890   1.404   1.228
  302   HG22  ILE  41          HG22      ILE  41  82.815   0.766  -0.138
  303   HG23  ILE  41          HG23      ILE  41  83.429   0.590   1.512
  304   HD11  ILE  41          HD11      ILE  41  82.365  -0.504  -1.445
  305   HD12  ILE  41          HD12      ILE  41  81.534  -2.049  -1.593
  306   HD13  ILE  41          HD13      ILE  41  83.287  -1.975  -1.756
  307    H    GLY  42           HN       GLY  42  79.289  -0.457   2.142
  308    HA2  GLY  42           HA2      GLY  42  79.245   2.072   3.392
  309    HA3  GLY  42           HA1      GLY  42  77.828   1.083   3.124
  310    H    GLY  43           HN       GLY  43  79.615  -0.970   4.752
  311    HA2  GLY  43           HA2      GLY  43  78.273  -0.376   7.304
  312    HA3  GLY  43           HA1      GLY  43  79.294  -1.780   6.954
  313    H    VAL  44           HN       VAL  44  81.251   0.002   5.714
  314    HA   VAL  44           HA       VAL  44  82.922   0.469   8.031
  315    HB   VAL  44           HB       VAL  44  83.269  -0.056   5.324
  316   HG11  VAL  44          HG11      VAL  44  82.953   2.189   4.546
  317   HG12  VAL  44          HG12      VAL  44  84.668   1.829   4.463
  318   HG13  VAL  44          HG13      VAL  44  84.046   2.837   5.753
  319   HG21  VAL  44          HG21      VAL  44  85.652   0.100   5.778
  320   HG22  VAL  44          HG22      VAL  44  84.788  -0.636   7.129
  321   HG23  VAL  44          HG23      VAL  44  85.327   1.046   7.234
  322    H    MET  45           HN       MET  45  81.541   2.688   5.540
  323    HA   MET  45           HA       MET  45  82.321   5.135   6.614
  324    HB2  MET  45           HB2      MET  45  79.488   4.660   5.650
  325    HB3  MET  45           HB1      MET  45  80.429   6.144   5.545
  326    HG2  MET  45           HG2      MET  45  82.057   4.843   4.068
  327    HG3  MET  45           HG1      MET  45  80.826   3.592   3.982
  328    HE1  MET  45           HE1      MET  45  78.380   4.170   3.676
  329    HE2  MET  45           HE2      MET  45  78.705   3.842   1.973
  330    HE3  MET  45           HE3      MET  45  77.783   5.277   2.437
  331    H    LEU  46           HN       LEU  46  79.857   2.930   7.767
  332    HA   LEU  46           HA       LEU  46  78.681   4.762   9.660
  333    HB2  LEU  46           HB2      LEU  46  77.621   2.662   8.727
  334    HB3  LEU  46           HB1      LEU  46  78.684   1.736   9.778
  335    HG   LEU  46           HG       LEU  46  77.260   3.890  11.240
  336   HD11  LEU  46          HD11      LEU  46  75.372   3.545   9.880
  337   HD12  LEU  46          HD12      LEU  46  75.092   2.472  11.250
  338   HD13  LEU  46          HD13      LEU  46  75.680   1.813   9.721
  339   HD21  LEU  46          HD21      LEU  46  76.806   2.030  12.800
  340   HD22  LEU  46          HD22      LEU  46  78.506   2.057  12.333
  341   HD23  LEU  46          HD23      LEU  46  77.413   0.878  11.610
  342    H    LYS  47           HN       LYS  47  81.481   2.583   9.847
  343    HA   LYS  47           HA       LYS  47  81.571   2.907  12.791
  344    HB2  LYS  47           HB2      LYS  47  83.610   1.616  10.962
  345    HB3  LYS  47           HB1      LYS  47  83.501   1.435  12.714
  346    HG2  LYS  47           HG2      LYS  47  81.193   0.474  12.384
  347    HG3  LYS  47           HG1      LYS  47  81.503   0.507  10.653
  348    HD2  LYS  47           HD2      LYS  47  83.754  -0.800  11.509
  349    HD3  LYS  47           HD1      LYS  47  82.600  -1.327  12.732
  350    HE2  LYS  47           HE2      LYS  47  82.254  -1.582   9.728
  351    HE3  LYS  47           HE1      LYS  47  82.627  -2.897  10.842
  352    HZ1  LYS  47           HZ1      LYS  47  80.450  -1.836  11.977
  353    HZ2  LYS  47           HZ2      LYS  47  80.410  -3.132  10.877
  354    HZ3  LYS  47           HZ3      LYS  47  80.113  -1.548  10.339
  355    H    LEU  48           HN       LEU  48  83.953   3.619  10.167
  356    HA   LEU  48           HA       LEU  48  85.786   5.037  11.692
  357    HB2  LEU  48           HB2      LEU  48  85.466   4.633   9.015
  358    HB3  LEU  48           HB1      LEU  48  85.087   6.339   9.084
  359    HG   LEU  48           HG       LEU  48  87.515   5.816  10.658
  360   HD11  LEU  48          HD11      LEU  48  87.982   5.255   7.746
  361   HD12  LEU  48          HD12      LEU  48  87.548   3.925   8.808
  362   HD13  LEU  48          HD13      LEU  48  88.991   4.872   9.136
  363   HD21  LEU  48          HD21      LEU  48  86.897   7.473   8.218
  364   HD22  LEU  48          HD22      LEU  48  88.489   7.434   8.969
  365   HD23  LEU  48          HD23      LEU  48  87.092   8.021   9.880
  366    H    VAL  49           HN       VAL  49  83.002   6.504  10.037
  367    HA   VAL  49           HA       VAL  49  83.221   9.106  11.075
  368    HB   VAL  49           HB       VAL  49  80.732   7.485  10.484
  369   HG11  VAL  49          HG11      VAL  49  81.119  10.417  11.123
  370   HG12  VAL  49          HG12      VAL  49  80.020   9.275  11.898
  371   HG13  VAL  49          HG13      VAL  49  79.708   9.820  10.249
  372   HG21  VAL  49          HG21      VAL  49  82.190   9.619   8.894
  373   HG22  VAL  49          HG22      VAL  49  80.775   8.708   8.365
  374   HG23  VAL  49          HG23      VAL  49  82.318   7.885   8.598
  375    H    GLU  50           HN       GLU  50  81.400   6.356  12.540
  376    HA   GLU  50           HA       GLU  50  80.437   7.638  14.823
  377    HB2  GLU  50           HB2      GLU  50  81.519   4.837  14.478
  378    HB3  GLU  50           HB1      GLU  50  80.846   5.384  16.010
  379    HG2  GLU  50           HG2      GLU  50  79.330   5.678  13.421
  380    HG3  GLU  50           HG1      GLU  50  79.238   4.205  14.382
  381    H    LYS  51           HN       LYS  51  83.714   6.376  14.286
  382    HA   LYS  51           HA       LYS  51  84.666   6.982  16.928
  383    HB2  LYS  51           HB2      LYS  51  86.135   6.666  14.297
  384    HB3  LYS  51           HB1      LYS  51  86.915   6.754  15.874
  385    HG2  LYS  51           HG2      LYS  51  85.799   4.746  16.620
  386    HG3  LYS  51           HG1      LYS  51  84.804   4.703  15.164
  387    HD2  LYS  51           HD2      LYS  51  86.627   4.123  13.782
  388    HD3  LYS  51           HD1      LYS  51  87.812   4.630  14.983
  389    HE2  LYS  51           HE2      LYS  51  87.056   2.775  16.467
  390    HE3  LYS  51           HE1      LYS  51  85.959   2.241  15.195
  391    HZ1  LYS  51           HZ1      LYS  51  88.755   1.801  15.459
  392    HZ2  LYS  51           HZ2      LYS  51  88.398   2.543  13.974
  393    HZ3  LYS  51           HZ3      LYS  51  87.650   1.077  14.395
  394    H    LEU  52           HN       LEU  52  84.617   8.829  13.881
  395    HA   LEU  52           HA       LEU  52  86.187  10.998  14.833
  396    HB2  LEU  52           HB2      LEU  52  84.888  10.197  12.438
  397    HB3  LEU  52           HB1      LEU  52  84.201  11.756  12.838
  398    HG   LEU  52           HG       LEU  52  86.116  12.111  11.436
  399   HD11  LEU  52          HD11      LEU  52  87.040  13.820  12.647
  400   HD12  LEU  52          HD12      LEU  52  87.388  12.801  14.041
  401   HD13  LEU  52          HD13      LEU  52  85.755  13.412  13.781
  402   HD21  LEU  52          HD21      LEU  52  87.996  10.840  13.410
  403   HD22  LEU  52          HD22      LEU  52  88.211  11.119  11.685
  404   HD23  LEU  52          HD23      LEU  52  87.161   9.819  12.239
  405    H    ASP  53           HN       ASP  53  82.705  11.053  14.141
  406    HA   ASP  53           HA       ASP  53  80.911  11.905  15.350
  407    HB2  ASP  53           HB2      ASP  53  82.406  10.949  17.266
  408    HB3  ASP  53           HB1      ASP  53  82.726  12.633  17.617
  409    H    VAL  54           HN       VAL  54  80.964  13.575  13.776
  410    HA   VAL  54           HA       VAL  54  81.188  16.200  14.945
  411    HB   VAL  54           HB       VAL  54  83.514  15.966  14.629
  412   HG11  VAL  54          HG11      VAL  54  84.464  15.223  12.438
  413   HG12  VAL  54          HG12      VAL  54  82.824  14.843  11.906
  414   HG13  VAL  54          HG13      VAL  54  83.534  13.975  13.272
  415   HG21  VAL  54          HG21      VAL  54  84.038  17.683  13.023
  416   HG22  VAL  54          HG22      VAL  54  82.447  18.077  13.675
  417   HG23  VAL  54          HG23      VAL  54  82.588  17.332  12.083
  418    H    LYS  55           HN       LYS  55  80.262  17.813  13.617
  419    HA   LYS  55           HA       LYS  55  78.297  16.849  11.760
  420    HB2  LYS  55           HB2      LYS  55  78.808  19.228  13.208
  421    HB3  LYS  55           HB1      LYS  55  78.837  19.718  11.526
  422    HG2  LYS  55           HG2      LYS  55  76.540  17.974  12.366
  423    HG3  LYS  55           HG1      LYS  55  76.557  19.610  12.980
  424    HD2  LYS  55           HD2      LYS  55  76.868  20.427  10.604
  425    HD3  LYS  55           HD1      LYS  55  76.587  18.772  10.070
  426    HE2  LYS  55           HE2      LYS  55  74.455  19.789   9.952
  427    HE3  LYS  55           HE1      LYS  55  74.412  18.902  11.476
  428    HZ1  LYS  55           HZ1      LYS  55  73.827  21.500  11.229
  429    HZ2  LYS  55           HZ2      LYS  55  75.470  21.588  11.652
  430    HZ3  LYS  55           HZ3      LYS  55  74.371  20.782  12.666
  431    H    LYS  56           HN       LYS  56  81.186  16.322  11.045
  432    HA   LYS  56           HA       LYS  56  81.695  18.019   8.717
  433    HB2  LYS  56           HB2      LYS  56  83.559  17.024   9.972
  434    HB3  LYS  56           HB1      LYS  56  82.992  15.409   9.570
  435    HG2  LYS  56           HG2      LYS  56  83.905  15.484   7.466
  436    HG3  LYS  56           HG1      LYS  56  83.316  17.115   7.173
  437    HD2  LYS  56           HD2      LYS  56  85.680  17.295   7.119
  438    HD3  LYS  56           HD1      LYS  56  85.228  17.918   8.700
  439    HE2  LYS  56           HE2      LYS  56  86.982  16.470   9.244
  440    HE3  LYS  56           HE1      LYS  56  85.588  15.418   9.470
  441    HZ1  LYS  56           HZ1      LYS  56  86.056  14.237   7.609
  442    HZ2  LYS  56           HZ2      LYS  56  87.639  14.727   7.988
  443    HZ3  LYS  56           HZ3      LYS  56  86.752  15.553   6.797
  444    H    ASP  57           HN       ASP  57  81.490  17.410   6.548
  445    HA   ASP  57           HA       ASP  57  79.258  15.698   5.917
  446    HB2  ASP  57           HB2      ASP  57  81.332  16.635   3.929
  447    HB3  ASP  57           HB1      ASP  57  79.611  16.358   3.671
  448    H    TRP  58           HN       TRP  58  79.422  13.506   6.072
  449    HA   TRP  58           HA       TRP  58  82.010  12.198   5.365
  450    HB2  TRP  58           HB2      TRP  58  79.668  11.256   7.027
  451    HB3  TRP  58           HB1      TRP  58  81.093  10.291   6.666
  452    HD1  TRP  58           HD1      TRP  58  79.790  12.487   9.226
  453    HE1  TRP  58           HE1      TRP  58  81.663  13.425  10.729
  454    HE3  TRP  58           HE3      TRP  58  83.877  11.295   6.395
  455    HZ2  TRP  58           HZ2      TRP  58  84.511  13.646  10.723
  456    HZ3  TRP  58           HZ3      TRP  58  86.154  11.884   7.169
  457    HH2  TRP  58           HH2      TRP  58  86.477  13.056   9.328
  458    H    SER  59           HN       SER  59  78.491  11.926   4.884
  459    HA   SER  59           HA       SER  59  78.330   9.655   3.301
  460    HB2  SER  59           HB2      SER  59  76.362  10.988   3.877
  461    HB3  SER  59           HB1      SER  59  76.913  12.287   2.820
  462    HG   SER  59           HG       SER  59  76.860   9.868   1.573
  463    H    ASP  60           HN       ASP  60  78.960  12.948   2.030
  464    HA   ASP  60           HA       ASP  60  79.449  12.235  -0.645
  465    HB2  ASP  60           HB2      ASP  60  79.413  14.571   0.009
  466    HB3  ASP  60           HB1      ASP  60  80.794  14.338   1.082
  467    H    HIS  61           HN       HIS  61  81.479  11.927   2.202
  468    HA   HIS  61           HA       HIS  61  83.862  11.142   0.782
  469    HB2  HIS  61           HB2      HIS  61  84.823  11.315   2.844
  470    HB3  HIS  61           HB1      HIS  61  83.253  11.865   3.410
  471    HD1  HIS  61           HD1      HIS  61  82.127  10.425   5.136
  472    HD2  HIS  61           HD2      HIS  61  85.140   8.366   3.126
  473    HE1  HIS  61           HE1      HIS  61  82.334   8.173   6.272
  474    H    ALA  62           HN       ALA  62  84.033   9.368  -0.337
  475    HA   ALA  62           HA       ALA  62  82.706   6.857   0.631
  476    HB1  ALA  62           HB1      ALA  62  82.940   8.080  -2.105
  477    HB2  ALA  62           HB2      ALA  62  81.561   7.265  -1.363
  478    HB3  ALA  62           HB3      ALA  62  82.925   6.320  -1.961
  479    H    LEU  63           HN       LEU  63  84.023   4.891  -0.073
  480    HA   LEU  63           HA       LEU  63  86.890   5.550   0.342
  481    HB2  LEU  63           HB2      LEU  63  85.758   2.772   0.211
  482    HB3  LEU  63           HB1      LEU  63  87.198   3.332   1.033
  483    HG   LEU  63           HG       LEU  63  85.598   3.004   2.724
  484   HD11  LEU  63          HD11      LEU  63  85.302   5.947   2.205
  485   HD12  LEU  63          HD12      LEU  63  86.862   5.245   2.605
  486   HD13  LEU  63          HD13      LEU  63  85.520   5.119   3.734
  487   HD21  LEU  63          HD21      LEU  63  83.337   3.267   2.527
  488   HD22  LEU  63          HD22      LEU  63  83.640   3.358   0.800
  489   HD23  LEU  63          HD23      LEU  63  83.475   4.835   1.744
  490    H    TRP  64           HN       TRP  64  88.484   5.110  -1.005
  491    HA   TRP  64           HA       TRP  64  87.802   3.892  -3.667
  492    HB2  TRP  64           HB2      TRP  64  88.233   5.881  -4.675
  493    HB3  TRP  64           HB1      TRP  64  88.460   6.613  -3.110
  494    HD1  TRP  64           HD1      TRP  64  91.202   5.841  -2.157
  495    HE1  TRP  64           HE1      TRP  64  93.344   6.336  -3.489
  496    HE3  TRP  64           HE3      TRP  64  89.212   6.476  -6.816
  497    HZ2  TRP  64           HZ2      TRP  64  94.115   6.963  -6.172
  498    HZ3  TRP  64           HZ3      TRP  64  90.671   7.045  -8.737
  499    HH2  TRP  64           HH2      TRP  64  93.118   7.291  -8.422
  500    H    TRP  65           HN       TRP  65  89.338   2.501  -4.481
  501    HA   TRP  65           HA       TRP  65  91.546   1.760  -2.622
  502    HB2  TRP  65           HB2      TRP  65  89.771   0.091  -3.468
  503    HB3  TRP  65           HB1      TRP  65  90.585   0.196  -5.025
  504    HD1  TRP  65           HD1      TRP  65  93.392   0.546  -2.892
  505    HE1  TRP  65           HE1      TRP  65  94.515  -1.704  -2.348
  506    HE3  TRP  65           HE3      TRP  65  89.640  -2.659  -4.206
  507    HZ2  TRP  65           HZ2      TRP  65  93.907  -4.493  -2.445
  508    HZ3  TRP  65           HZ3      TRP  65  89.945  -5.104  -3.972
  509    HH2  TRP  65           HH2      TRP  65  92.068  -6.027  -3.091
  510    H    GLU  66           HN       GLU  66  93.105   3.365  -3.290
  511    HA   GLU  66           HA       GLU  66  93.653   4.093  -5.950
  512    HB2  GLU  66           HB2      GLU  66  95.969   4.671  -5.121
  513    HB3  GLU  66           HB1      GLU  66  94.633   5.393  -4.242
  514    HG2  GLU  66           HG2      GLU  66  94.792   3.502  -2.590
  515    HG3  GLU  66           HG1      GLU  66  96.243   2.994  -3.437
  516    H    LYS  67           HN       LYS  67  94.484   1.090  -4.356
  517    HA   LYS  67           HA       LYS  67  96.666   0.399  -6.104
  518    HB2  LYS  67           HB2      LYS  67  94.654  -1.349  -4.707
  519    HB3  LYS  67           HB1      LYS  67  95.994  -1.974  -5.632
  520    HG2  LYS  67           HG2      LYS  67  96.205  -1.667  -3.020
  521    HG3  LYS  67           HG1      LYS  67  97.565  -1.372  -4.060
  522    HD2  LYS  67           HD2      LYS  67  97.177   1.017  -3.971
  523    HD3  LYS  67           HD1      LYS  67  95.696   0.771  -3.042
  524    HE2  LYS  67           HE2      LYS  67  97.783   1.391  -1.700
  525    HE3  LYS  67           HE1      LYS  67  96.897  -0.034  -1.154
  526    HZ1  LYS  67           HZ1      LYS  67  99.392  -0.256  -1.376
  527    HZ2  LYS  67           HZ2      LYS  67  99.153  -0.221  -3.058
  528    HZ3  LYS  67           HZ3      LYS  67  98.457  -1.458  -2.123
  529    H    LYS  68           HN       LYS  68  93.309   0.746  -6.359
  530    HA   LYS  68           HA       LYS  68  93.215  -0.487  -9.081
  531    HB2  LYS  68           HB2      LYS  68  90.746  -0.139  -7.391
  532    HB3  LYS  68           HB1      LYS  68  91.076  -1.326  -8.649
  533    HG2  LYS  68           HG2      LYS  68  92.569  -1.350  -6.006
  534    HG3  LYS  68           HG1      LYS  68  91.037  -2.168  -6.224
  535    HD2  LYS  68           HD2      LYS  68  91.902  -3.606  -7.908
  536    HD3  LYS  68           HD1      LYS  68  93.357  -2.628  -8.097
  537    HE2  LYS  68           HE2      LYS  68  94.319  -3.449  -6.146
  538    HE3  LYS  68           HE1      LYS  68  92.771  -3.823  -5.400
  539    HZ1  LYS  68           HZ1      LYS  68  93.035  -5.325  -7.753
  540    HZ2  LYS  68           HZ2      LYS  68  92.935  -5.879  -6.150
  541    HZ3  LYS  68           HZ3      LYS  68  94.448  -5.525  -6.837
  542    H    ARG  69           HN       ARG  69  92.884   2.354  -7.214
  543    HA   ARG  69           HA       ARG  69  92.056   4.487  -7.707
  544    HB2  ARG  69           HB2      ARG  69  92.623   3.434 -10.501
  545    HB3  ARG  69           HB1      ARG  69  92.049   5.066 -10.204
  546    HG2  ARG  69           HG2      ARG  69  94.352   5.425 -10.233
  547    HG3  ARG  69           HG1      ARG  69  94.093   5.164  -8.511
  548    HD2  ARG  69           HD2      ARG  69  95.949   3.785  -9.110
  549    HD3  ARG  69           HD1      ARG  69  94.568   2.704  -8.951
  550    HE   ARG  69           HE       ARG  69  95.041   3.703 -11.673
  551   HH11  ARG  69          HH11      ARG  69  95.515   2.100 -13.191
  552   HH12  ARG  69          HH12      ARG  69  95.908   0.501 -12.651
  553   HH21  ARG  69          HH21      ARG  69  95.580   1.266  -9.287
  554   HH22  ARG  69          HH22      ARG  69  95.944   0.031 -10.444
  555    H    THR  70           HN       THR  70  90.179   2.599  -7.063
  556    HA   THR  70           HA       THR  70  87.934   3.033  -9.013
  557    HB   THR  70           HB       THR  70  88.719   0.678  -8.368
  558    HG1  THR  70           HG1      THR  70  86.779   0.172  -8.938
  559   HG21  THR  70          HG21      THR  70  87.093   1.042  -5.882
  560   HG22  THR  70          HG22      THR  70  88.810   1.443  -5.858
  561   HG23  THR  70          HG23      THR  70  88.293  -0.197  -6.254
  562    H    TRP  71           HN       TRP  71  85.795   2.665  -7.562
  563    HA   TRP  71           HA       TRP  71  85.942   4.451  -5.179
  564    HB2  TRP  71           HB2      TRP  71  83.464   5.006  -6.090
  565    HB3  TRP  71           HB1      TRP  71  84.862   5.947  -6.578
  566    HD1  TRP  71           HD1      TRP  71  83.162   2.681  -7.837
  567    HE1  TRP  71           HE1      TRP  71  83.180   2.705 -10.364
  568    HE3  TRP  71           HE3      TRP  71  85.548   7.121  -8.636
  569    HZ2  TRP  71           HZ2      TRP  71  84.080   4.383 -12.516
  570    HZ3  TRP  71           HZ3      TRP  71  85.971   7.907 -10.949
  571    HH2  TRP  71           HH2      TRP  71  85.241   6.545 -12.888
  572    H    LEU  72           HN       LEU  72  85.775   2.783  -3.706
  573    HA   LEU  72           HA       LEU  72  84.303   0.409  -4.162
  574    HB2  LEU  72           HB2      LEU  72  84.949   1.659  -1.505
  575    HB3  LEU  72           HB1      LEU  72  84.608  -0.037  -1.795
  576    HG   LEU  72           HG       LEU  72  86.851   1.379  -3.232
  577   HD11  LEU  72          HD11      LEU  72  87.469   1.739  -0.990
  578   HD12  LEU  72          HD12      LEU  72  88.333   0.275  -1.462
  579   HD13  LEU  72          HD13      LEU  72  86.867   0.160  -0.484
  580   HD21  LEU  72          HD21      LEU  72  86.361  -0.716  -4.232
  581   HD22  LEU  72          HD22      LEU  72  86.135  -1.503  -2.668
  582   HD23  LEU  72          HD23      LEU  72  87.748  -1.027  -3.190
  583    H    LEU  73           HN       LEU  73  82.346   1.127  -5.015
  584    HA   LEU  73           HA       LEU  73  80.342   2.147  -3.039
  585    HB2  LEU  73           HB2      LEU  73  78.976   2.784  -5.079
  586    HB3  LEU  73           HB1      LEU  73  80.450   3.716  -4.849
  587    HG   LEU  73           HG       LEU  73  81.450   1.785  -6.467
  588   HD11  LEU  73          HD11      LEU  73  79.943   0.974  -8.075
  589   HD12  LEU  73          HD12      LEU  73  78.694   2.143  -7.644
  590   HD13  LEU  73          HD13      LEU  73  79.035   0.791  -6.577
  591   HD21  LEU  73          HD21      LEU  73  80.984   3.337  -8.380
  592   HD22  LEU  73          HD22      LEU  73  81.586   4.164  -6.950
  593   HD23  LEU  73          HD23      LEU  73  79.876   4.225  -7.339
  594    H    LYS  74           HN       LYS  74  81.445  -0.642  -3.943
  595    HA   LYS  74           HA       LYS  74  78.989  -1.942  -4.912
  596    HB2  LYS  74           HB2      LYS  74  81.812  -2.814  -4.353
  597    HB3  LYS  74           HB1      LYS  74  80.553  -4.040  -4.394
  598    HG2  LYS  74           HG2      LYS  74  81.569  -3.786  -6.617
  599    HG3  LYS  74           HG1      LYS  74  79.882  -3.295  -6.648
  600    HD2  LYS  74           HD2      LYS  74  81.287  -1.692  -7.881
  601    HD3  LYS  74           HD1      LYS  74  80.558  -0.935  -6.472
  602    HE2  LYS  74           HE2      LYS  74  83.116  -0.570  -6.955
  603    HE3  LYS  74           HE1      LYS  74  82.577  -0.849  -5.304
  604    HZ1  LYS  74           HZ1      LYS  74  83.064  -3.223  -5.627
  605    HZ2  LYS  74           HZ2      LYS  74  84.446  -2.246  -5.781
  606    HZ3  LYS  74           HZ3      LYS  74  83.687  -2.874  -7.166
  607    H    THR  75           HN       THR  75  77.955  -0.981  -2.817
  608    HA   THR  75           HA       THR  75  78.556  -2.156  -0.276
  609    HB   THR  75           HB       THR  75  75.776  -1.264  -1.042
  610    HG1  THR  75           HG1      THR  75  76.690   0.470  -1.782
  611   HG21  THR  75          HG21      THR  75  76.730  -2.045   1.346
  612   HG22  THR  75          HG22      THR  75  75.557  -0.737   1.204
  613   HG23  THR  75          HG23      THR  75  77.270  -0.364   1.389
  614    H    HIS  76           HN       HIS  76  77.312  -3.583  -3.053
  615    HA   HIS  76           HA       HIS  76  75.489  -5.451  -1.701
  616    HB2  HIS  76           HB2      HIS  76  76.533  -5.275  -4.538
  617    HB3  HIS  76           HB1      HIS  76  75.428  -6.535  -3.987
  618    HD1  HIS  76           HD1      HIS  76  73.397  -5.714  -5.342
  619    HD2  HIS  76           HD2      HIS  76  74.972  -2.797  -2.814
  620    HE1  HIS  76           HE1      HIS  76  71.717  -3.819  -5.302
  621    H    TRP  77           HN       TRP  77  78.797  -5.485  -2.969
  622    HA   TRP  77           HA       TRP  77  79.111  -8.343  -2.278
  623    HB2  TRP  77           HB2      TRP  77  80.966  -6.288  -3.500
  624    HB3  TRP  77           HB1      TRP  77  81.444  -7.938  -3.158
  625    HD1  TRP  77           HD1      TRP  77  80.261  -5.949  -5.858
  626    HE1  TRP  77           HE1      TRP  77  79.164  -7.365  -7.677
  627    HE3  TRP  77           HE3      TRP  77  79.572 -10.343  -3.327
  628    HZ2  TRP  77           HZ2      TRP  77  78.112  -9.989  -8.057
  629    HZ3  TRP  77           HZ3      TRP  77  78.519 -12.278  -4.448
  630    HH2  TRP  77           HH2      TRP  77  77.788 -12.109  -6.810
  631    H    THR  78           HN       THR  78  81.830  -8.241  -1.470
  632    HA   THR  78           HA       THR  78  81.936  -6.477   0.889
  633    HB   THR  78           HB       THR  78  82.513  -9.307   1.618
  634    HG1  THR  78           HG1      THR  78  80.669  -9.429   0.181
  635   HG21  THR  78          HG21      THR  78  80.889  -8.628   3.499
  636   HG22  THR  78          HG22      THR  78  80.997  -6.999   2.851
  637   HG23  THR  78          HG23      THR  78  82.454  -7.817   3.439
  638    H    LEU  79           HN       LEU  79  84.034  -6.848   2.039
  639    HA   LEU  79           HA       LEU  79  86.281  -6.345   0.529
  640    HB2  LEU  79           HB2      LEU  79  85.924  -7.761   3.153
  641    HB3  LEU  79           HB1      LEU  79  87.537  -7.506   2.502
  642    HG   LEU  79           HG       LEU  79  87.172  -5.083   2.504
  643   HD11  LEU  79          HD11      LEU  79  84.810  -4.924   2.055
  644   HD12  LEU  79          HD12      LEU  79  85.071  -4.242   3.661
  645   HD13  LEU  79          HD13      LEU  79  84.423  -5.870   3.493
  646   HD21  LEU  79          HD21      LEU  79  86.844  -4.818   5.013
  647   HD22  LEU  79          HD22      LEU  79  88.063  -6.006   4.546
  648   HD23  LEU  79          HD23      LEU  79  86.468  -6.542   5.068
  649    H    ASP  80           HN       ASP  80  85.627  -9.501   1.991
  650    HA   ASP  80           HA       ASP  80  87.509 -11.110   0.794
  651    HB2  ASP  80           HB2      ASP  80  85.767 -11.834   2.414
  652    HB3  ASP  80           HB1      ASP  80  84.582 -11.811   1.107
  653    H    LYS  81           HN       LYS  81  84.317 -10.389  -0.536
  654    HA   LYS  81           HA       LYS  81  84.381 -11.788  -2.898
  655    HB2  LYS  81           HB2      LYS  81  83.471  -8.922  -2.858
  656    HB3  LYS  81           HB1      LYS  81  82.779 -10.274  -3.747
  657    HG2  LYS  81           HG2      LYS  81  82.672  -9.785  -0.770
  658    HG3  LYS  81           HG1      LYS  81  81.316  -9.853  -1.887
  659    HD2  LYS  81           HD2      LYS  81  82.020 -12.250  -2.382
  660    HD3  LYS  81           HD1      LYS  81  83.063 -12.126  -0.970
  661    HE2  LYS  81           HE2      LYS  81  81.099 -13.013  -0.050
  662    HE3  LYS  81           HE1      LYS  81  80.897 -11.286   0.239
  663    HZ1  LYS  81           HZ1      LYS  81  79.051 -11.359  -0.950
  664    HZ2  LYS  81           HZ2      LYS  81  79.287 -13.007  -1.290
  665    HZ3  LYS  81           HZ3      LYS  81  79.941 -11.823  -2.318
  666    H    TYR  82           HN       TYR  82  85.608  -8.477  -2.476
  667    HA   TYR  82           HA       TYR  82  86.886  -8.543  -5.109
  668    HB2  TYR  82           HB2      TYR  82  86.660  -6.575  -2.863
  669    HB3  TYR  82           HB1      TYR  82  88.010  -6.373  -3.974
  670    HD1  TYR  82           HD1      TYR  82  84.391  -6.152  -3.560
  671    HD2  TYR  82           HD2      TYR  82  87.604  -6.042  -6.407
  672    HE1  TYR  82           HE1      TYR  82  82.870  -5.146  -5.239
  673    HE2  TYR  82           HE2      TYR  82  86.086  -5.031  -8.085
  674    HH   TYR  82           HH       TYR  82  83.932  -4.584  -8.574
  675    H    GLY  83           HN       GLY  83  87.996  -8.876  -1.741
  676    HA2  GLY  83           HA2      GLY  83  89.845 -10.528  -1.382
  677    HA3  GLY  83           HA1      GLY  83  90.629  -9.869  -2.818
  678    H    ILE  84           HN       ILE  84  89.074  -7.482  -1.016
  679    HA   ILE  84           HA       ILE  84  91.476  -6.081  -0.406
  680    HB   ILE  84           HB       ILE  84  88.700  -5.850   0.797
  681   HG12  ILE  84          HG12      ILE  84  89.943  -4.012  -1.252
  682   HG13  ILE  84          HG11      ILE  84  89.164  -5.507  -1.760
  683   HG21  ILE  84          HG21      ILE  84  91.095  -3.986   0.883
  684   HG22  ILE  84          HG22      ILE  84  90.308  -4.762   2.257
  685   HG23  ILE  84          HG23      ILE  84  89.461  -3.516   1.351
  686   HD11  ILE  84          HD11      ILE  84  87.750  -3.297  -1.618
  687   HD12  ILE  84          HD12      ILE  84  87.716  -3.643   0.110
  688   HD13  ILE  84          HD13      ILE  84  87.052  -4.807  -1.038
  689    H    GLN  85           HN       GLN  85  92.307  -5.620   1.790
  690    HA   GLN  85           HA       GLN  85  91.600  -7.256   4.048
  691    HB2  GLN  85           HB2      GLN  85  92.924  -8.753   2.231
  692    HB3  GLN  85           HB1      GLN  85  94.311  -8.029   3.029
  693    HG2  GLN  85           HG2      GLN  85  94.023  -9.904   4.378
  694    HG3  GLN  85           HG1      GLN  85  92.995  -8.761   5.238
  695   HE21  GLN  85          HE21      GLN  85  90.748  -8.704   3.558
  696   HE22  GLN  85          HE22      GLN  85  90.018 -10.228   3.548
  697    H    ALA  86           HN       ALA  86  93.997  -7.309   5.410
  698    HA   ALA  86           HA       ALA  86  94.344  -4.572   6.191
  699    HB1  ALA  86           HB1      ALA  86  95.805  -7.138   6.781
  700    HB2  ALA  86           HB2      ALA  86  94.766  -6.200   7.855
  701    HB3  ALA  86           HB3      ALA  86  96.371  -5.601   7.435
  702    H    ASP  87           HN       ASP  87  95.916  -6.574   3.818
  703    HA   ASP  87           HA       ASP  87  98.311  -4.915   3.647
  704    HB2  ASP  87           HB2      ASP  87  98.629  -6.237   1.485
  705    HB3  ASP  87           HB1      ASP  87  98.554  -7.194   2.966
  706    H    ALA  88           HN       ALA  88  95.123  -4.564   2.720
  707    HA   ALA  88           HA       ALA  88  95.730  -2.886   0.338
  708    HB1  ALA  88           HB1      ALA  88  93.295  -4.186   1.502
  709    HB2  ALA  88           HB2      ALA  88  93.931  -4.313  -0.130
  710    HB3  ALA  88           HB3      ALA  88  93.099  -2.842   0.378
  711    H    LYS  89           HN       LYS  89  96.186  -0.774   0.865
  712    HA   LYS  89           HA       LYS  89  94.963   0.407   3.305
  713    HB2  LYS  89           HB2      LYS  89  96.824   1.899   1.468
  714    HB3  LYS  89           HB1      LYS  89  96.609   2.066   3.209
  715    HG2  LYS  89           HG2      LYS  89  97.847  -0.347   1.847
  716    HG3  LYS  89           HG1      LYS  89  98.744   0.956   2.602
  717    HD2  LYS  89           HD2      LYS  89  97.930   0.413   4.775
  718    HD3  LYS  89           HD1      LYS  89  96.704  -0.673   4.123
  719    HE2  LYS  89           HE2      LYS  89  98.622  -1.935   5.020
  720    HE3  LYS  89           HE1      LYS  89  98.445  -2.170   3.280
  721    HZ1  LYS  89           HZ1      LYS  89 100.074   0.089   3.896
  722    HZ2  LYS  89           HZ2      LYS  89 100.416  -1.251   2.908
  723    HZ3  LYS  89           HZ3      LYS  89 100.700  -1.331   4.581
  724    H    LEU  90           HN       LEU  90  93.135   1.437   3.150
  725    HA   LEU  90           HA       LEU  90  92.209   2.449   0.501
  726    HB2  LEU  90           HB2      LEU  90  90.551   2.333   3.014
  727    HB3  LEU  90           HB1      LEU  90  90.008   2.347   1.335
  728    HG   LEU  90           HG       LEU  90  91.504   0.124   2.721
  729   HD11  LEU  90          HD11      LEU  90  89.206   0.072   3.371
  730   HD12  LEU  90          HD12      LEU  90  89.365  -1.125   2.086
  731   HD13  LEU  90          HD13      LEU  90  88.667   0.455   1.736
  732   HD21  LEU  90          HD21      LEU  90  92.288   0.106   0.480
  733   HD22  LEU  90          HD22      LEU  90  90.705   0.552  -0.164
  734   HD23  LEU  90          HD23      LEU  90  90.972  -1.067   0.491
  735    H    GLN  91           HN       GLN  91  90.736   4.466   0.783
  736    HA   GLN  91           HA       GLN  91  91.963   6.450   2.632
  737    HB2  GLN  91           HB2      GLN  91  91.203   7.131  -0.212
  738    HB3  GLN  91           HB1      GLN  91  92.102   8.117   0.930
  739    HG2  GLN  91           HG2      GLN  91  94.078   6.900   0.646
  740    HG3  GLN  91           HG1      GLN  91  93.244   5.466   0.087
  741   HE21  GLN  91          HE21      GLN  91  92.099   8.399  -1.241
  742   HE22  GLN  91          HE22      GLN  91  92.830   8.244  -2.754
  743    H    PHE  92           HN       PHE  92  90.475   8.004   3.308
  744    HA   PHE  92           HA       PHE  92  87.610   7.443   2.631
  745    HB2  PHE  92           HB2      PHE  92  89.063   8.089   5.158
  746    HB3  PHE  92           HB1      PHE  92  87.451   8.751   4.996
  747    HD1  PHE  92           HD1      PHE  92  85.860   7.484   6.138
  748    HD2  PHE  92           HD2      PHE  92  89.070   5.471   4.117
  749    HE1  PHE  92           HE1      PHE  92  84.953   5.298   6.869
  750    HE2  PHE  92           HE2      PHE  92  88.144   3.287   4.841
  751    HZ   PHE  92           HZ       PHE  92  86.129   3.202   6.236
  752    H    THR  93           HN       THR  93  87.349   8.932   0.966
  753    HA   THR  93           HA       THR  93  87.302  11.765   1.742
  754    HB   THR  93           HB       THR  93  89.595  11.655   1.188
  755    HG1  THR  93           HG1      THR  93  88.697  12.267  -1.370
  756   HG21  THR  93          HG21      THR  93  90.387  10.546  -0.917
  757   HG22  THR  93          HG22      THR  93  88.743   9.968  -1.180
  758   HG23  THR  93          HG23      THR  93  89.655   9.421   0.226
  759    HA   PRO  94           HA       PRO  94  83.888  12.310  -1.102
  760    HB2  PRO  94           HB2      PRO  94  85.790  14.242  -2.412
  761    HB3  PRO  94           HB1      PRO  94  84.050  14.424  -2.095
  762    HG2  PRO  94           HG2      PRO  94  85.865  15.537  -0.487
  763    HG3  PRO  94           HG1      PRO  94  84.364  14.843   0.153
  764    HD2  PRO  94           HD2      PRO  94  87.134  13.837   0.438
  765    HD3  PRO  94           HD1      PRO  94  85.698  13.443   1.403
  766    H    TYR 541           HT1      TYR 541  54.289  37.390  17.094
  767    HA   TYR 541           HA       TYR 541  52.154  37.910  17.214
  768    HB2  TYR 541           HB2      TYR 541  52.970  40.475  15.814
  769    HB3  TYR 541           HB1      TYR 541  51.379  40.179  16.515
  770    HD1  TYR 541           HD1      TYR 541  54.950  40.737  17.235
  771    HD2  TYR 541           HD2      TYR 541  51.059  40.077  18.930
  772    HE1  TYR 541           HE1      TYR 541  55.803  41.426  19.459
  773    HE2  TYR 541           HE2      TYR 541  51.912  40.765  21.155
  774    HH   TYR 541           HH       TYR 541  54.011  40.934  22.347
  775    H    HIS 542           HN       HIS 542  52.448  39.735  14.215
  776    HA   HIS 542           HA       HIS 542  50.508  37.993  12.912
  777    HB2  HIS 542           HB2      HIS 542  52.004  40.506  12.220
  778    HB3  HIS 542           HB1      HIS 542  51.282  39.583  10.909
  779    HD1  HIS 542           HD1      HIS 542  49.919  40.270  14.407
  780    HD2  HIS 542           HD2      HIS 542  48.913  40.930  10.415
  781    HE1  HIS 542           HE1      HIS 542  47.615  41.322  14.413
  782    H    GLU 543           HN       GLU 543  53.894  38.884  12.189
  783    HA   GLU 543           HA       GLU 543  54.440  37.246  10.043
  784    HB2  GLU 543           HB2      GLU 543  56.778  36.951  11.151
  785    HB3  GLU 543           HB1      GLU 543  56.229  38.586  10.782
  786    HG2  GLU 543           HG2      GLU 543  55.635  39.018  13.041
  787    HG3  GLU 543           HG1      GLU 543  55.719  37.310  13.472
  788    H    ARG 544           HN       ARG 544  53.555  36.170  13.197
  789    HA   ARG 544           HA       ARG 544  54.746  33.516  12.947
  790    HB2  ARG 544           HB2      ARG 544  52.443  34.215  14.771
  791    HB3  ARG 544           HB1      ARG 544  53.740  33.048  15.031
  792    HG2  ARG 544           HG2      ARG 544  54.068  36.065  14.944
  793    HG3  ARG 544           HG1      ARG 544  54.103  35.066  16.390
  794    HD2  ARG 544           HD2      ARG 544  56.015  33.776  15.290
  795    HD3  ARG 544           HD1      ARG 544  56.081  35.082  14.108
  796    HE   ARG 544           HE       ARG 544  56.182  36.390  16.552
  797   HH11  ARG 544          HH11      ARG 544  58.128  36.846  17.610
  798   HH12  ARG 544          HH12      ARG 544  59.524  35.875  17.282
  799   HH21  ARG 544          HH21      ARG 544  57.899  33.837  14.996
  800   HH22  ARG 544          HH22      ARG 544  59.395  34.173  15.801
  801    H    ARG 545           HN       ARG 545  53.906  32.822  10.867
  802    HA   ARG 545           HA       ARG 545  51.044  31.972  10.961
  803    HB2  ARG 545           HB2      ARG 545  51.558  32.290   8.259
  804    HB3  ARG 545           HB1      ARG 545  50.711  33.455   9.262
  805    HG2  ARG 545           HG2      ARG 545  52.418  34.638   8.063
  806    HG3  ARG 545           HG1      ARG 545  52.918  34.569   9.737
  807    HD2  ARG 545           HD2      ARG 545  54.670  33.117   9.294
  808    HD3  ARG 545           HD1      ARG 545  53.848  32.335   7.955
  809    HE   ARG 545           HE       ARG 545  55.737  34.508   7.809
  810   HH11  ARG 545          HH11      ARG 545  55.941  35.803   5.993
  811   HH12  ARG 545          HH12      ARG 545  54.692  35.798   4.793
  812   HH21  ARG 545          HH21      ARG 545  52.722  33.490   6.460
  813   HH22  ARG 545          HH22      ARG 545  52.875  34.493   5.057
  814    H    GLY 546           HN       GLY 546  54.251  31.393   9.569
  815    HA2  GLY 546           HA2      GLY 546  53.795  29.004   8.200
  816    HA3  GLY 546           HA1      GLY 546  55.311  29.370   9.017
  817    H    SER 547           HN       SER 547  55.843  28.156  10.784
  818    HA   SER 547           HA       SER 547  53.842  26.918  12.497
  819    HB2  SER 547           HB2      SER 547  55.180  25.360  10.315
  820    HB3  SER 547           HB1      SER 547  54.952  24.565  11.870
  821    HG   SER 547           HG       SER 547  53.188  24.835   9.981
  822    H    LEU 548           HN       LEU 548  54.867  27.145  14.446
  823    HA   LEU 548           HA       LEU 548  57.635  27.681  14.681
  824    HB2  LEU 548           HB2      LEU 548  55.385  27.137  16.525
  825    HB3  LEU 548           HB1      LEU 548  56.962  26.726  17.185
  826    HG   LEU 548           HG       LEU 548  57.734  29.054  16.479
  827   HD11  LEU 548          HD11      LEU 548  55.748  30.690  16.291
  828   HD12  LEU 548          HD12      LEU 548  54.790  29.269  15.883
  829   HD13  LEU 548          HD13      LEU 548  56.156  29.731  14.877
  830   HD21  LEU 548          HD21      LEU 548  55.421  29.182  18.400
  831   HD22  LEU 548          HD22      LEU 548  56.945  30.072  18.445
  832   HD23  LEU 548          HD23      LEU 548  56.920  28.350  18.816
  833    H    CYS 549           HN       CYS 549  59.424  26.399  14.931
  834    HA   CYS 549           HA       CYS 549  59.054  23.503  14.519
  835    HB2  CYS 549           HB2      CYS 549  60.926  24.335  13.341
  836    HB3  CYS 549           HB1      CYS 549  61.394  25.406  14.646
  837    H    SER 550           HN       SER 550  58.288  22.601  16.356
  838    HA   SER 550           HA       SER 550  58.585  23.485  18.972
  839    HB2  SER 550           HB2      SER 550  56.999  21.796  18.593
  840    HB3  SER 550           HB1      SER 550  58.190  20.694  17.913
  841    HG   SER 550           HG       SER 550  57.997  21.607  20.595
  842    H    GLY 551           HN       GLY 551  60.170  23.640  20.309
  843    HA2  GLY 551           HA2      GLY 551  62.152  22.669  21.455
  844    HA3  GLY 551           HA1      GLY 551  62.669  22.036  19.887
  845    H    CYS 552           HN       CYS 552  61.842  24.309  18.403
  846    HA   CYS 552           HA       CYS 552  64.002  26.247  19.115
  847    HB2  CYS 552           HB2      CYS 552  62.645  25.358  16.583
  848    HB3  CYS 552           HB1      CYS 552  63.398  26.943  16.648
  849    H    GLN 553           HN       GLN 553  60.634  25.803  18.269
  850    HA   GLN 553           HA       GLN 553  58.819  27.185  18.360
  851    HB2  GLN 553           HB2      GLN 553  60.411  28.418  20.589
  852    HB3  GLN 553           HB1      GLN 553  58.717  28.784  20.250
  853    HG2  GLN 553           HG2      GLN 553  59.767  25.995  20.729
  854    HG3  GLN 553           HG1      GLN 553  59.039  26.984  21.979
  855   HE21  GLN 553          HE21      GLN 553  58.382  25.330  18.917
  856   HE22  GLN 553          HE22      GLN 553  56.697  25.252  19.111
  857    H    LYS 554           HN       LYS 554  60.066  27.726  16.319
  858    HA   LYS 554           HA       LYS 554  59.920  30.670  16.007
  859    HB2  LYS 554           HB2      LYS 554  62.144  28.947  14.882
  860    HB3  LYS 554           HB1      LYS 554  61.894  30.641  14.489
  861    HG2  LYS 554           HG2      LYS 554  62.369  29.607  17.296
  862    HG3  LYS 554           HG1      LYS 554  63.640  30.247  16.259
  863    HD2  LYS 554           HD2      LYS 554  62.062  32.340  16.059
  864    HD3  LYS 554           HD1      LYS 554  61.317  31.692  17.519
  865    HE2  LYS 554           HE2      LYS 554  63.645  31.598  18.532
  866    HE3  LYS 554           HE1      LYS 554  64.198  32.530  17.141
  867    HZ1  LYS 554           HZ1      LYS 554  62.586  34.245  17.702
  868    HZ2  LYS 554           HZ2      LYS 554  63.657  33.971  18.993
  869    HZ3  LYS 554           HZ3      LYS 554  62.076  33.351  19.051
  870    HA   PRO 555           HA       PRO 555  57.036  29.028  12.903
  871    HB2  PRO 555           HB2      PRO 555  57.779  31.472  11.394
  872    HB3  PRO 555           HB1      PRO 555  56.177  30.857  11.816
  873    HG2  PRO 555           HG2      PRO 555  57.370  32.967  13.111
  874    HG3  PRO 555           HG1      PRO 555  56.178  31.909  13.876
  875    HD2  PRO 555           HD2      PRO 555  59.074  32.114  14.421
  876    HD3  PRO 555           HD1      PRO 555  57.809  31.320  15.393
  877    H    ILE 556           HN       ILE 556  57.313  27.672  11.302
  878    HA   ILE 556           HA       ILE 556  59.919  27.493   9.904
  879    HB   ILE 556           HB       ILE 556  57.490  25.677  10.073
  880   HG12  ILE 556          HG12      ILE 556  60.263  25.001  11.052
  881   HG13  ILE 556          HG11      ILE 556  59.243  26.009  12.054
  882   HG21  ILE 556          HG21      ILE 556  59.078  24.029   8.979
  883   HG22  ILE 556          HG22      ILE 556  60.102  25.403   8.577
  884   HG23  ILE 556          HG23      ILE 556  58.464  25.303   7.929
  885   HD11  ILE 556          HD11      ILE 556  57.928  23.558  10.982
  886   HD12  ILE 556          HD12      ILE 556  57.833  24.275  12.590
  887   HD13  ILE 556          HD13      ILE 556  59.218  23.286  12.150
  888    H    THR 557           HN       THR 557  59.780  29.100   8.288
  889    HA   THR 557           HA       THR 557  57.335  29.176   6.588
  890    HB   THR 557           HB       THR 557  58.082  31.332   5.892
  891    HG1  THR 557           HG1      THR 557  60.196  31.223   5.560
  892   HG21  THR 557          HG21      THR 557  57.186  31.029   8.234
  893   HG22  THR 557          HG22      THR 557  58.189  32.466   8.017
  894   HG23  THR 557          HG23      THR 557  58.854  31.032   8.802
  895    H    GLY 558           HN       GLY 558  57.668  27.346   5.335
  896    HA2  GLY 558           HA2      GLY 558  58.677  27.486   2.819
  897    HA3  GLY 558           HA1      GLY 558  60.100  26.986   3.746
  898    H    ARG 559           HN       ARG 559  60.184  24.932   4.570
  899    HA   ARG 559           HA       ARG 559  57.935  23.075   3.908
  900    HB2  ARG 559           HB2      ARG 559  60.935  22.818   3.896
  901    HB3  ARG 559           HB1      ARG 559  59.972  21.383   4.241
  902    HG2  ARG 559           HG2      ARG 559  59.497  23.164   1.846
  903    HG3  ARG 559           HG1      ARG 559  60.545  21.752   1.790
  904    HD2  ARG 559           HD2      ARG 559  58.639  20.604   1.230
  905    HD3  ARG 559           HD1      ARG 559  58.205  20.744   2.932
  906    HE   ARG 559           HE       ARG 559  57.322  23.125   1.826
  907   HH11  ARG 559          HH11      ARG 559  55.236  23.364   0.983
  908   HH12  ARG 559          HH12      ARG 559  54.380  21.967   0.420
  909   HH21  ARG 559          HH21      ARG 559  56.942  19.759   1.181
  910   HH22  ARG 559          HH22      ARG 559  55.345  19.927   0.532
  911    H    CYS 560           HN       CYS 560  57.370  21.582   5.591
  912    HA   CYS 560           HA       CYS 560  58.692  21.991   8.213
  913    HB2  CYS 560           HB2      CYS 560  56.532  22.310   9.359
  914    HB3  CYS 560           HB1      CYS 560  56.885  23.626   8.237
  915    HG   CYS 560           HG       CYS 560  55.297  22.214   6.492
  916    H    ILE 561           HN       ILE 561  59.052  20.186   9.165
  917    HA   ILE 561           HA       ILE 561  57.665  17.741   8.276
  918    HB   ILE 561           HB       ILE 561  59.981  18.200  10.173
  919   HG12  ILE 561          HG12      ILE 561  59.748  17.220   7.330
  920   HG13  ILE 561          HG11      ILE 561  60.453  18.742   7.840
  921   HG21  ILE 561          HG21      ILE 561  58.708  16.136  10.732
  922   HG22  ILE 561          HG22      ILE 561  60.279  15.744  10.040
  923   HG23  ILE 561          HG23      ILE 561  58.829  15.630   9.046
  924   HD11  ILE 561          HD11      ILE 561  62.104  17.405   9.201
  925   HD12  ILE 561          HD12      ILE 561  62.278  17.227   7.456
  926   HD13  ILE 561          HD13      ILE 561  61.490  15.958   8.401
  927    H    THR 562           HN       THR 562  56.507  16.492   9.677
  928    HA   THR 562           HA       THR 562  55.682  17.776  12.248
  929    HB   THR 562           HB       THR 562  53.929  15.925  10.650
  930    HG1  THR 562           HG1      THR 562  53.821  18.749  10.670
  931   HG21  THR 562          HG21      THR 562  52.188  16.783  12.068
  932   HG22  THR 562          HG22      THR 562  53.250  18.043  12.698
  933   HG23  THR 562          HG23      THR 562  53.540  16.353  13.121
  934    H    ALA 563           HN       ALA 563  55.417  16.475  13.999
  935    HA   ALA 563           HA       ALA 563  56.468  13.685  13.753
  936    HB1  ALA 563           HB1      ALA 563  57.602  14.024  15.860
  937    HB2  ALA 563           HB2      ALA 563  56.857  15.615  16.045
  938    HB3  ALA 563           HB3      ALA 563  58.047  15.342  14.767
  939    H    MET 564           HN       MET 564  55.920  14.039  16.836
  940    HA   MET 564           HA       MET 564  53.510  12.499  16.916
  941    HB2  MET 564           HB2      MET 564  54.500  14.158  19.224
  942    HB3  MET 564           HB1      MET 564  53.808  12.534  19.239
  943    HG2  MET 564           HG2      MET 564  55.895  11.832  17.889
  944    HG3  MET 564           HG1      MET 564  56.566  13.387  18.375
  945    HE1  MET 564           HE1      MET 564  58.296  10.594  20.496
  946    HE2  MET 564           HE2      MET 564  58.659  12.194  19.852
  947    HE3  MET 564           HE3      MET 564  57.965  10.965  18.798
  948    H    ALA 565           HN       ALA 565  53.478  15.113  15.580
  949    HA   ALA 565           HA       ALA 565  51.463  16.389  15.116
  950    HB1  ALA 565           HB1      ALA 565  51.202  16.737  18.114
  951    HB2  ALA 565           HB2      ALA 565  50.297  15.516  17.209
  952    HB3  ALA 565           HB3      ALA 565  50.059  17.227  16.868
  953    H    LYS 566           HN       LYS 566  54.316  16.624  16.813
  954    HA   LYS 566           HA       LYS 566  54.322  19.556  17.098
  955    HB2  LYS 566           HB2      LYS 566  56.190  17.289  17.650
  956    HB3  LYS 566           HB1      LYS 566  56.938  18.848  17.335
  957    HG2  LYS 566           HG2      LYS 566  55.831  19.877  19.161
  958    HG3  LYS 566           HG1      LYS 566  54.692  18.544  19.329
  959    HD2  LYS 566           HD2      LYS 566  57.634  17.963  19.603
  960    HD3  LYS 566           HD1      LYS 566  56.799  18.740  20.942
  961    HE2  LYS 566           HE2      LYS 566  55.391  16.899  21.307
  962    HE3  LYS 566           HE1      LYS 566  55.583  16.296  19.656
  963    HZ1  LYS 566           HZ1      LYS 566  56.957  14.877  20.745
  964    HZ2  LYS 566           HZ2      LYS 566  57.337  15.984  21.977
  965    HZ3  LYS 566           HZ3      LYS 566  58.074  16.119  20.453
  966    H    LYS 567           HN       LYS 567  55.964  20.848  15.891
  967    HA   LYS 567           HA       LYS 567  56.217  19.876  13.072
  968    HB2  LYS 567           HB2      LYS 567  56.698  22.709  13.927
  969    HB3  LYS 567           HB1      LYS 567  56.116  22.110  12.385
  970    HG2  LYS 567           HG2      LYS 567  54.559  22.113  14.996
  971    HG3  LYS 567           HG1      LYS 567  54.295  23.192  13.637
  972    HD2  LYS 567           HD2      LYS 567  53.987  20.161  13.515
  973    HD3  LYS 567           HD1      LYS 567  52.664  21.318  13.661
  974    HE2  LYS 567           HE2      LYS 567  53.658  22.406  11.519
  975    HE3  LYS 567           HE1      LYS 567  54.513  20.877  11.333
  976    HZ1  LYS 567           HZ1      LYS 567  51.914  21.426  10.606
  977    HZ2  LYS 567           HZ2      LYS 567  51.792  20.429  11.977
  978    HZ3  LYS 567           HZ3      LYS 567  52.671  19.909  10.619
  979    H    PHE 568           HN       PHE 568  58.370  20.883  12.040
  980    HA   PHE 568           HA       PHE 568  60.545  21.122  14.004
  981    HB2  PHE 568           HB2      PHE 568  59.824  18.524  13.019
  982    HB3  PHE 568           HB1      PHE 568  61.352  18.931  12.258
  983    HD1  PHE 568           HD1      PHE 568  62.856  20.415  14.169
  984    HD2  PHE 568           HD2      PHE 568  60.159  17.147  14.887
  985    HE1  PHE 568           HE1      PHE 568  64.058  19.883  16.273
  986    HE2  PHE 568           HE2      PHE 568  61.362  16.618  16.991
  987    HZ   PHE 568           HZ       PHE 568  63.311  17.986  17.683
  988    H    HIS 569           HN       HIS 569  62.276  22.171  13.121
  989    HA   HIS 569           HA       HIS 569  62.045  23.439  10.587
  990    HB2  HIS 569           HB2      HIS 569  64.298  22.905  12.482
  991    HB3  HIS 569           HB1      HIS 569  64.699  23.486  10.878
  992    HD2  HIS 569           HD2      HIS 569  62.978  25.997  10.331
  993    HE1  HIS 569           HE1      HIS 569  63.452  27.126  14.365
  994    HA   PRO 570           HA       PRO 570  62.573  19.507   8.309
  995    HB2  PRO 570           HB2      PRO 570  63.514  21.388   6.178
  996    HB3  PRO 570           HB1      PRO 570  62.313  20.089   6.081
  997    HG2  PRO 570           HG2      PRO 570  61.594  22.713   6.180
  998    HG3  PRO 570           HG1      PRO 570  60.598  21.430   6.873
  999    HD2  PRO 570           HD2      PRO 570  62.207  23.492   8.273
 1000    HD3  PRO 570           HD1      PRO 570  60.832  22.528   8.872
 1001    H    GLU 571           HN       GLU 571  64.923  21.819   9.196
 1002    HA   GLU 571           HA       GLU 571  67.209  20.228   8.179
 1003    HB2  GLU 571           HB2      GLU 571  67.441  22.790   9.741
 1004    HB3  GLU 571           HB1      GLU 571  68.522  22.136   8.512
 1005    HG2  GLU 571           HG2      GLU 571  66.602  22.418   6.864
 1006    HG3  GLU 571           HG1      GLU 571  65.794  23.354   8.126
 1007    H    HIS 572           HN       HIS 572  66.111  21.738  11.213
 1008    HA   HIS 572           HA       HIS 572  68.035  20.476  12.886
 1009    HB2  HIS 572           HB2      HIS 572  65.215  21.256  13.684
 1010    HB3  HIS 572           HB1      HIS 572  66.610  21.102  14.753
 1011    HD2  HIS 572           HD2      HIS 572  68.555  22.645  12.295
 1012    HE1  HIS 572           HE1      HIS 572  66.367  26.021  13.532
 1013    H    PHE 573           HN       PHE 573  65.737  18.993  11.049
 1014    HA   PHE 573           HA       PHE 573  65.821  16.537  12.777
 1015    HB2  PHE 573           HB2      PHE 573  63.532  17.737  12.570
 1016    HB3  PHE 573           HB1      PHE 573  63.559  17.188  10.903
 1017    HD1  PHE 573           HD1      PHE 573  63.734  16.011  14.431
 1018    HD2  PHE 573           HD2      PHE 573  63.032  14.938  10.330
 1019    HE1  PHE 573           HE1      PHE 573  62.948  13.772  15.151
 1020    HE2  PHE 573           HE2      PHE 573  62.247  12.698  11.052
 1021    HZ   PHE 573           HZ       PHE 573  62.205  12.116  13.462
 1022    H    VAL 574           HN       VAL 574  67.818  16.824  11.146
 1023    HA   VAL 574           HA       VAL 574  67.253  15.804   8.448
 1024    HB   VAL 574           HB       VAL 574  69.739  16.054   8.179
 1025   HG11  VAL 574          HG11      VAL 574  68.984  18.013   7.339
 1026   HG12  VAL 574          HG12      VAL 574  69.314  18.753   8.880
 1027   HG13  VAL 574          HG13      VAL 574  67.704  18.119   8.525
 1028   HG21  VAL 574          HG21      VAL 574  70.954  17.231   9.945
 1029   HG22  VAL 574          HG22      VAL 574  70.251  15.762  10.612
 1030   HG23  VAL 574          HG23      VAL 574  69.500  17.332  10.931
 1031    H    CYS 575           HN       CYS 575  69.034  14.129   7.689
 1032    HA   CYS 575           HA       CYS 575  68.774  11.682   9.297
 1033    HB2  CYS 575           HB2      CYS 575  68.864  10.880   7.163
 1034    HB3  CYS 575           HB1      CYS 575  69.493  12.412   6.570
 1035    H    ALA 576           HN       ALA 576  70.531  10.596  10.410
 1036    HA   ALA 576           HA       ALA 576  72.773  12.518  10.976
 1037    HB1  ALA 576           HB1      ALA 576  71.864  11.607  12.966
 1038    HB2  ALA 576           HB2      ALA 576  73.338  10.673  12.704
 1039    HB3  ALA 576           HB3      ALA 576  71.768   9.982  12.289
 1040    H    PHE 577           HN       PHE 577  73.483  12.106   8.757
 1041    HA   PHE 577           HA       PHE 577  75.799  10.366   8.761
 1042    HB2  PHE 577           HB2      PHE 577  73.993   8.920   7.615
 1043    HB3  PHE 577           HB1      PHE 577  73.918  10.156   6.368
 1044    HD1  PHE 577           HD1      PHE 577  74.530   7.493   5.472
 1045    HD2  PHE 577           HD2      PHE 577  77.306  10.377   7.103
 1046    HE1  PHE 577           HE1      PHE 577  76.400   6.414   4.283
 1047    HE2  PHE 577           HE2      PHE 577  79.133   9.267   5.911
 1048    HZ   PHE 577           HZ       PHE 577  78.691   7.291   4.501
 1049    H    CYS 578           HN       CYS 578  73.654  12.051   6.610
 1050    HA   CYS 578           HA       CYS 578  75.656  14.190   6.024
 1051    HB2  CYS 578           HB2      CYS 578  74.409  14.501   3.904
 1052    HB3  CYS 578           HB1      CYS 578  75.016  12.859   4.019
 1053    H    LEU 579           HN       LEU 579  74.871  15.101   8.019
 1054    HA   LEU 579           HA       LEU 579  72.261  15.590   8.803
 1055    HB2  LEU 579           HB2      LEU 579  74.667  17.376   9.195
 1056    HB3  LEU 579           HB1      LEU 579  73.203  17.411  10.164
 1057    HG   LEU 579           HG       LEU 579  73.997  14.677  10.164
 1058   HD11  LEU 579          HD11      LEU 579  76.213  15.213   9.384
 1059   HD12  LEU 579          HD12      LEU 579  76.320  14.859  11.108
 1060   HD13  LEU 579          HD13      LEU 579  76.362  16.529  10.547
 1061   HD21  LEU 579          HD21      LEU 579  74.317  14.996  12.539
 1062   HD22  LEU 579          HD22      LEU 579  72.973  16.021  12.035
 1063   HD23  LEU 579          HD23      LEU 579  74.561  16.729  12.325
 1064    H    LYS 580           HN       LYS 580  72.893  16.532   5.765
 1065    HA   LYS 580           HA       LYS 580  72.055  19.354   6.091
 1066    HB2  LYS 580           HB2      LYS 580  72.713  19.700   3.915
 1067    HB3  LYS 580           HB1      LYS 580  73.686  18.288   4.283
 1068    HG2  LYS 580           HG2      LYS 580  70.984  18.154   2.881
 1069    HG3  LYS 580           HG1      LYS 580  72.532  18.196   2.056
 1070    HD2  LYS 580           HD2      LYS 580  73.165  16.087   2.805
 1071    HD3  LYS 580           HD1      LYS 580  72.077  16.134   4.187
 1072    HE2  LYS 580           HE2      LYS 580  71.436  14.634   2.163
 1073    HE3  LYS 580           HE1      LYS 580  70.195  15.654   2.888
 1074    HZ1  LYS 580           HZ1      LYS 580  70.707  17.346   1.197
 1075    HZ2  LYS 580           HZ2      LYS 580  70.134  15.897   0.519
 1076    HZ3  LYS 580           HZ3      LYS 580  71.792  16.267   0.463
 1077    H    GLN 581           HN       GLN 581  70.402  16.324   4.927
 1078    HA   GLN 581           HA       GLN 581  67.913  17.722   5.495
 1079    HB2  GLN 581           HB2      GLN 581  68.525  18.570   3.250
 1080    HB3  GLN 581           HB1      GLN 581  68.277  16.942   2.623
 1081    HG2  GLN 581           HG2      GLN 581  66.203  18.072   2.310
 1082    HG3  GLN 581           HG1      GLN 581  65.953  17.064   3.720
 1083   HE21  GLN 581          HE21      GLN 581  66.200  18.181   5.881
 1084   HE22  GLN 581          HE22      GLN 581  65.820  19.826   5.973
 1085    H    LEU 582           HN       LEU 582  66.213  16.524   5.895
 1086    HA   LEU 582           HA       LEU 582  66.077  13.707   5.008
 1087    HB2  LEU 582           HB2      LEU 582  67.065  13.946   7.344
 1088    HB3  LEU 582           HB1      LEU 582  65.483  14.510   7.855
 1089    HG   LEU 582           HG       LEU 582  64.505  12.379   7.049
 1090   HD11  LEU 582          HD11      LEU 582  66.568  10.586   6.793
 1091   HD12  LEU 582          HD12      LEU 582  67.263  12.012   6.021
 1092   HD13  LEU 582          HD13      LEU 582  65.745  11.345   5.434
 1093   HD21  LEU 582          HD21      LEU 582  64.958  12.381   9.343
 1094   HD22  LEU 582          HD22      LEU 582  66.695  12.407   9.106
 1095   HD23  LEU 582          HD23      LEU 582  65.790  10.928   8.794
 1096    H    ASN 583           HN       ASN 583  63.790  12.845   5.510
 1097    HA   ASN 583           HA       ASN 583  61.715  14.948   5.780
 1098    HB2  ASN 583           HB2      ASN 583  62.238  13.335   3.281
 1099    HB3  ASN 583           HB1      ASN 583  60.592  13.823   3.671
 1100   HD21  ASN 583          HD21      ASN 583  61.605  14.881   1.373
 1101   HD22  ASN 583          HD22      ASN 583  62.014  16.510   1.584
 1102    H    LYS 584           HN       LYS 584  59.844  14.128   6.691
 1103    HA   LYS 584           HA       LYS 584  59.894  11.675   8.096
 1104    HB2  LYS 584           HB2      LYS 584  57.397  12.035   8.248
 1105    HB3  LYS 584           HB1      LYS 584  58.382  13.402   8.766
 1106    HG2  LYS 584           HG2      LYS 584  57.852  14.694   6.900
 1107    HG3  LYS 584           HG1      LYS 584  57.569  13.295   5.866
 1108    HD2  LYS 584           HD2      LYS 584  55.426  14.244   6.243
 1109    HD3  LYS 584           HD1      LYS 584  55.497  12.844   7.304
 1110    HE2  LYS 584           HE2      LYS 584  54.628  14.615   8.643
 1111    HE3  LYS 584           HE1      LYS 584  56.316  14.447   9.125
 1112    HZ1  LYS 584           HZ1      LYS 584  55.707  16.762   8.739
 1113    HZ2  LYS 584           HZ2      LYS 584  55.285  16.395   7.135
 1114    HZ3  LYS 584           HZ3      LYS 584  56.898  16.247   7.646
 1115    H    GLY 585           HN       GLY 585  59.195  12.366   4.810
 1116    HA2  GLY 585           HA2      GLY 585  57.685   9.880   4.358
 1117    HA3  GLY 585           HA1      GLY 585  58.089  11.094   3.146
 1118    H    THR 586           HN       THR 586  60.898  10.983   4.359
 1119    HA   THR 586           HA       THR 586  61.798   8.406   3.132
 1120    HB   THR 586           HB       THR 586  63.361   9.473   1.761
 1121    HG1  THR 586           HG1      THR 586  63.179  11.455   3.718
 1122   HG21  THR 586          HG21      THR 586  62.168  11.183   0.542
 1123   HG22  THR 586          HG22      THR 586  61.186  11.574   1.957
 1124   HG23  THR 586          HG23      THR 586  60.976  10.027   1.138
 1125    H    PHE 587           HN       PHE 587  61.472   9.468   5.956
 1126    HA   PHE 587           HA       PHE 587  64.318   9.614   6.817
 1127    HB2  PHE 587           HB2      PHE 587  63.449  10.862   8.481
 1128    HB3  PHE 587           HB1      PHE 587  61.846  10.539   7.892
 1129    HD1  PHE 587           HD1      PHE 587  60.471   8.728   8.855
 1130    HD2  PHE 587           HD2      PHE 587  64.403   9.616  10.336
 1131    HE1  PHE 587           HE1      PHE 587  60.012   7.376  10.883
 1132    HE2  PHE 587           HE2      PHE 587  63.945   8.265  12.364
 1133    HZ   PHE 587           HZ       PHE 587  61.750   7.145  12.638
 1134    H    LYS 588           HN       LYS 588  65.362   7.845   7.029
 1135    HA   LYS 588           HA       LYS 588  64.032   5.317   7.885
 1136    HB2  LYS 588           HB2      LYS 588  65.763   5.916   5.738
 1137    HB3  LYS 588           HB1      LYS 588  66.793   5.156   6.901
 1138    HG2  LYS 588           HG2      LYS 588  65.778   3.586   5.217
 1139    HG3  LYS 588           HG1      LYS 588  65.541   3.135   6.890
 1140    HD2  LYS 588           HD2      LYS 588  63.557   2.946   5.191
 1141    HD3  LYS 588           HD1      LYS 588  63.247   3.534   6.806
 1142    HE2  LYS 588           HE2      LYS 588  62.808   5.689   6.061
 1143    HE3  LYS 588           HE1      LYS 588  63.909   5.559   4.710
 1144    HZ1  LYS 588           HZ1      LYS 588  62.384   4.241   3.523
 1145    HZ2  LYS 588           HZ2      LYS 588  61.507   5.565   4.126
 1146    HZ3  LYS 588           HZ3      LYS 588  61.382   4.046   4.877
 1147    H    GLU 589           HN       GLU 589  65.515   3.963   9.376
 1148    HA   GLU 589           HA       GLU 589  67.383   5.602  10.975
 1149    HB2  GLU 589           HB2      GLU 589  65.478   6.297  12.124
 1150    HB3  GLU 589           HB1      GLU 589  64.665   4.748  11.940
 1151    HG2  GLU 589           HG2      GLU 589  66.055   3.733  13.611
 1152    HG3  GLU 589           HG1      GLU 589  67.158   5.115  13.634
 1153    H    GLN 590           HN       GLN 590  68.509   4.443  12.527
 1154    HA   GLN 590           HA       GLN 590  68.290   1.552  12.750
 1155    HB2  GLN 590           HB2      GLN 590  69.710   2.170  10.596
 1156    HB3  GLN 590           HB1      GLN 590  70.959   2.564  11.764
 1157    HG2  GLN 590           HG2      GLN 590  71.470   0.327  11.529
 1158    HG3  GLN 590           HG1      GLN 590  70.214   0.153  12.753
 1159   HE21  GLN 590          HE21      GLN 590  71.143  -0.817   9.621
 1160   HE22  GLN 590          HE22      GLN 590  69.662  -1.472   9.114
 1161    H    ASN 591           HN       ASN 591  69.416   0.895  14.658
 1162    HA   ASN 591           HA       ASN 591  70.123   1.302  16.848
 1163    HB2  ASN 591           HB2      ASN 591  72.254   3.080  16.585
 1164    HB3  ASN 591           HB1      ASN 591  72.367   1.340  16.437
 1165   HD21  ASN 591          HD21      ASN 591  71.441   0.702  14.035
 1166   HD22  ASN 591          HD22      ASN 591  72.205   1.554  12.787
 1167    H    ASP 592           HN       ASP 592  68.106   3.205  15.633
 1168    HA   ASP 592           HA       ASP 592  66.805   4.908  16.617
 1169    HB2  ASP 592           HB2      ASP 592  69.055   5.659  18.465
 1170    HB3  ASP 592           HB1      ASP 592  67.317   5.795  18.717
 1171    H    LYS 593           HN       LYS 593  69.767   5.227  15.121
 1172    HA   LYS 593           HA       LYS 593  69.888   8.150  15.182
 1173    HB2  LYS 593           HB2      LYS 593  71.433   6.178  13.521
 1174    HB3  LYS 593           HB1      LYS 593  71.840   7.863  13.803
 1175    HG2  LYS 593           HG2      LYS 593  71.762   7.145  16.346
 1176    HG3  LYS 593           HG1      LYS 593  72.003   5.528  15.688
 1177    HD2  LYS 593           HD2      LYS 593  74.035   6.257  14.537
 1178    HD3  LYS 593           HD1      LYS 593  73.781   7.915  15.086
 1179    HE2  LYS 593           HE2      LYS 593  74.086   5.575  16.985
 1180    HE3  LYS 593           HE1      LYS 593  75.444   6.570  16.458
 1181    HZ1  LYS 593           HZ1      LYS 593  74.852   7.747  18.275
 1182    HZ2  LYS 593           HZ2      LYS 593  73.235   7.226  18.241
 1183    HZ3  LYS 593           HZ3      LYS 593  73.756   8.461  17.196
 1184    HA   PRO 594           HA       PRO 594  66.895   8.268  11.696
 1185    HB2  PRO 594           HB2      PRO 594  68.142  10.946  11.311
 1186    HB3  PRO 594           HB1      PRO 594  66.437  10.518  11.445
 1187    HG2  PRO 594           HG2      PRO 594  67.822  11.744  13.445
 1188    HG3  PRO 594           HG1      PRO 594  66.465  10.650  13.754
 1189    HD2  PRO 594           HD2      PRO 594  69.368  10.198  14.212
 1190    HD3  PRO 594           HD1      PRO 594  67.971   9.378  14.949
 1191    H    TYR 595           HN       TYR 595  67.132   8.532   9.290
 1192    HA   TYR 595           HA       TYR 595  69.773   8.876   8.116
 1193    HB2  TYR 595           HB2      TYR 595  68.686   6.091   8.539
 1194    HB3  TYR 595           HB1      TYR 595  69.767   6.433   7.201
 1195    HD1  TYR 595           HD1      TYR 595  71.907   7.990   8.065
 1196    HD2  TYR 595           HD2      TYR 595  69.723   5.088  10.363
 1197    HE1  TYR 595           HE1      TYR 595  73.887   7.629   9.517
 1198    HE2  TYR 595           HE2      TYR 595  71.704   4.743  11.800
 1199    HH   TYR 595           HH       TYR 595  74.698   5.537  11.038
 1200    H    CYS 596           HN       CYS 596  69.495   9.265   5.893
 1201    HA   CYS 596           HA       CYS 596  66.797   9.243   4.778
 1202    HB2  CYS 596           HB2      CYS 596  69.312   9.198   3.091
 1203    HB3  CYS 596           HB1      CYS 596  67.771   9.970   2.740
 1204    H    GLN 597           HN       GLN 597  66.122   7.654   3.056
 1205    HA   GLN 597           HA       GLN 597  66.897   5.000   3.787
 1206    HB2  GLN 597           HB2      GLN 597  64.814   4.998   2.732
 1207    HB3  GLN 597           HB1      GLN 597  65.287   6.222   1.591
 1208    HG2  GLN 597           HG2      GLN 597  65.164   4.352   0.204
 1209    HG3  GLN 597           HG1      GLN 597  66.857   4.309   0.649
 1210   HE21  GLN 597          HE21      GLN 597  66.243   3.444   3.439
 1211   HE22  GLN 597          HE22      GLN 597  65.800   1.827   3.326
 1212    H    ASN 598           HN       ASN 598  67.642   6.947   0.905
 1213    HA   ASN 598           HA       ASN 598  69.549   5.353  -0.321
 1214    HB2  ASN 598           HB2      ASN 598  70.165   8.277  -0.027
 1215    HB3  ASN 598           HB1      ASN 598  70.208   7.267  -1.466
 1216   HD21  ASN 598          HD21      ASN 598  67.805   6.235  -1.789
 1217   HD22  ASN 598          HD22      ASN 598  66.582   7.405  -1.814
 1218    H    CYS 599           HN       CYS 599  69.809   7.137   2.672
 1219    HA   CYS 599           HA       CYS 599  72.709   6.710   2.887
 1220    HB2  CYS 599           HB2      CYS 599  70.593   7.923   4.669
 1221    HB3  CYS 599           HB1      CYS 599  72.191   7.553   5.302
 1222    H    PHE 600           HN       PHE 600  69.958   5.809   4.982
 1223    HA   PHE 600           HA       PHE 600  71.132   3.807   6.501
 1224    HB2  PHE 600           HB2      PHE 600  68.937   4.262   7.133
 1225    HB3  PHE 600           HB1      PHE 600  68.369   4.315   5.471
 1226    HD1  PHE 600           HD1      PHE 600  68.989   2.195   8.387
 1227    HD2  PHE 600           HD2      PHE 600  67.855   2.220   4.249
 1228    HE1  PHE 600           HE1      PHE 600  68.142  -0.125   8.606
 1229    HE2  PHE 600           HE2      PHE 600  67.013  -0.100   4.462
 1230    HZ   PHE 600           HZ       PHE 600  67.154  -1.273   6.641
 1231    H    LEU 601           HN       LEU 601  69.477   3.342   3.386
 1232    HA   LEU 601           HA       LEU 601  70.027   0.583   3.192
 1233    HB2  LEU 601           HB2      LEU 601  68.738   0.823   1.337
 1234    HB3  LEU 601           HB1      LEU 601  68.702   2.542   1.677
 1235    HG   LEU 601           HG       LEU 601  70.809   2.777   0.289
 1236   HD11  LEU 601          HD11      LEU 601  70.537  -0.151   0.227
 1237   HD12  LEU 601          HD12      LEU 601  71.914   0.851  -0.219
 1238   HD13  LEU 601          HD13      LEU 601  70.647   0.532  -1.393
 1239   HD21  LEU 601          HD21      LEU 601  68.542   3.269  -0.564
 1240   HD22  LEU 601          HD22      LEU 601  68.385   1.590  -1.081
 1241   HD23  LEU 601          HD23      LEU 601  69.589   2.634  -1.833
 1242    H    LYS 602           HN       LYS 602  71.910   3.383   2.118
 1243    HA   LYS 602           HA       LYS 602  73.909   1.981   0.700
 1244    HB2  LYS 602           HB2      LYS 602  73.796   4.420   0.670
 1245    HB3  LYS 602           HB1      LYS 602  74.203   4.484   2.376
 1246    HG2  LYS 602           HG2      LYS 602  76.122   4.951   0.920
 1247    HG3  LYS 602           HG1      LYS 602  76.392   3.510   1.894
 1248    HD2  LYS 602           HD2      LYS 602  76.151   2.069   0.064
 1249    HD3  LYS 602           HD1      LYS 602  75.204   3.233  -0.861
 1250    HE2  LYS 602           HE2      LYS 602  78.173   3.413  -0.264
 1251    HE3  LYS 602           HE1      LYS 602  77.438   3.036  -1.819
 1252    HZ1  LYS 602           HZ1      LYS 602  77.885   5.288  -1.962
 1253    HZ2  LYS 602           HZ2      LYS 602  77.436   5.593  -0.352
 1254    HZ3  LYS 602           HZ3      LYS 602  76.248   5.262  -1.521
 1255    H    LEU 603           HN       LEU 603  73.389   2.223   4.158
 1256    HA   LEU 603           HA       LEU 603  76.092   1.123   4.693
 1257    HB2  LEU 603           HB2      LEU 603  74.272   1.387   7.007
 1258    HB3  LEU 603           HB1      LEU 603  75.907   2.004   6.786
 1259    HG   LEU 603           HG       LEU 603  73.390   3.223   5.622
 1260   HD11  LEU 603          HD11      LEU 603  73.546   4.889   7.284
 1261   HD12  LEU 603          HD12      LEU 603  75.180   4.400   7.735
 1262   HD13  LEU 603          HD13      LEU 603  73.805   3.375   8.149
 1263   HD21  LEU 603          HD21      LEU 603  75.760   3.495   4.426
 1264   HD22  LEU 603          HD22      LEU 603  76.064   4.613   5.747
 1265   HD23  LEU 603          HD23      LEU 603  74.713   4.889   4.652
 1266    H    PHE 604           HN       PHE 604  72.736   0.186   5.597
 1267    HA   PHE 604           HA       PHE 604  73.737  -2.596   6.009
 1268    HB2  PHE 604           HB2      PHE 604  70.905  -1.872   6.657
 1269    HB3  PHE 604           HB1      PHE 604  72.048  -2.869   7.557
 1270    HD1  PHE 604           HD1      PHE 604  73.755  -1.810   9.029
 1271    HD2  PHE 604           HD2      PHE 604  70.810   0.519   6.942
 1272    HE1  PHE 604           HE1      PHE 604  74.247   0.124  10.494
 1273    HE2  PHE 604           HE2      PHE 604  71.310   2.456   8.408
 1274    HZ   PHE 604           HZ       PHE 604  73.023   2.258  10.183
 1275    H    CYS 605           HN       CYS 605  71.544  -0.748   3.943
 1276    HA   CYS 605           HA       CYS 605  70.148  -1.467   2.170
 1277    HB2  CYS 605           HB2      CYS 605  72.160  -1.632   0.949
 1278    HB3  CYS 605           HB1      CYS 605  72.707  -3.036   1.868
 1279    HG   CYS 605           HG       CYS 605  71.475  -4.517   0.303
  Start of MODEL   11
    1    H    MET   1           HT1      MET   1  91.990 -23.501  18.743
    2    HA   MET   1           HA       MET   1  89.462 -22.740  17.408
    3    HB2  MET   1           HB2      MET   1  91.539 -21.311  16.791
    4    HB3  MET   1           HB1      MET   1  92.172 -22.788  16.065
    5    HG2  MET   1           HG2      MET   1  89.884 -22.918  14.843
    6    HG3  MET   1           HG1      MET   1  89.713 -21.221  15.296
    7    HE1  MET   1           HE1      MET   1  90.081 -19.614  13.530
    8    HE2  MET   1           HE2      MET   1  89.422 -20.990  12.648
    9    HE3  MET   1           HE3      MET   1  90.767 -20.079  11.967
   10    H    ALA   2           HN       ALA   2  91.320 -24.132  15.200
   11    HA   ALA   2           HA       ALA   2  91.216 -26.928  16.130
   12    HB1  ALA   2           HB1      ALA   2  89.692 -27.681  14.421
   13    HB2  ALA   2           HB2      ALA   2  89.640 -26.077  13.689
   14    HB3  ALA   2           HB3      ALA   2  88.896 -26.352  15.265
   15    H    LEU   3           HN       LEU   3  91.440 -24.863  13.252
   16    HA   LEU   3           HA       LEU   3  93.090 -26.398  11.617
   17    HB2  LEU   3           HB2      LEU   3  93.050 -23.425  12.159
   18    HB3  LEU   3           HB1      LEU   3  94.045 -24.132  10.887
   19    HG   LEU   3           HG       LEU   3  91.053 -24.556  11.123
   20   HD11  LEU   3          HD11      LEU   3  91.540 -22.181  10.731
   21   HD12  LEU   3          HD12      LEU   3  90.862 -22.913   9.277
   22   HD13  LEU   3          HD13      LEU   3  92.596 -22.607   9.384
   23   HD21  LEU   3          HD21      LEU   3  93.178 -25.400   9.175
   24   HD22  LEU   3          HD22      LEU   3  91.577 -25.025   8.541
   25   HD23  LEU   3          HD23      LEU   3  91.768 -26.284   9.754
   26    H    ASP   4           HN       ASP   4  94.500 -23.668  13.242
   27    HA   ASP   4           HA       ASP   4  96.620 -23.365  14.168
   28    HB2  ASP   4           HB2      ASP   4  95.545 -24.504  16.036
   29    HB3  ASP   4           HB1      ASP   4  95.854 -26.065  15.281
   30    H    GLY   5           HN       GLY   5  96.251 -25.002  11.601
   31    HA2  GLY   5           HA2      GLY   5  98.317 -26.972  11.437
   32    HA3  GLY   5           HA1      GLY   5  97.682 -26.044  10.069
   33    H    ILE   6           HN       ILE   6  98.280 -23.628  11.768
   34    HA   ILE   6           HA       ILE   6 101.134 -23.324  10.939
   35    HB   ILE   6           HB       ILE   6 100.140 -20.770  11.484
   36   HG12  ILE   6          HG12      ILE   6  97.861 -21.883  11.732
   37   HG13  ILE   6          HG11      ILE   6  97.959 -20.553  10.585
   38   HG21  ILE   6          HG21      ILE   6 100.239 -22.317   8.902
   39   HG22  ILE   6          HG22      ILE   6 101.458 -21.219   9.555
   40   HG23  ILE   6          HG23      ILE   6  99.914 -20.584   8.987
   41   HD11  ILE   6          HD11      ILE   6  98.524 -23.155   9.327
   42   HD12  ILE   6          HD12      ILE   6  97.398 -21.889   8.847
   43   HD13  ILE   6          HD13      ILE   6  96.924 -23.073  10.062
   44    H    ARG   7           HN       ARG   7  99.549 -21.141  13.163
   45    HA   ARG   7           HA       ARG   7 100.721 -22.426  15.524
   46    HB2  ARG   7           HB2      ARG   7 102.002 -20.315  16.084
   47    HB3  ARG   7           HB1      ARG   7 102.664 -21.290  14.780
   48    HG2  ARG   7           HG2      ARG   7 100.724 -19.228  13.873
   49    HG3  ARG   7           HG1      ARG   7 102.191 -18.581  14.598
   50    HD2  ARG   7           HD2      ARG   7 103.576 -19.584  12.981
   51    HD3  ARG   7           HD1      ARG   7 102.333 -20.741  12.506
   52    HE   ARG   7           HE       ARG   7 101.296 -18.190  11.926
   53   HH11  ARG   7          HH11      ARG   7 101.469 -17.338   9.840
   54   HH12  ARG   7          HH12      ARG   7 102.703 -17.930   8.778
   55   HH21  ARG   7          HH21      ARG   7 103.976 -20.188  11.081
   56   HH22  ARG   7          HH22      ARG   7 104.122 -19.543   9.480
   57    H    MET   8           HN       MET   8 100.413 -18.994  15.631
   58    HA   MET   8           HA       MET   8  97.580 -19.126  16.431
   59    HB2  MET   8           HB2      MET   8  98.810 -17.794  18.635
   60    HB3  MET   8           HB1      MET   8  97.971 -19.331  18.642
   61    HG2  MET   8           HG2      MET   8  99.967 -20.567  18.237
   62    HG3  MET   8           HG1      MET   8 100.899 -19.138  17.848
   63    HE1  MET   8           HE1      MET   8  99.688 -21.563  20.392
   64    HE2  MET   8           HE2      MET   8 100.777 -21.183  21.723
   65    HE3  MET   8           HE3      MET   8 101.438 -21.556  20.134
   66    HA   PRO   9           HA       PRO   9  98.938 -14.340  16.559
   67    HB2  PRO   9           HB2      PRO   9 101.347 -14.873  14.824
   68    HB3  PRO   9           HB1      PRO   9 101.042 -13.507  15.922
   69    HG2  PRO   9           HG2      PRO   9 102.603 -15.468  16.694
   70    HG3  PRO   9           HG1      PRO   9 101.397 -14.795  17.809
   71    HD2  PRO   9           HD2      PRO   9 101.348 -17.413  16.371
   72    HD3  PRO   9           HD1      PRO   9 100.694 -16.969  17.945
   73    H    ASP  10           HN       ASP  10  99.678 -16.582  14.006
   74    HA   ASP  10           HA       ASP  10  97.932 -15.053  12.090
   75    HB2  ASP  10           HB2      ASP  10 100.452 -15.406  11.558
   76    HB3  ASP  10           HB1      ASP  10 100.011 -17.088  11.273
   77    H    GLY  11           HN       GLY  11  98.603 -18.043  13.683
   78    HA2  GLY  11           HA2      GLY  11  96.618 -19.539  12.081
   79    HA3  GLY  11           HA1      GLY  11  97.619 -20.198  13.368
   80    H    CYS  12           HN       CYS  12  96.260 -17.255  14.230
   81    HA   CYS  12           HA       CYS  12  93.684 -18.232  15.164
   82    HB2  CYS  12           HB2      CYS  12  95.222 -19.323  16.776
   83    HB3  CYS  12           HB1      CYS  12  95.870 -17.739  17.197
   84    HG   CYS  12           HG       CYS  12  93.068 -18.798  17.988
   85    H    TYR  13           HN       TYR  13  95.835 -15.981  16.850
   86    HA   TYR  13           HA       TYR  13  95.818 -13.646  16.979
   87    HB2  TYR  13           HB2      TYR  13  95.060 -13.938  14.418
   88    HB3  TYR  13           HB1      TYR  13  93.513 -13.392  15.058
   89    HD1  TYR  13           HD1      TYR  13  96.512 -12.273  13.640
   90    HD2  TYR  13           HD2      TYR  13  93.765 -11.340  16.809
   91    HE1  TYR  13           HE1      TYR  13  97.329  -9.932  13.661
   92    HE2  TYR  13           HE2      TYR  13  94.583  -8.999  16.828
   93    HH   TYR  13           HH       TYR  13  96.979  -7.872  14.457
   94    H    ALA  14           HN       ALA  14  92.723 -15.316  16.678
   95    HA   ALA  14           HA       ALA  14  91.792 -15.044  19.248
   96    HB1  ALA  14           HB1      ALA  14  90.164 -12.957  18.710
   97    HB2  ALA  14           HB2      ALA  14  91.546 -12.499  17.712
   98    HB3  ALA  14           HB3      ALA  14  91.752 -12.735  19.445
   99    H    ASP  15           HN       ASP  15  90.568 -14.204  16.013
  100    HA   ASP  15           HA       ASP  15  88.980 -16.637  15.953
  101    HB2  ASP  15           HB2      ASP  15  87.700 -14.989  17.432
  102    HB3  ASP  15           HB1      ASP  15  87.442 -14.042  15.965
  103    H    GLY  16           HN       GLY  16  90.690 -14.326  14.413
  104    HA2  GLY  16           HA2      GLY  16  91.108 -14.493  12.008
  105    HA3  GLY  16           HA1      GLY  16  89.408 -14.904  11.773
  106    H    THR  17           HN       THR  17  90.310 -12.388  14.000
  107    HA   THR  17           HA       THR  17  88.840 -10.424  12.357
  108    HB   THR  17           HB       THR  17  89.388  -8.975  14.467
  109    HG1  THR  17           HG1      THR  17  89.863 -11.582  15.466
  110   HG21  THR  17          HG21      THR  17  87.602 -10.268  15.781
  111   HG22  THR  17          HG22      THR  17  87.589 -11.394  14.424
  112   HG23  THR  17          HG23      THR  17  87.159  -9.701  14.171
  113    H    TRP  18           HN       TRP  18  89.895  -9.125  11.025
  114    HA   TRP  18           HA       TRP  18  92.721  -8.328  11.614
  115    HB2  TRP  18           HB2      TRP  18  92.579  -8.146   8.879
  116    HB3  TRP  18           HB1      TRP  18  93.233  -9.536   9.732
  117    HD1  TRP  18           HD1      TRP  18  89.811  -8.326   8.388
  118    HE1  TRP  18           HE1      TRP  18  88.499 -10.398   7.590
  119    HE3  TRP  18           HE3      TRP  18  93.093 -12.010   9.700
  120    HZ2  TRP  18           HZ2      TRP  18  88.803 -13.241   7.515
  121    HZ3  TRP  18           HZ3      TRP  18  92.559 -14.389   9.254
  122    HH2  TRP  18           HH2      TRP  18  90.421 -15.008   8.164
  123    H    GLU  19           HN       GLU  19  92.795  -6.175  11.908
  124    HA   GLU  19           HA       GLU  19  90.499  -4.528  11.237
  125    HB2  GLU  19           HB2      GLU  19  92.550  -2.739  11.901
  126    HB3  GLU  19           HB1      GLU  19  91.369  -3.405  13.020
  127    HG2  GLU  19           HG2      GLU  19  93.697  -3.730  13.797
  128    HG3  GLU  19           HG1      GLU  19  92.847  -5.254  13.542
  129    H    LEU  20           HN       LEU  20  90.168  -3.408   9.409
  130    HA   LEU  20           HA       LEU  20  92.209  -3.557   7.303
  131    HB2  LEU  20           HB2      LEU  20  89.369  -3.371   7.373
  132    HB3  LEU  20           HB1      LEU  20  89.910  -1.866   6.645
  133    HG   LEU  20           HG       LEU  20  89.560  -3.492   4.889
  134   HD11  LEU  20          HD11      LEU  20  91.780  -1.987   5.075
  135   HD12  LEU  20          HD12      LEU  20  91.480  -3.073   3.721
  136   HD13  LEU  20          HD13      LEU  20  92.542  -3.579   5.030
  137   HD21  LEU  20          HD21      LEU  20  90.320  -5.692   4.909
  138   HD22  LEU  20          HD22      LEU  20  90.069  -5.450   6.630
  139   HD23  LEU  20          HD23      LEU  20  91.690  -5.332   5.950
  140    H    SER  21           HN       SER  21  93.514  -1.865   6.720
  141    HA   SER  21           HA       SER  21  93.641   0.401   8.550
  142    HB2  SER  21           HB2      SER  21  95.550  -0.863   7.172
  143    HB3  SER  21           HB1      SER  21  95.171   0.384   5.986
  144    HG   SER  21           HG       SER  21  95.525   1.057   8.694
  145    H    VAL  22           HN       VAL  22  93.185   2.544   8.074
  146    HA   VAL  22           HA       VAL  22  91.941   3.121   5.435
  147    HB   VAL  22           HB       VAL  22  90.652   3.518   8.137
  148   HG11  VAL  22          HG11      VAL  22  90.095   4.971   5.532
  149   HG12  VAL  22          HG12      VAL  22  90.440   5.687   7.108
  150   HG13  VAL  22          HG13      VAL  22  88.918   4.850   6.838
  151   HG21  VAL  22          HG21      VAL  22  89.664   2.465   5.475
  152   HG22  VAL  22          HG22      VAL  22  88.758   2.466   6.991
  153   HG23  VAL  22          HG23      VAL  22  90.197   1.455   6.824
  154    H    HIS  23           HN       HIS  23  93.191   4.630   4.628
  155    HA   HIS  23           HA       HIS  23  94.549   6.614   6.340
  156    HB2  HIS  23           HB2      HIS  23  94.574   5.805   3.445
  157    HB3  HIS  23           HB1      HIS  23  95.206   7.398   3.879
  158    HD1  HIS  23           HD1      HIS  23  97.620   7.411   4.494
  159    HD2  HIS  23           HD2      HIS  23  95.903   3.671   5.158
  160    HE1  HIS  23           HE1      HIS  23  99.490   5.893   5.276
  161    H    VAL  24           HN       VAL  24  93.064   8.109   7.092
  162    HA   VAL  24           HA       VAL  24  90.817   8.975   5.475
  163    HB   VAL  24           HB       VAL  24  91.870  10.565   7.807
  164   HG11  VAL  24          HG11      VAL  24  89.729  11.057   6.384
  165   HG12  VAL  24          HG12      VAL  24  89.618  11.137   8.142
  166   HG13  VAL  24          HG13      VAL  24  89.028   9.713   7.284
  167   HG21  VAL  24          HG21      VAL  24  90.613   8.952   9.291
  168   HG22  VAL  24          HG22      VAL  24  92.098   8.300   8.600
  169   HG23  VAL  24          HG23      VAL  24  90.536   7.853   7.917
  170    H    THR  25           HN       THR  25  91.965   9.659   3.508
  171    HA   THR  25           HA       THR  25  93.981  11.657   3.465
  172    HB   THR  25           HB       THR  25  93.764  11.599   1.183
  173    HG1  THR  25           HG1      THR  25  91.810  12.924   1.468
  174   HG21  THR  25          HG21      THR  25  93.367   9.226   1.948
  175   HG22  THR  25          HG22      THR  25  92.738   9.596   0.344
  176   HG23  THR  25          HG23      THR  25  91.642   9.511   1.722
  177    H    ASP  26           HN       ASP  26  93.570  13.998   2.713
  178    HA   ASP  26           HA       ASP  26  92.503  16.072   3.054
  179    HB2  ASP  26           HB2      ASP  26  90.374  14.533   2.446
  180    HB3  ASP  26           HB1      ASP  26  90.011  14.781   4.152
  181    H    LEU  27           HN       LEU  27  91.810  13.536   5.439
  182    HA   LEU  27           HA       LEU  27  92.142  15.388   7.695
  183    HB2  LEU  27           HB2      LEU  27  91.076  12.716   7.263
  184    HB3  LEU  27           HB1      LEU  27  92.190  12.692   8.608
  185    HG   LEU  27           HG       LEU  27  90.065  13.106   9.535
  186   HD11  LEU  27          HD11      LEU  27  92.072  14.880   9.986
  187   HD12  LEU  27          HD12      LEU  27  90.533  14.894  10.843
  188   HD13  LEU  27          HD13      LEU  27  90.785  15.977   9.478
  189   HD21  LEU  27          HD21      LEU  27  89.719  15.232   7.435
  190   HD22  LEU  27          HD22      LEU  27  88.552  14.847   8.705
  191   HD23  LEU  27          HD23      LEU  27  88.935  13.654   7.463
  192    H    ASN  28           HN       ASN  28  93.759  12.801   5.977
  193    HA   ASN  28           HA       ASN  28  96.029  12.255   5.826
  194    HB2  ASN  28           HB2      ASN  28  96.386  14.788   6.274
  195    HB3  ASN  28           HB1      ASN  28  96.709  14.313   7.937
  196   HD21  ASN  28          HD21      ASN  28  97.733  11.649   6.773
  197   HD22  ASN  28          HD22      ASN  28  99.319  12.008   6.299
  198    H    ARG  29           HN       ARG  29  93.947  11.607   8.113
  199    HA   ARG  29           HA       ARG  29  95.817  10.659  10.181
  200    HB2  ARG  29           HB2      ARG  29  92.831  10.300   9.912
  201    HB3  ARG  29           HB1      ARG  29  93.794   9.866  11.319
  202    HG2  ARG  29           HG2      ARG  29  94.297  12.120  11.821
  203    HG3  ARG  29           HG1      ARG  29  93.781  12.683  10.242
  204    HD2  ARG  29           HD2      ARG  29  91.981  13.257  11.677
  205    HD3  ARG  29           HD1      ARG  29  91.445  11.775  10.883
  206    HE   ARG  29           HE       ARG  29  92.682  10.862  13.180
  207   HH11  ARG  29          HH11      ARG  29  91.567  10.567  15.129
  208   HH12  ARG  29          HH12      ARG  29  90.142  11.500  15.443
  209   HH21  ARG  29          HH21      ARG  29  90.268  13.207  12.430
  210   HH22  ARG  29          HH22      ARG  29  89.407  12.992  13.917
  211    H    ASP  30           HN       ASP  30  95.022   8.359  10.930
  212    HA   ASP  30           HA       ASP  30  94.588   6.524   8.661
  213    HB2  ASP  30           HB2      ASP  30  97.038   6.521  10.437
  214    HB3  ASP  30           HB1      ASP  30  96.467   5.055   9.637
  215    H    VAL  31           HN       VAL  31  92.927   5.343   9.333
  216    HA   VAL  31           HA       VAL  31  92.724   4.668  12.254
  217    HB   VAL  31           HB       VAL  31  90.457   4.954  10.278
  218   HG11  VAL  31          HG11      VAL  31  89.161   5.134  12.434
  219   HG12  VAL  31          HG12      VAL  31  90.641   4.714  13.292
  220   HG13  VAL  31          HG13      VAL  31  89.914   3.560  12.175
  221   HG21  VAL  31          HG21      VAL  31  90.043   7.155  11.341
  222   HG22  VAL  31          HG22      VAL  31  91.631   7.129  10.576
  223   HG23  VAL  31          HG23      VAL  31  91.492   6.955  12.325
  224    H    THR  32           HN       THR  32  91.759   2.636  12.742
  225    HA   THR  32           HA       THR  32  91.785   0.623  10.534
  226    HB   THR  32           HB       THR  32  92.705  -0.645  12.942
  227    HG1  THR  32           HG1      THR  32  94.450   1.441  12.315
  228   HG21  THR  32          HG21      THR  32  94.522   0.171  10.678
  229   HG22  THR  32          HG22      THR  32  93.294  -1.075  10.447
  230   HG23  THR  32          HG23      THR  32  94.563  -1.301  11.649
  231    H    LEU  33           HN       LEU  33  90.040  -0.698  10.616
  232    HA   LEU  33           HA       LEU  33  88.237  -0.545  13.002
  233    HB2  LEU  33           HB2      LEU  33  87.788  -0.714  10.038
  234    HB3  LEU  33           HB1      LEU  33  86.569  -1.362  11.114
  235    HG   LEU  33           HG       LEU  33  86.281   1.074  10.351
  236   HD11  LEU  33          HD11      LEU  33  86.390   0.780  13.349
  237   HD12  LEU  33          HD12      LEU  33  85.186  -0.059  12.377
  238   HD13  LEU  33          HD13      LEU  33  85.251   1.703  12.378
  239   HD21  LEU  33          HD21      LEU  33  88.755   1.593  10.813
  240   HD22  LEU  33          HD22      LEU  33  88.302   1.660  12.517
  241   HD23  LEU  33          HD23      LEU  33  87.573   2.769  11.375
  242    H    ARG  34           HN       ARG  34  88.450  -2.370  14.163
  243    HA   ARG  34           HA       ARG  34  89.522  -4.830  13.256
  244    HB2  ARG  34           HB2      ARG  34  89.225  -4.106  15.673
  245    HB3  ARG  34           HB1      ARG  34  87.515  -4.485  15.492
  246    HG2  ARG  34           HG2      ARG  34  88.545  -6.440  16.431
  247    HG3  ARG  34           HG1      ARG  34  88.192  -6.803  14.743
  248    HD2  ARG  34           HD2      ARG  34  90.420  -6.784  14.126
  249    HD3  ARG  34           HD1      ARG  34  90.891  -5.660  15.399
  250    HE   ARG  34           HE       ARG  34  90.898  -8.532  15.619
  251   HH11  ARG  34          HH11      ARG  34  91.338  -9.396  17.661
  252   HH12  ARG  34          HH12      ARG  34  91.181  -8.393  19.065
  253   HH21  ARG  34          HH21      ARG  34  90.208  -5.587  17.277
  254   HH22  ARG  34          HH22      ARG  34  90.540  -6.238  18.847
  255    H    VAL  35           HN       VAL  35  88.598  -5.798  11.515
  256    HA   VAL  35           HA       VAL  35  85.670  -6.420  11.652
  257    HB   VAL  35           HB       VAL  35  85.642  -6.125   9.167
  258   HG11  VAL  35          HG11      VAL  35  84.707  -4.352  10.473
  259   HG12  VAL  35          HG12      VAL  35  85.769  -3.573   9.299
  260   HG13  VAL  35          HG13      VAL  35  86.305  -3.788  10.968
  261   HG21  VAL  35          HG21      VAL  35  87.997  -6.328   8.669
  262   HG22  VAL  35          HG22      VAL  35  88.381  -4.954   9.703
  263   HG23  VAL  35          HG23      VAL  35  87.479  -4.707   8.210
  264    H    THR  36           HN       THR  36  85.400  -7.909   9.464
  265    HA   THR  36           HA       THR  36  87.522  -9.983   9.443
  266    HB   THR  36           HB       THR  36  85.592 -11.698   9.584
  267    HG1  THR  36           HG1      THR  36  84.370  -9.296  10.276
  268   HG21  THR  36          HG21      THR  36  87.125 -11.647  11.372
  269   HG22  THR  36          HG22      THR  36  85.546 -11.478  12.136
  270   HG23  THR  36          HG23      THR  36  86.572 -10.062  11.912
  271    H    GLY  37           HN       GLY  37  86.783 -11.648   7.635
  272    HA2  GLY  37           HA2      GLY  37  86.233 -10.039   5.283
  273    HA3  GLY  37           HA1      GLY  37  86.578 -11.759   5.281
  274    H    GLU  38           HN       GLU  38  84.068  -9.928   6.984
  275    HA   GLU  38           HA       GLU  38  81.980 -11.172   5.292
  276    HB2  GLU  38           HB2      GLU  38  80.811 -12.142   7.117
  277    HB3  GLU  38           HB1      GLU  38  82.481 -12.655   7.306
  278    HG2  GLU  38           HG2      GLU  38  82.124 -11.916   9.474
  279    HG3  GLU  38           HG1      GLU  38  82.593 -10.377   8.752
  280    H    VAL  39           HN       VAL  39  83.259  -8.463   6.620
  281    HA   VAL  39           HA       VAL  39  80.714  -7.230   7.444
  282    HB   VAL  39           HB       VAL  39  81.987  -5.398   8.179
  283   HG11  VAL  39          HG11      VAL  39  83.958  -7.637   8.522
  284   HG12  VAL  39          HG12      VAL  39  82.363  -7.719   9.268
  285   HG13  VAL  39          HG13      VAL  39  83.461  -6.413   9.692
  286   HG21  VAL  39          HG21      VAL  39  84.410  -5.119   7.547
  287   HG22  VAL  39          HG22      VAL  39  83.307  -4.901   6.200
  288   HG23  VAL  39          HG23      VAL  39  84.200  -6.416   6.375
  289    H    HIS  40           HN       HIS  40  79.557  -5.799   6.216
  290    HA   HIS  40           HA       HIS  40  80.188  -5.680   3.358
  291    HB2  HIS  40           HB2      HIS  40  78.019  -4.003   4.595
  292    HB3  HIS  40           HB1      HIS  40  78.029  -4.876   3.062
  293    HD1  HIS  40           HD1      HIS  40  78.494  -7.688   3.676
  294    HD2  HIS  40           HD2      HIS  40  76.298  -5.306   6.299
  295    HE1  HIS  40           HE1      HIS  40  77.107  -9.269   5.089
  296    H    ILE  41           HN       ILE  41  80.846  -3.824   2.219
  297    HA   ILE  41           HA       ILE  41  82.675  -2.056   3.322
  298    HB   ILE  41           HB       ILE  41  80.698  -1.412   1.122
  299   HG12  ILE  41          HG12      ILE  41  83.531  -2.455   0.893
  300   HG13  ILE  41          HG11      ILE  41  82.106  -3.492   0.864
  301   HG21  ILE  41          HG21      ILE  41  82.610   0.094   0.388
  302   HG22  ILE  41          HG22      ILE  41  83.310  -0.155   1.987
  303   HG23  ILE  41          HG23      ILE  41  81.735   0.628   1.826
  304   HD11  ILE  41          HD11      ILE  41  83.063  -2.650  -1.406
  305   HD12  ILE  41          HD12      ILE  41  82.285  -1.125  -0.984
  306   HD13  ILE  41          HD13      ILE  41  81.320  -2.591  -1.149
  307    H    GLY  42           HN       GLY  42  79.288  -1.218   2.645
  308    HA2  GLY  42           HA2      GLY  42  79.326   1.276   3.900
  309    HA3  GLY  42           HA1      GLY  42  77.870   0.298   3.715
  310    H    GLY  43           HN       GLY  43  79.630  -1.794   5.219
  311    HA2  GLY  43           HA2      GLY  43  78.533  -1.176   7.860
  312    HA3  GLY  43           HA1      GLY  43  79.481  -2.603   7.426
  313    H    VAL  44           HN       VAL  44  81.567  -0.872   6.177
  314    HA   VAL  44           HA       VAL  44  83.135  -0.420   8.620
  315    HB   VAL  44           HB       VAL  44  83.686  -0.418   5.650
  316   HG11  VAL  44          HG11      VAL  44  84.958   1.505   6.282
  317   HG12  VAL  44          HG12      VAL  44  86.105   0.165   6.296
  318   HG13  VAL  44          HG13      VAL  44  85.442   0.774   7.812
  319   HG21  VAL  44          HG21      VAL  44  85.156  -1.767   7.922
  320   HG22  VAL  44          HG22      VAL  44  85.201  -2.178   6.208
  321   HG23  VAL  44          HG23      VAL  44  83.741  -2.483   7.150
  322    H    MET  45           HN       MET  45  82.195   1.719   5.812
  323    HA   MET  45           HA       MET  45  83.284   4.048   6.982
  324    HB2  MET  45           HB2      MET  45  81.444   5.287   5.678
  325    HB3  MET  45           HB1      MET  45  82.599   4.332   4.760
  326    HG2  MET  45           HG2      MET  45  80.906   3.122   3.867
  327    HG3  MET  45           HG1      MET  45  80.401   2.598   5.463
  328    HE1  MET  45           HE1      MET  45  79.161   3.533   2.529
  329    HE2  MET  45           HE2      MET  45  77.687   4.477   2.811
  330    HE3  MET  45           HE3      MET  45  77.857   2.885   3.535
  331    H    LEU  46           HN       LEU  46  80.369   2.298   7.761
  332    HA   LEU  46           HA       LEU  46  79.064   4.348   9.313
  333    HB2  LEU  46           HB2      LEU  46  77.948   2.230   8.636
  334    HB3  LEU  46           HB1      LEU  46  79.045   1.331   9.676
  335    HG   LEU  46           HG       LEU  46  77.927   3.369  11.346
  336   HD11  LEU  46          HD11      LEU  46  75.832   2.033   9.611
  337   HD12  LEU  46          HD12      LEU  46  76.106   3.766   9.829
  338   HD13  LEU  46          HD13      LEU  46  75.486   2.797  11.163
  339   HD21  LEU  46          HD21      LEU  46  78.553   1.103  12.073
  340   HD22  LEU  46          HD22      LEU  46  77.231   0.422  11.125
  341   HD23  LEU  46          HD23      LEU  46  76.881   1.455  12.512
  342    H    LYS  47           HN       LYS  47  80.915   1.512  10.481
  343    HA   LYS  47           HA       LYS  47  81.271   2.339  13.137
  344    HB2  LYS  47           HB2      LYS  47  83.303   0.882  11.431
  345    HB3  LYS  47           HB1      LYS  47  83.202   0.844  13.193
  346    HG2  LYS  47           HG2      LYS  47  81.045  -0.270  13.084
  347    HG3  LYS  47           HG1      LYS  47  81.020  -0.099  11.329
  348    HD2  LYS  47           HD2      LYS  47  83.142  -1.453  11.236
  349    HD3  LYS  47           HD1      LYS  47  82.956  -1.757  12.962
  350    HE2  LYS  47           HE2      LYS  47  80.796  -2.400  10.943
  351    HE3  LYS  47           HE1      LYS  47  82.029  -3.565  11.434
  352    HZ1  LYS  47           HZ1      LYS  47  79.958  -3.731  12.734
  353    HZ2  LYS  47           HZ2      LYS  47  80.206  -2.150  13.306
  354    HZ3  LYS  47           HZ3      LYS  47  81.309  -3.381  13.698
  355    H    LEU  48           HN       LEU  48  83.554   2.818  10.439
  356    HA   LEU  48           HA       LEU  48  85.560   4.234  11.681
  357    HB2  LEU  48           HB2      LEU  48  85.644   3.641   9.328
  358    HB3  LEU  48           HB1      LEU  48  84.308   4.723   8.968
  359    HG   LEU  48           HG       LEU  48  85.741   6.660   9.641
  360   HD11  LEU  48          HD11      LEU  48  87.833   4.497   9.917
  361   HD12  LEU  48          HD12      LEU  48  87.292   5.617  11.167
  362   HD13  LEU  48          HD13      LEU  48  88.210   6.210   9.788
  363   HD21  LEU  48          HD21      LEU  48  86.688   4.755   7.496
  364   HD22  LEU  48          HD22      LEU  48  87.352   6.382   7.673
  365   HD23  LEU  48          HD23      LEU  48  85.639   6.161   7.313
  366    H    VAL  49           HN       VAL  49  82.587   5.743  10.325
  367    HA   VAL  49           HA       VAL  49  83.232   8.369  11.308
  368    HB   VAL  49           HB       VAL  49  80.609   7.079  10.524
  369   HG11  VAL  49          HG11      VAL  49  79.808   9.518  10.453
  370   HG12  VAL  49          HG12      VAL  49  81.209   9.893  11.456
  371   HG13  VAL  49          HG13      VAL  49  79.966   8.794  12.053
  372   HG21  VAL  49          HG21      VAL  49  82.167   9.291   9.169
  373   HG22  VAL  49          HG22      VAL  49  80.871   8.306   8.488
  374   HG23  VAL  49          HG23      VAL  49  82.448   7.586   8.812
  375    H    GLU  50           HN       GLU  50  81.147   5.771  12.609
  376    HA   GLU  50           HA       GLU  50  80.176   7.017  14.906
  377    HB2  GLU  50           HB2      GLU  50  81.160   4.181  14.535
  378    HB3  GLU  50           HB1      GLU  50  80.329   4.720  15.986
  379    HG2  GLU  50           HG2      GLU  50  79.181   4.972  13.187
  380    HG3  GLU  50           HG1      GLU  50  78.808   3.649  14.293
  381    H    LYS  51           HN       LYS  51  83.383   5.575  14.410
  382    HA   LYS  51           HA       LYS  51  84.285   5.997  17.107
  383    HB2  LYS  51           HB2      LYS  51  85.804   5.671  14.509
  384    HB3  LYS  51           HB1      LYS  51  86.538   5.636  16.112
  385    HG2  LYS  51           HG2      LYS  51  85.050   3.750  16.733
  386    HG3  LYS  51           HG1      LYS  51  84.391   3.751  15.097
  387    HD2  LYS  51           HD2      LYS  51  86.403   3.012  14.139
  388    HD3  LYS  51           HD1      LYS  51  87.363   3.530  15.520
  389    HE2  LYS  51           HE2      LYS  51  86.243   1.763  16.900
  390    HE3  LYS  51           HE1      LYS  51  85.426   1.205  15.440
  391    HZ1  LYS  51           HZ1      LYS  51  87.958   1.283  14.615
  392    HZ2  LYS  51           HZ2      LYS  51  87.225  -0.102  15.273
  393    HZ3  LYS  51           HZ3      LYS  51  88.191   0.897  16.251
  394    H    LEU  52           HN       LEU  52  84.654   7.903  14.099
  395    HA   LEU  52           HA       LEU  52  86.343   9.908  14.986
  396    HB2  LEU  52           HB2      LEU  52  84.734   9.406  12.775
  397    HB3  LEU  52           HB1      LEU  52  84.012  10.856  13.432
  398    HG   LEU  52           HG       LEU  52  85.641  11.577  11.888
  399   HD11  LEU  52          HD11      LEU  52  86.777  13.091  13.179
  400   HD12  LEU  52          HD12      LEU  52  87.375  11.863  14.293
  401   HD13  LEU  52          HD13      LEU  52  85.722  12.449  14.436
  402   HD21  LEU  52          HD21      LEU  52  87.805  10.709  11.604
  403   HD22  LEU  52          HD22      LEU  52  86.867   9.270  11.987
  404   HD23  LEU  52          HD23      LEU  52  87.853  10.036  13.231
  405    H    ASP  53           HN       ASP  53  82.813   9.959  15.108
  406    HA   ASP  53           HA       ASP  53  81.330  10.771  16.695
  407    HB2  ASP  53           HB2      ASP  53  83.263   9.871  18.197
  408    HB3  ASP  53           HB1      ASP  53  83.609  11.567  18.470
  409    H    VAL  54           HN       VAL  54  81.127  12.378  15.000
  410    HA   VAL  54           HA       VAL  54  81.158  15.034  16.045
  411    HB   VAL  54           HB       VAL  54  83.527  14.990  15.659
  412   HG11  VAL  54          HG11      VAL  54  83.498  13.012  14.167
  413   HG12  VAL  54          HG12      VAL  54  84.497  14.319  13.534
  414   HG13  VAL  54          HG13      VAL  54  82.892  14.032  12.862
  415   HG21  VAL  54          HG21      VAL  54  83.786  16.788  14.074
  416   HG22  VAL  54          HG22      VAL  54  82.222  17.011  14.856
  417   HG23  VAL  54          HG23      VAL  54  82.306  16.332  13.233
  418    H    LYS  55           HN       LYS  55  79.610  16.144  14.969
  419    HA   LYS  55           HA       LYS  55  78.159  14.865  12.837
  420    HB2  LYS  55           HB2      LYS  55  77.981  17.395  14.389
  421    HB3  LYS  55           HB1      LYS  55  77.208  17.417  12.816
  422    HG2  LYS  55           HG2      LYS  55  76.712  15.129  14.712
  423    HG3  LYS  55           HG1      LYS  55  75.825  16.630  14.873
  424    HD2  LYS  55           HD2      LYS  55  75.166  16.415  12.455
  425    HD3  LYS  55           HD1      LYS  55  75.851  14.792  12.483
  426    HE2  LYS  55           HE2      LYS  55  74.246  14.736  14.720
  427    HE3  LYS  55           HE1      LYS  55  73.333  15.809  13.656
  428    HZ1  LYS  55           HZ1      LYS  55  74.284  13.070  13.041
  429    HZ2  LYS  55           HZ2      LYS  55  73.571  14.113  11.904
  430    HZ3  LYS  55           HZ3      LYS  55  72.677  13.573  13.244
  431    H    LYS  56           HN       LYS  56  80.968  15.289  12.151
  432    HA   LYS  56           HA       LYS  56  81.028  17.546  10.270
  433    HB2  LYS  56           HB2      LYS  56  83.142  17.002  11.178
  434    HB3  LYS  56           HB1      LYS  56  82.929  15.278  10.891
  435    HG2  LYS  56           HG2      LYS  56  83.261  15.529   8.546
  436    HG3  LYS  56           HG1      LYS  56  83.053  17.279   8.626
  437    HD2  LYS  56           HD2      LYS  56  85.147  17.582   9.733
  438    HD3  LYS  56           HD1      LYS  56  85.295  15.861  10.081
  439    HE2  LYS  56           HE2      LYS  56  86.767  16.323   8.239
  440    HE3  LYS  56           HE1      LYS  56  85.375  15.469   7.572
  441    HZ1  LYS  56           HZ1      LYS  56  84.412  17.706   7.083
  442    HZ2  LYS  56           HZ2      LYS  56  85.798  17.317   6.181
  443    HZ3  LYS  56           HZ3      LYS  56  85.910  18.384   7.498
  444    H    ASP  57           HN       ASP  57  80.551  17.455   8.107
  445    HA   ASP  57           HA       ASP  57  78.870  15.485   7.029
  446    HB2  ASP  57           HB2      ASP  57  79.461  17.763   6.034
  447    HB3  ASP  57           HB1      ASP  57  80.883  16.992   5.347
  448    H    TRP  58           HN       TRP  58  79.272  13.356   6.662
  449    HA   TRP  58           HA       TRP  58  82.054  12.557   5.937
  450    HB2  TRP  58           HB2      TRP  58  79.971  11.104   7.568
  451    HB3  TRP  58           HB1      TRP  58  81.464  10.373   7.009
  452    HD1  TRP  58           HD1      TRP  58  80.133  11.866   9.947
  453    HE1  TRP  58           HE1      TRP  58  81.939  12.898  11.462
  454    HE3  TRP  58           HE3      TRP  58  84.091  12.002   6.683
  455    HZ2  TRP  58           HZ2      TRP  58  84.678  13.683  11.313
  456    HZ3  TRP  58           HZ3      TRP  58  86.272  12.898   7.411
  457    HH2  TRP  58           HH2      TRP  58  86.575  13.736   9.722
  458    H    SER  59           HN       SER  59  78.617  11.973   5.372
  459    HA   SER  59           HA       SER  59  78.622   9.808   3.645
  460    HB2  SER  59           HB2      SER  59  76.649  11.319   4.268
  461    HB3  SER  59           HB1      SER  59  77.156  12.347   2.927
  462    HG   SER  59           HG       SER  59  77.175  10.034   1.877
  463    H    ASP  60           HN       ASP  60  79.339  13.185   2.693
  464    HA   ASP  60           HA       ASP  60  79.999  12.646  -0.015
  465    HB2  ASP  60           HB2      ASP  60  79.837  14.944   0.760
  466    HB3  ASP  60           HB1      ASP  60  81.132  14.685   1.929
  467    H    HIS  61           HN       HIS  61  81.917  12.519   2.951
  468    HA   HIS  61           HA       HIS  61  84.354  11.632   1.686
  469    HB2  HIS  61           HB2      HIS  61  83.526  11.191   4.560
  470    HB3  HIS  61           HB1      HIS  61  85.160  11.284   3.917
  471    HD1  HIS  61           HD1      HIS  61  82.313  13.689   3.168
  472    HD2  HIS  61           HD2      HIS  61  86.009  13.661   5.095
  473    HE1  HIS  61           HE1      HIS  61  82.815  16.092   3.789
  474    H    ALA  62           HN       ALA  62  84.494   9.728   0.704
  475    HA   ALA  62           HA       ALA  62  83.175   7.348   1.957
  476    HB1  ALA  62           HB1      ALA  62  82.117   8.368  -0.213
  477    HB2  ALA  62           HB2      ALA  62  82.360   6.622  -0.116
  478    HB3  ALA  62           HB3      ALA  62  83.493   7.625  -1.027
  479    H    LEU  63           HN       LEU  63  84.231   5.303   1.104
  480    HA   LEU  63           HA       LEU  63  87.160   5.702   1.149
  481    HB2  LEU  63           HB2      LEU  63  86.973   3.032   1.413
  482    HB3  LEU  63           HB1      LEU  63  86.718   4.112   2.792
  483    HG   LEU  63           HG       LEU  63  84.310   4.084   2.400
  484   HD11  LEU  63          HD11      LEU  63  83.992   3.860   0.117
  485   HD12  LEU  63          HD12      LEU  63  83.597   2.242   0.667
  486   HD13  LEU  63          HD13      LEU  63  85.193   2.586  -0.011
  487   HD21  LEU  63          HD21      LEU  63  83.858   1.884   3.164
  488   HD22  LEU  63          HD22      LEU  63  85.491   2.245   3.737
  489   HD23  LEU  63          HD23      LEU  63  85.262   1.225   2.317
  490    H    TRP  64           HN       TRP  64  88.561   4.767  -0.306
  491    HA   TRP  64           HA       TRP  64  87.431   3.605  -2.824
  492    HB2  TRP  64           HB2      TRP  64  87.880   5.496  -4.035
  493    HB3  TRP  64           HB1      TRP  64  88.114   6.321  -2.523
  494    HD1  TRP  64           HD1      TRP  64  90.870   5.527  -1.585
  495    HE1  TRP  64           HE1      TRP  64  93.000   6.040  -2.935
  496    HE3  TRP  64           HE3      TRP  64  88.815   6.185  -6.198
  497    HZ2  TRP  64           HZ2      TRP  64  93.725   6.700  -5.626
  498    HZ3  TRP  64           HZ3      TRP  64  90.240   6.781  -8.136
  499    HH2  TRP  64           HH2      TRP  64  92.688   7.042  -7.856
  500    H    TRP  65           HN       TRP  65  88.878   2.104  -3.780
  501    HA   TRP  65           HA       TRP  65  91.185   1.377  -2.065
  502    HB2  TRP  65           HB2      TRP  65  89.432  -0.298  -2.925
  503    HB3  TRP  65           HB1      TRP  65  90.223  -0.151  -4.486
  504    HD1  TRP  65           HD1      TRP  65  93.023   0.243  -2.340
  505    HE1  TRP  65           HE1      TRP  65  94.218  -1.970  -1.821
  506    HE3  TRP  65           HE3      TRP  65  89.401  -3.067  -3.770
  507    HZ2  TRP  65           HZ2      TRP  65  93.714  -4.781  -1.997
  508    HZ3  TRP  65           HZ3      TRP  65  89.792  -5.506  -3.588
  509    HH2  TRP  65           HH2      TRP  65  91.941  -6.367  -2.702
  510    H    GLU  66           HN       GLU  66  92.723   3.011  -2.716
  511    HA   GLU  66           HA       GLU  66  93.275   3.784  -5.370
  512    HB2  GLU  66           HB2      GLU  66  95.604   4.304  -4.517
  513    HB3  GLU  66           HB1      GLU  66  94.280   5.031  -3.620
  514    HG2  GLU  66           HG2      GLU  66  94.387   3.196  -1.972
  515    HG3  GLU  66           HG1      GLU  66  95.719   2.488  -2.874
  516    H    LYS  67           HN       LYS  67  94.109   0.783  -3.765
  517    HA   LYS  67           HA       LYS  67  96.276   0.105  -5.556
  518    HB2  LYS  67           HB2      LYS  67  94.355  -1.861  -4.286
  519    HB3  LYS  67           HB1      LYS  67  95.999  -2.180  -4.823
  520    HG2  LYS  67           HG2      LYS  67  95.198  -0.369  -2.531
  521    HG3  LYS  67           HG1      LYS  67  95.940  -1.956  -2.385
  522    HD2  LYS  67           HD2      LYS  67  97.840  -0.953  -3.849
  523    HD3  LYS  67           HD1      LYS  67  97.140   0.606  -3.412
  524    HE2  LYS  67           HE2      LYS  67  98.539   0.432  -1.594
  525    HE3  LYS  67           HE1      LYS  67  97.254  -0.595  -0.948
  526    HZ1  LYS  67           HZ1      LYS  67  99.890  -1.298  -1.838
  527    HZ2  LYS  67           HZ2      LYS  67  98.684  -2.276  -2.528
  528    HZ3  LYS  67           HZ3      LYS  67  98.819  -2.153  -0.839
  529    H    LYS  68           HN       LYS  68  93.023   0.615  -5.889
  530    HA   LYS  68           HA       LYS  68  92.903  -0.700  -8.560
  531    HB2  LYS  68           HB2      LYS  68  90.436  -0.452  -6.852
  532    HB3  LYS  68           HB1      LYS  68  90.787  -1.604  -8.138
  533    HG2  LYS  68           HG2      LYS  68  92.287  -1.641  -5.499
  534    HG3  LYS  68           HG1      LYS  68  90.787  -2.504  -5.746
  535    HD2  LYS  68           HD2      LYS  68  91.704  -3.891  -7.432
  536    HD3  LYS  68           HD1      LYS  68  93.100  -2.836  -7.645
  537    HE2  LYS  68           HE2      LYS  68  94.165  -3.637  -5.748
  538    HE3  LYS  68           HE1      LYS  68  92.659  -4.062  -4.942
  539    HZ1  LYS  68           HZ1      LYS  68  92.461  -5.761  -6.855
  540    HZ2  LYS  68           HZ2      LYS  68  93.492  -6.099  -5.548
  541    HZ3  LYS  68           HZ3      LYS  68  94.134  -5.536  -7.017
  542    H    ARG  69           HN       ARG  69  92.576   2.078  -6.638
  543    HA   ARG  69           HA       ARG  69  91.707   4.214  -7.062
  544    HB2  ARG  69           HB2      ARG  69  92.303   3.215  -9.869
  545    HB3  ARG  69           HB1      ARG  69  91.697   4.836  -9.559
  546    HG2  ARG  69           HG2      ARG  69  93.998   5.225  -9.566
  547    HG3  ARG  69           HG1      ARG  69  93.721   4.954  -7.850
  548    HD2  ARG  69           HD2      ARG  69  95.553   3.567  -8.280
  549    HD3  ARG  69           HD1      ARG  69  94.202   2.450  -8.427
  550    HE   ARG  69           HE       ARG  69  94.673   2.266 -10.735
  551   HH11  ARG  69          HH11      ARG  69  95.921   2.733 -12.564
  552   HH12  ARG  69          HH12      ARG  69  96.995   4.091 -12.538
  553   HH21  ARG  69          HH21      ARG  69  96.186   5.005  -9.292
  554   HH22  ARG  69          HH22      ARG  69  97.144   5.379 -10.685
  555    H    THR  70           HN       THR  70  89.854   2.339  -6.421
  556    HA   THR  70           HA       THR  70  87.589   2.779  -8.348
  557    HB   THR  70           HB       THR  70  88.462   0.416  -7.768
  558    HG1  THR  70           HG1      THR  70  85.951   1.418  -7.984
  559   HG21  THR  70          HG21      THR  70  88.399   1.106  -5.221
  560   HG22  THR  70          HG22      THR  70  88.009  -0.543  -5.709
  561   HG23  THR  70          HG23      THR  70  86.714   0.601  -5.355
  562    H    TRP  71           HN       TRP  71  85.503   2.268  -6.840
  563    HA   TRP  71           HA       TRP  71  85.652   3.942  -4.387
  564    HB2  TRP  71           HB2      TRP  71  83.227   4.650  -5.084
  565    HB3  TRP  71           HB1      TRP  71  84.596   5.503  -5.772
  566    HD1  TRP  71           HD1      TRP  71  83.863   2.046  -7.170
  567    HE1  TRP  71           HE1      TRP  71  82.878   2.283  -9.495
  568    HE3  TRP  71           HE3      TRP  71  83.142   7.100  -7.318
  569    HZ2  TRP  71           HZ2      TRP  71  81.919   4.328 -11.257
  570    HZ3  TRP  71           HZ3      TRP  71  82.193   8.165  -9.346
  571    HH2  TRP  71           HH2      TRP  71  81.582   6.786 -11.314
  572    H    LEU  72           HN       LEU  72  85.513   2.233  -3.025
  573    HA   LEU  72           HA       LEU  72  84.029  -0.120  -3.577
  574    HB2  LEU  72           HB2      LEU  72  84.506   0.766  -0.776
  575    HB3  LEU  72           HB1      LEU  72  84.519  -0.841  -1.401
  576    HG   LEU  72           HG       LEU  72  86.563   1.030  -2.519
  577   HD11  LEU  72          HD11      LEU  72  87.987   0.138  -0.394
  578   HD12  LEU  72          HD12      LEU  72  86.422   0.426   0.365
  579   HD13  LEU  72          HD13      LEU  72  87.243   1.731  -0.497
  580   HD21  LEU  72          HD21      LEU  72  87.762  -1.381  -1.754
  581   HD22  LEU  72          HD22      LEU  72  87.240  -0.914  -3.374
  582   HD23  LEU  72          HD23      LEU  72  86.169  -1.848  -2.343
  583    H    LEU  73           HN       LEU  73  82.064   0.547  -4.312
  584    HA   LEU  73           HA       LEU  73  80.123   1.564  -2.263
  585    HB2  LEU  73           HB2      LEU  73  78.777   2.401  -4.220
  586    HB3  LEU  73           HB1      LEU  73  80.308   3.232  -3.984
  587    HG   LEU  73           HG       LEU  73  81.157   1.319  -5.713
  588   HD11  LEU  73          HD11      LEU  73  79.428   1.052  -7.490
  589   HD12  LEU  73          HD12      LEU  73  78.236   1.750  -6.393
  590   HD13  LEU  73          HD13      LEU  73  79.006   0.216  -5.997
  591   HD21  LEU  73          HD21      LEU  73  80.950   2.956  -7.493
  592   HD22  LEU  73          HD22      LEU  73  81.288   3.812  -5.994
  593   HD23  LEU  73          HD23      LEU  73  79.650   3.781  -6.637
  594    H    LYS  74           HN       LYS  74  81.119  -1.189  -3.411
  595    HA   LYS  74           HA       LYS  74  78.567  -2.306  -4.368
  596    HB2  LYS  74           HB2      LYS  74  81.371  -3.058  -4.487
  597    HB3  LYS  74           HB1      LYS  74  80.444  -4.396  -3.858
  598    HG2  LYS  74           HG2      LYS  74  80.595  -4.554  -6.299
  599    HG3  LYS  74           HG1      LYS  74  78.930  -4.322  -5.791
  600    HD2  LYS  74           HD2      LYS  74  79.727  -2.959  -7.812
  601    HD3  LYS  74           HD1      LYS  74  78.906  -2.060  -6.551
  602    HE2  LYS  74           HE2      LYS  74  80.919  -1.103  -5.768
  603    HE3  LYS  74           HE1      LYS  74  81.899  -2.325  -6.561
  604    HZ1  LYS  74           HZ1      LYS  74  80.249  -0.885  -8.394
  605    HZ2  LYS  74           HZ2      LYS  74  81.922  -1.179  -8.445
  606    HZ3  LYS  74           HZ3      LYS  74  81.314   0.134  -7.554
  607    H    THR  75           HN       THR  75  77.494  -1.662  -2.280
  608    HA   THR  75           HA       THR  75  78.247  -2.881   0.198
  609    HB   THR  75           HB       THR  75  75.337  -2.378  -0.248
  610    HG1  THR  75           HG1      THR  75  77.175  -0.235  -0.318
  611   HG21  THR  75          HG21      THR  75  75.509  -1.238   1.849
  612   HG22  THR  75          HG22      THR  75  77.260  -1.091   1.705
  613   HG23  THR  75          HG23      THR  75  76.528  -2.670   1.993
  614    H    HIS  76           HN       HIS  76  76.559  -4.041  -2.609
  615    HA   HIS  76           HA       HIS  76  75.457  -6.408  -1.257
  616    HB2  HIS  76           HB2      HIS  76  74.374  -5.311  -3.267
  617    HB3  HIS  76           HB1      HIS  76  75.730  -5.890  -4.234
  618    HD1  HIS  76           HD1      HIS  76  74.536  -8.081  -1.477
  619    HD2  HIS  76           HD2      HIS  76  73.923  -7.708  -5.584
  620    HE1  HIS  76           HE1      HIS  76  73.378 -10.206  -2.226
  621    H    TRP  77           HN       TRP  77  77.672  -6.933  -0.409
  622    HA   TRP  77           HA       TRP  77  78.864  -9.206  -1.382
  623    HB2  TRP  77           HB2      TRP  77  79.700  -6.837  -2.974
  624    HB3  TRP  77           HB1      TRP  77  81.041  -7.753  -2.326
  625    HD1  TRP  77           HD1      TRP  77  81.759  -8.519  -4.688
  626    HE1  TRP  77           HE1      TRP  77  80.920 -10.354  -6.272
  627    HE3  TRP  77           HE3      TRP  77  77.114  -9.520  -2.639
  628    HZ2  TRP  77           HZ2      TRP  77  78.653 -12.005  -6.649
  629    HZ3  TRP  77           HZ3      TRP  77  75.679 -11.230  -3.662
  630    HH2  TRP  77           HH2      TRP  77  76.432 -12.476  -5.661
  631    H    THR  78           HN       THR  78  81.553  -8.860  -0.759
  632    HA   THR  78           HA       THR  78  81.668  -7.206   1.680
  633    HB   THR  78           HB       THR  78  82.619  -9.934   2.267
  634    HG1  THR  78           HG1      THR  78  80.854 -10.282   0.743
  635   HG21  THR  78          HG21      THR  78  82.225  -8.650   4.170
  636   HG22  THR  78          HG22      THR  78  80.761  -9.628   4.079
  637   HG23  THR  78          HG23      THR  78  80.725  -7.955   3.540
  638    H    LEU  79           HN       LEU  79  83.953  -8.037   2.749
  639    HA   LEU  79           HA       LEU  79  85.997  -7.033   1.026
  640    HB2  LEU  79           HB2      LEU  79  86.071  -8.652   3.564
  641    HB3  LEU  79           HB1      LEU  79  87.539  -8.103   2.779
  642    HG   LEU  79           HG       LEU  79  86.913  -5.784   3.096
  643   HD11  LEU  79          HD11      LEU  79  84.794  -5.286   4.417
  644   HD12  LEU  79          HD12      LEU  79  84.308  -6.946   4.096
  645   HD13  LEU  79          HD13      LEU  79  84.537  -5.818   2.757
  646   HD21  LEU  79          HD21      LEU  79  86.608  -5.798   5.654
  647   HD22  LEU  79          HD22      LEU  79  88.003  -6.676   5.022
  648   HD23  LEU  79          HD23      LEU  79  86.561  -7.559   5.529
  649    H    ASP  80           HN       ASP  80  85.483 -10.283   2.347
  650    HA   ASP  80           HA       ASP  80  87.313 -11.800   0.949
  651    HB2  ASP  80           HB2      ASP  80  85.640 -12.649   2.583
  652    HB3  ASP  80           HB1      ASP  80  84.399 -12.524   1.338
  653    H    LYS  81           HN       LYS  81  84.063 -10.955  -0.198
  654    HA   LYS  81           HA       LYS  81  84.069 -12.173  -2.675
  655    HB2  LYS  81           HB2      LYS  81  83.108  -9.329  -2.373
  656    HB3  LYS  81           HB1      LYS  81  82.442 -10.614  -3.374
  657    HG2  LYS  81           HG2      LYS  81  82.368 -10.421  -0.367
  658    HG3  LYS  81           HG1      LYS  81  80.993 -10.379  -1.474
  659    HD2  LYS  81           HD2      LYS  81  81.799 -12.717  -2.233
  660    HD3  LYS  81           HD1      LYS  81  82.749 -12.718  -0.752
  661    HE2  LYS  81           HE2      LYS  81  80.743 -13.744  -0.084
  662    HE3  LYS  81           HE1      LYS  81  80.499 -12.068   0.404
  663    HZ1  LYS  81           HZ1      LYS  81  79.137 -11.656  -1.419
  664    HZ2  LYS  81           HZ2      LYS  81  78.651 -13.199  -0.902
  665    HZ3  LYS  81           HZ3      LYS  81  79.660 -13.034  -2.258
  666    H    TYR  82           HN       TYR  82  85.261  -8.888  -2.016
  667    HA   TYR  82           HA       TYR  82  86.450  -8.674  -4.671
  668    HB2  TYR  82           HB2      TYR  82  86.323  -6.984  -2.212
  669    HB3  TYR  82           HB1      TYR  82  87.710  -6.702  -3.262
  670    HD1  TYR  82           HD1      TYR  82  87.454  -5.775  -5.477
  671    HD2  TYR  82           HD2      TYR  82  84.017  -6.627  -3.047
  672    HE1  TYR  82           HE1      TYR  82  86.032  -4.472  -7.035
  673    HE2  TYR  82           HE2      TYR  82  82.594  -5.322  -4.605
  674    HH   TYR  82           HH       TYR  82  83.313  -4.609  -7.586
  675    H    GLY  83           HN       GLY  83  87.691  -9.404  -1.423
  676    HA2  GLY  83           HA2      GLY  83  89.505 -11.111  -1.273
  677    HA3  GLY  83           HA1      GLY  83  90.240 -10.369  -2.697
  678    H    ILE  84           HN       ILE  84  88.831  -8.061  -0.728
  679    HA   ILE  84           HA       ILE  84  91.280  -6.754  -0.103
  680    HB   ILE  84           HB       ILE  84  88.537  -6.514   1.175
  681   HG12  ILE  84          HG12      ILE  84  89.782  -4.636  -0.830
  682   HG13  ILE  84          HG11      ILE  84  88.931  -6.080  -1.370
  683   HG21  ILE  84          HG21      ILE  84  89.303  -4.263   1.869
  684   HG22  ILE  84          HG22      ILE  84  90.905  -4.615   1.231
  685   HG23  ILE  84          HG23      ILE  84  90.284  -5.520   2.609
  686   HD11  ILE  84          HD11      ILE  84  87.531  -3.943  -1.188
  687   HD12  ILE  84          HD12      ILE  84  87.697  -4.112   0.559
  688   HD13  ILE  84          HD13      ILE  84  86.885  -5.369  -0.376
  689    H    GLN  85           HN       GLN  85  92.215  -6.452   2.034
  690    HA   GLN  85           HA       GLN  85  91.495  -8.214   4.224
  691    HB2  GLN  85           HB2      GLN  85  92.919  -9.521   2.339
  692    HB3  GLN  85           HB1      GLN  85  94.259  -8.779   3.202
  693    HG2  GLN  85           HG2      GLN  85  94.053 -10.738   4.439
  694    HG3  GLN  85           HG1      GLN  85  92.942  -9.709   5.341
  695   HE21  GLN  85          HE21      GLN  85  90.743  -9.677   3.582
  696   HE22  GLN  85          HE22      GLN  85  90.098 -11.235   3.473
  697    H    ALA  86           HN       ALA  86  93.915  -8.219   5.584
  698    HA   ALA  86           HA       ALA  86  94.077  -5.495   6.509
  699    HB1  ALA  86           HB1      ALA  86  95.601  -8.030   7.059
  700    HB2  ALA  86           HB2      ALA  86  94.534  -7.132   8.140
  701    HB3  ALA  86           HB3      ALA  86  96.135  -6.500   7.757
  702    H    ASP  87           HN       ASP  87  95.830  -7.339   4.129
  703    HA   ASP  87           HA       ASP  87  98.130  -5.544   4.080
  704    HB2  ASP  87           HB2      ASP  87  98.631  -6.787   1.931
  705    HB3  ASP  87           HB1      ASP  87  98.481  -7.815   3.357
  706    H    ALA  88           HN       ALA  88  94.962  -5.352   3.057
  707    HA   ALA  88           HA       ALA  88  95.532  -3.588   0.729
  708    HB1  ALA  88           HB1      ALA  88  93.083  -4.926   1.855
  709    HB2  ALA  88           HB2      ALA  88  93.834  -5.201   0.288
  710    HB3  ALA  88           HB3      ALA  88  92.963  -3.696   0.597
  711    H    LYS  89           HN       LYS  89  95.852  -1.459   1.331
  712    HA   LYS  89           HA       LYS  89  94.488  -0.439   3.766
  713    HB2  LYS  89           HB2      LYS  89  96.316   1.223   2.047
  714    HB3  LYS  89           HB1      LYS  89  96.014   1.331   3.780
  715    HG2  LYS  89           HG2      LYS  89  97.440  -0.993   2.450
  716    HG3  LYS  89           HG1      LYS  89  98.248   0.378   3.185
  717    HD2  LYS  89           HD2      LYS  89  97.517  -0.177   5.360
  718    HD3  LYS  89           HD1      LYS  89  96.269  -1.262   4.756
  719    HE2  LYS  89           HE2      LYS  89  98.229  -2.497   5.652
  720    HE3  LYS  89           HE1      LYS  89  97.942  -2.816   3.940
  721    HZ1  LYS  89           HZ1      LYS  89  99.689  -0.576   4.539
  722    HZ2  LYS  89           HZ2      LYS  89  99.820  -1.767   3.334
  723    HZ3  LYS  89           HZ3      LYS  89 100.307  -2.107   4.925
  724    H    LEU  90           HN       LEU  90  92.576   0.388   3.558
  725    HA   LEU  90           HA       LEU  90  91.675   1.545   0.980
  726    HB2  LEU  90           HB2      LEU  90  90.026   1.347   3.495
  727    HB3  LEU  90           HB1      LEU  90  89.471   1.415   1.825
  728    HG   LEU  90           HG       LEU  90  90.912  -0.864   3.181
  729   HD11  LEU  90          HD11      LEU  90  88.865  -2.100   2.716
  730   HD12  LEU  90          HD12      LEU  90  88.198  -0.721   1.841
  731   HD13  LEU  90          HD13      LEU  90  88.455  -0.620   3.583
  732   HD21  LEU  90          HD21      LEU  90  90.272  -0.356   0.267
  733   HD22  LEU  90          HD22      LEU  90  90.502  -1.991   0.897
  734   HD23  LEU  90          HD23      LEU  90  91.819  -0.822   0.982
  735    H    GLN  91           HN       GLN  91  90.226   3.654   1.416
  736    HA   GLN  91           HA       GLN  91  91.666   5.430   3.367
  737    HB2  GLN  91           HB2      GLN  91  90.935   6.348   0.573
  738    HB3  GLN  91           HB1      GLN  91  91.919   7.188   1.762
  739    HG2  GLN  91           HG2      GLN  91  93.778   5.812   1.393
  740    HG3  GLN  91           HG1      GLN  91  92.824   4.513   0.724
  741   HE21  GLN  91          HE21      GLN  91  91.883   7.583  -0.422
  742   HE22  GLN  91          HE22      GLN  91  92.653   7.488  -1.922
  743    H    PHE  92           HN       PHE  92  90.343   7.568   3.518
  744    HA   PHE  92           HA       PHE  92  87.461   7.133   2.968
  745    HB2  PHE  92           HB2      PHE  92  87.997   6.300   5.284
  746    HB3  PHE  92           HB1      PHE  92  88.465   7.937   5.711
  747    HD1  PHE  92           HD1      PHE  92  85.622   6.173   3.978
  748    HD2  PHE  92           HD2      PHE  92  86.811   9.242   6.744
  749    HE1  PHE  92           HE1      PHE  92  83.243   6.704   4.417
  750    HE2  PHE  92           HE2      PHE  92  84.430   9.763   7.183
  751    HZ   PHE  92           HZ       PHE  92  82.646   8.498   6.020
  752    H    THR  93           HN       THR  93  87.416   8.784   1.512
  753    HA   THR  93           HA       THR  93  87.605  11.519   2.579
  754    HB   THR  93           HB       THR  93  89.921  11.061   2.075
  755    HG1  THR  93           HG1      THR  93  90.224  12.780   0.854
  756   HG21  THR  93          HG21      THR  93  89.612   9.111   0.639
  757   HG22  THR  93          HG22      THR  93  90.588  10.311  -0.210
  758   HG23  THR  93          HG23      THR  93  88.885  10.119  -0.613
  759    HA   PRO  94           HA       PRO  94  84.369  12.611  -0.328
  760    HB2  PRO  94           HB2      PRO  94  86.468  14.517  -1.346
  761    HB3  PRO  94           HB1      PRO  94  84.733  14.800  -1.078
  762    HG2  PRO  94           HG2      PRO  94  86.553  15.595   0.706
  763    HG3  PRO  94           HG1      PRO  94  84.975  14.963   1.213
  764    HD2  PRO  94           HD2      PRO  94  87.643  13.714   1.494
  765    HD3  PRO  94           HD1      PRO  94  86.141  13.340   2.357
  766    H    TYR 541           HT1      TYR 541  51.454  40.103  11.185
  767    HA   TYR 541           HA       TYR 541  50.088  40.131  13.027
  768    HB2  TYR 541           HB2      TYR 541  49.383  42.932  12.116
  769    HB3  TYR 541           HB1      TYR 541  48.520  42.093  13.405
  770    HD1  TYR 541           HD1      TYR 541  49.757  41.357  15.461
  771    HD2  TYR 541           HD2      TYR 541  51.552  43.877  12.484
  772    HE1  TYR 541           HE1      TYR 541  51.528  42.000  17.075
  773    HE2  TYR 541           HE2      TYR 541  53.323  44.522  14.096
  774    HH   TYR 541           HH       TYR 541  53.956  42.856  16.890
  775    H    HIS 542           HN       HIS 542  49.617  40.434   9.749
  776    HA   HIS 542           HA       HIS 542  46.818  39.364   9.917
  777    HB2  HIS 542           HB2      HIS 542  48.073  41.451   8.180
  778    HB3  HIS 542           HB1      HIS 542  46.961  40.349   7.382
  779    HD1  HIS 542           HD1      HIS 542  46.761  41.882  10.871
  780    HD2  HIS 542           HD2      HIS 542  44.580  41.768   7.320
  781    HE1  HIS 542           HE1      HIS 542  44.591  43.106  11.324
  782    H    GLU 543           HN       GLU 543  49.740  39.467   7.861
  783    HA   GLU 543           HA       GLU 543  49.086  36.950   6.544
  784    HB2  GLU 543           HB2      GLU 543  51.517  37.173   5.757
  785    HB3  GLU 543           HB1      GLU 543  50.433  38.489   5.298
  786    HG2  GLU 543           HG2      GLU 543  51.330  39.968   6.880
  787    HG3  GLU 543           HG1      GLU 543  51.972  38.667   7.886
  788    H    ARG 544           HN       ARG 544  49.745  37.429   9.621
  789    HA   ARG 544           HA       ARG 544  50.939  36.362  11.324
  790    HB2  ARG 544           HB2      ARG 544  49.863  34.168   9.577
  791    HB3  ARG 544           HB1      ARG 544  50.337  33.958  11.267
  792    HG2  ARG 544           HG2      ARG 544  48.289  35.968  10.294
  793    HG3  ARG 544           HG1      ARG 544  47.876  34.399  10.928
  794    HD2  ARG 544           HD2      ARG 544  49.527  35.364  12.919
  795    HD3  ARG 544           HD1      ARG 544  48.723  36.829  12.372
  796    HE   ARG 544           HE       ARG 544  47.563  34.925  14.076
  797   HH11  ARG 544          HH11      ARG 544  45.360  34.519  14.239
  798   HH12  ARG 544          HH12      ARG 544  44.301  35.014  12.962
  799   HH21  ARG 544          HH21      ARG 544  46.821  36.387  11.034
  800   HH22  ARG 544          HH22      ARG 544  45.129  36.061  11.150
  801    H    ARG 545           HN       ARG 545  52.279  33.910  11.379
  802    HA   ARG 545           HA       ARG 545  54.721  34.541   9.766
  803    HB2  ARG 545           HB2      ARG 545  55.787  33.088  11.613
  804    HB3  ARG 545           HB1      ARG 545  55.262  34.704  12.053
  805    HG2  ARG 545           HG2      ARG 545  53.229  32.522  12.347
  806    HG3  ARG 545           HG1      ARG 545  54.572  32.494  13.479
  807    HD2  ARG 545           HD2      ARG 545  54.087  34.888  14.048
  808    HD3  ARG 545           HD1      ARG 545  52.658  34.800  13.018
  809    HE   ARG 545           HE       ARG 545  52.354  32.660  14.748
  810   HH11  ARG 545          HH11      ARG 545  51.282  32.836  16.731
  811   HH12  ARG 545          HH12      ARG 545  51.186  34.378  17.514
  812   HH21  ARG 545          HH21      ARG 545  52.950  36.043  15.034
  813   HH22  ARG 545          HH22      ARG 545  52.131  36.194  16.553
  814    H    GLY 546           HN       GLY 546  56.049  32.123  10.099
  815    HA2  GLY 546           HA2      GLY 546  54.529  30.386   8.243
  816    HA3  GLY 546           HA1      GLY 546  56.242  30.234   8.641
  817    H    SER 547           HN       SER 547  56.860  29.003  10.434
  818    HA   SER 547           HA       SER 547  54.838  27.943  12.280
  819    HB2  SER 547           HB2      SER 547  56.043  26.296  10.075
  820    HB3  SER 547           HB1      SER 547  55.752  25.532  11.636
  821    HG   SER 547           HG       SER 547  53.580  26.200  11.468
  822    H    LEU 548           HN       LEU 548  55.933  28.145  14.178
  823    HA   LEU 548           HA       LEU 548  58.740  28.488  14.326
  824    HB2  LEU 548           HB2      LEU 548  56.499  28.182  16.232
  825    HB3  LEU 548           HB1      LEU 548  58.052  27.665  16.874
  826    HG   LEU 548           HG       LEU 548  58.994  29.897  16.086
  827   HD11  LEU 548          HD11      LEU 548  57.146  31.684  15.868
  828   HD12  LEU 548          HD12      LEU 548  56.069  30.333  15.520
  829   HD13  LEU 548          HD13      LEU 548  57.453  30.649  14.480
  830   HD21  LEU 548          HD21      LEU 548  58.311  31.042  18.028
  831   HD22  LEU 548          HD22      LEU 548  58.164  29.338  18.454
  832   HD23  LEU 548          HD23      LEU 548  56.728  30.268  18.031
  833    H    CYS 549           HN       CYS 549  60.431  27.089  14.604
  834    HA   CYS 549           HA       CYS 549  59.852  24.217  14.277
  835    HB2  CYS 549           HB2      CYS 549  61.756  24.887  13.051
  836    HB3  CYS 549           HB1      CYS 549  62.314  25.963  14.318
  837    H    SER 550           HN       SER 550  59.050  23.419  16.148
  838    HA   SER 550           HA       SER 550  59.455  24.351  18.735
  839    HB2  SER 550           HB2      SER 550  57.733  22.781  18.413
  840    HB3  SER 550           HB1      SER 550  58.830  21.562  17.774
  841    HG   SER 550           HG       SER 550  59.827  21.537  19.858
  842    H    GLY 551           HN       GLY 551  61.066  24.408  20.048
  843    HA2  GLY 551           HA2      GLY 551  62.988  23.321  21.186
  844    HA3  GLY 551           HA1      GLY 551  63.428  22.608  19.627
  845    H    CYS 552           HN       CYS 552  62.742  24.908  18.100
  846    HA   CYS 552           HA       CYS 552  65.058  26.691  18.728
  847    HB2  CYS 552           HB2      CYS 552  63.605  25.834  16.237
  848    HB3  CYS 552           HB1      CYS 552  64.457  27.369  16.250
  849    H    GLN 553           HN       GLN 553  61.650  26.476  17.955
  850    HA   GLN 553           HA       GLN 553  59.945  27.991  18.029
  851    HB2  GLN 553           HB2      GLN 553  61.654  29.143  20.214
  852    HB3  GLN 553           HB1      GLN 553  59.993  29.641  19.883
  853    HG2  GLN 553           HG2      GLN 553  60.814  26.785  20.412
  854    HG3  GLN 553           HG1      GLN 553  60.184  27.857  21.647
  855   HE21  GLN 553          HE21      GLN 553  59.362  26.192  18.633
  856   HE22  GLN 553          HE22      GLN 553  57.678  26.260  18.841
  857    H    LYS 554           HN       LYS 554  61.204  28.388  15.963
  858    HA   LYS 554           HA       LYS 554  61.257  31.319  15.573
  859    HB2  LYS 554           HB2      LYS 554  63.365  29.427  14.516
  860    HB3  LYS 554           HB1      LYS 554  63.212  31.108  14.034
  861    HG2  LYS 554           HG2      LYS 554  63.649  30.186  16.886
  862    HG3  LYS 554           HG1      LYS 554  64.939  30.721  15.815
  863    HD2  LYS 554           HD2      LYS 554  63.441  32.872  15.534
  864    HD3  LYS 554           HD1      LYS 554  62.704  32.324  17.038
  865    HE2  LYS 554           HE2      LYS 554  65.668  32.810  16.628
  866    HE3  LYS 554           HE1      LYS 554  64.562  33.902  17.462
  867    HZ1  LYS 554           HZ1      LYS 554  64.040  31.691  18.777
  868    HZ2  LYS 554           HZ2      LYS 554  65.312  32.724  19.227
  869    HZ3  LYS 554           HZ3      LYS 554  65.631  31.324  18.318
  870    HA   PRO 555           HA       PRO 555  58.256  29.827  12.516
  871    HB2  PRO 555           HB2      PRO 555  59.226  32.125  10.910
  872    HB3  PRO 555           HB1      PRO 555  57.580  31.677  11.352
  873    HG2  PRO 555           HG2      PRO 555  58.960  33.720  12.562
  874    HG3  PRO 555           HG1      PRO 555  57.671  32.815  13.361
  875    HD2  PRO 555           HD2      PRO 555  60.568  32.770  13.922
  876    HD3  PRO 555           HD1      PRO 555  59.230  32.132  14.911
  877    H    ILE 556           HN       ILE 556  58.358  28.435  10.908
  878    HA   ILE 556           HA       ILE 556  60.938  27.954   9.521
  879    HB   ILE 556           HB       ILE 556  58.358  26.379   9.786
  880   HG12  ILE 556          HG12      ILE 556  61.084  25.509  10.743
  881   HG13  ILE 556          HG11      ILE 556  60.157  26.622  11.727
  882   HG21  ILE 556          HG21      ILE 556  59.778  24.560   8.724
  883   HG22  ILE 556          HG22      ILE 556  60.896  25.831   8.244
  884   HG23  ILE 556          HG23      ILE 556  59.237  25.840   7.645
  885   HD11  ILE 556          HD11      ILE 556  58.597  25.031  12.301
  886   HD12  ILE 556          HD12      ILE 556  59.927  23.934  11.950
  887   HD13  ILE 556          HD13      ILE 556  58.682  24.219  10.737
  888    H    THR 557           HN       THR 557  60.938  29.500   7.846
  889    HA   THR 557           HA       THR 557  58.491  29.759   6.168
  890    HB   THR 557           HB       THR 557  59.619  31.747   5.259
  891    HG1  THR 557           HG1      THR 557  61.754  30.521   6.185
  892   HG21  THR 557          HG21      THR 557  58.263  32.081   7.204
  893   HG22  THR 557          HG22      THR 557  59.751  32.989   7.474
  894   HG23  THR 557          HG23      THR 557  59.510  31.430   8.267
  895    H    GLY 558           HN       GLY 558  58.583  27.902   4.924
  896    HA2  GLY 558           HA2      GLY 558  59.581  27.836   2.417
  897    HA3  GLY 558           HA1      GLY 558  60.968  27.242   3.343
  898    H    ARG 559           HN       ARG 559  60.865  25.234   4.285
  899    HA   ARG 559           HA       ARG 559  58.458  23.552   3.701
  900    HB2  ARG 559           HB2      ARG 559  61.423  23.013   3.645
  901    HB3  ARG 559           HB1      ARG 559  60.330  21.688   4.037
  902    HG2  ARG 559           HG2      ARG 559  59.768  23.403   1.626
  903    HG3  ARG 559           HG1      ARG 559  60.996  22.144   1.522
  904    HD2  ARG 559           HD2      ARG 559  59.447  20.419   1.887
  905    HD3  ARG 559           HD1      ARG 559  58.270  21.497   2.635
  906    HE   ARG 559           HE       ARG 559  58.474  22.439   0.037
  907   HH11  ARG 559          HH11      ARG 559  57.144  21.686  -1.630
  908   HH12  ARG 559          HH12      ARG 559  56.444  20.106  -1.515
  909   HH21  ARG 559          HH21      ARG 559  57.878  19.405   1.563
  910   HH22  ARG 559          HH22      ARG 559  56.859  18.815   0.293
  911    H    CYS 560           HN       CYS 560  57.845  22.108   5.448
  912    HA   CYS 560           HA       CYS 560  59.250  22.524   8.021
  913    HB2  CYS 560           HB2      CYS 560  57.128  23.005   9.198
  914    HB3  CYS 560           HB1      CYS 560  57.557  24.269   8.043
  915    HG   CYS 560           HG       CYS 560  55.748  23.377   6.415
  916    H    ILE 561           HN       ILE 561  59.520  20.731   9.032
  917    HA   ILE 561           HA       ILE 561  57.994  18.332   8.241
  918    HB   ILE 561           HB       ILE 561  60.342  18.759  10.111
  919   HG12  ILE 561          HG12      ILE 561  60.061  17.669   7.318
  920   HG13  ILE 561          HG11      ILE 561  60.822  19.189   7.760
  921   HG21  ILE 561          HG21      ILE 561  58.892  16.731  10.662
  922   HG22  ILE 561          HG22      ILE 561  60.556  16.359  10.215
  923   HG23  ILE 561          HG23      ILE 561  59.263  16.136   9.041
  924   HD11  ILE 561          HD11      ILE 561  62.604  17.621   7.467
  925   HD12  ILE 561          HD12      ILE 561  61.762  16.392   8.417
  926   HD13  ILE 561          HD13      ILE 561  62.404  17.836   9.205
  927    H    THR 562           HN       THR 562  56.753  17.234   9.683
  928    HA   THR 562           HA       THR 562  56.053  18.646  12.225
  929    HB   THR 562           HB       THR 562  54.134  16.896  10.704
  930    HG1  THR 562           HG1      THR 562  53.752  18.493   9.416
  931   HG21  THR 562          HG21      THR 562  53.663  19.123  12.692
  932   HG22  THR 562          HG22      THR 562  53.819  17.428  13.162
  933   HG23  THR 562          HG23      THR 562  52.491  17.938  12.116
  934    H    ALA 563           HN       ALA 563  55.712  17.418  14.007
  935    HA   ALA 563           HA       ALA 563  56.532  14.547  13.834
  936    HB1  ALA 563           HB1      ALA 563  57.728  14.861  15.915
  937    HB2  ALA 563           HB2      ALA 563  57.122  16.515  16.049
  938    HB3  ALA 563           HB3      ALA 563  58.263  16.096  14.766
  939    H    MET 564           HN       MET 564  56.081  15.045  16.914
  940    HA   MET 564           HA       MET 564  53.556  13.713  17.094
  941    HB2  MET 564           HB2      MET 564  54.732  15.364  19.318
  942    HB3  MET 564           HB1      MET 564  53.896  13.813  19.409
  943    HG2  MET 564           HG2      MET 564  55.884  12.867  18.059
  944    HG3  MET 564           HG1      MET 564  56.701  14.376  18.454
  945    HE1  MET 564           HE1      MET 564  54.739  11.491  19.550
  946    HE2  MET 564           HE2      MET 564  54.223  12.204  21.075
  947    HE3  MET 564           HE3      MET 564  55.432  10.923  21.075
  948    H    ALA 565           HN       ALA 565  53.714  16.278  15.668
  949    HA   ALA 565           HA       ALA 565  51.807  17.702  15.195
  950    HB1  ALA 565           HB1      ALA 565  50.495  18.696  16.935
  951    HB2  ALA 565           HB2      ALA 565  51.613  18.161  18.184
  952    HB3  ALA 565           HB3      ALA 565  50.607  16.984  17.330
  953    H    LYS 566           HN       LYS 566  54.695  17.744  16.830
  954    HA   LYS 566           HA       LYS 566  54.962  20.665  17.054
  955    HB2  LYS 566           HB2      LYS 566  56.637  18.253  17.606
  956    HB3  LYS 566           HB1      LYS 566  57.515  19.731  17.237
  957    HG2  LYS 566           HG2      LYS 566  56.573  20.886  19.075
  958    HG3  LYS 566           HG1      LYS 566  55.306  19.683  19.294
  959    HD2  LYS 566           HD2      LYS 566  58.177  18.801  19.511
  960    HD3  LYS 566           HD1      LYS 566  57.462  19.683  20.854
  961    HE2  LYS 566           HE2      LYS 566  55.889  18.004  21.296
  962    HE3  LYS 566           HE1      LYS 566  55.956  17.365  19.649
  963    HZ1  LYS 566           HZ1      LYS 566  57.379  15.870  20.422
  964    HZ2  LYS 566           HZ2      LYS 566  57.502  16.647  21.928
  965    HZ3  LYS 566           HZ3      LYS 566  58.509  17.115  20.642
  966    H    LYS 567           HN       LYS 567  56.610  21.822  15.761
  967    HA   LYS 567           HA       LYS 567  56.750  20.759  12.968
  968    HB2  LYS 567           HB2      LYS 567  57.442  23.576  13.730
  969    HB3  LYS 567           HB1      LYS 567  56.772  22.977  12.224
  970    HG2  LYS 567           HG2      LYS 567  55.302  23.162  14.877
  971    HG3  LYS 567           HG1      LYS 567  55.074  24.222  13.496
  972    HD2  LYS 567           HD2      LYS 567  54.559  21.215  13.452
  973    HD3  LYS 567           HD1      LYS 567  53.318  22.456  13.634
  974    HE2  LYS 567           HE2      LYS 567  54.293  23.452  11.434
  975    HE3  LYS 567           HE1      LYS 567  55.034  21.866  11.239
  976    HZ1  LYS 567           HZ1      LYS 567  52.677  22.327  10.297
  977    HZ2  LYS 567           HZ2      LYS 567  52.180  22.045  11.897
  978    HZ3  LYS 567           HZ3      LYS 567  53.014  20.839  11.038
  979    H    PHE 568           HN       PHE 568  58.944  21.603  11.874
  980    HA   PHE 568           HA       PHE 568  61.170  21.753  13.784
  981    HB2  PHE 568           HB2      PHE 568  60.277  19.176  12.735
  982    HB3  PHE 568           HB1      PHE 568  61.928  19.477  12.229
  983    HD1  PHE 568           HD1      PHE 568  63.518  20.423  14.145
  984    HD2  PHE 568           HD2      PHE 568  59.894  18.223  14.846
  985    HE1  PHE 568           HE1      PHE 568  64.323  19.817  16.410
  986    HE2  PHE 568           HE2      PHE 568  60.701  17.617  17.111
  987    HZ   PHE 568           HZ       PHE 568  62.915  18.414  17.893
  988    H    HIS 569           HN       HIS 569  62.902  22.714  12.839
  989    HA   HIS 569           HA       HIS 569  62.743  23.881  10.264
  990    HB2  HIS 569           HB2      HIS 569  64.979  23.234  12.144
  991    HB3  HIS 569           HB1      HIS 569  65.387  23.773  10.527
  992    HD2  HIS 569           HD2      HIS 569  63.786  26.368   9.981
  993    HE1  HIS 569           HE1      HIS 569  64.502  27.538  13.965
  994    HA   PRO 570           HA       PRO 570  63.003  19.834   8.132
  995    HB2  PRO 570           HB2      PRO 570  63.947  21.575   5.889
  996    HB3  PRO 570           HB1      PRO 570  62.679  20.339   5.896
  997    HG2  PRO 570           HG2      PRO 570  62.111  23.003   5.904
  998    HG3  PRO 570           HG1      PRO 570  61.066  21.804   6.674
  999    HD2  PRO 570           HD2      PRO 570  62.820  23.829   7.948
 1000    HD3  PRO 570           HD1      PRO 570  61.421  22.958   8.625
 1001    H    GLU 571           HN       GLU 571  65.480  22.068   8.858
 1002    HA   GLU 571           HA       GLU 571  67.645  20.337   7.799
 1003    HB2  GLU 571           HB2      GLU 571  68.074  22.933   9.260
 1004    HB3  GLU 571           HB1      GLU 571  69.062  22.186   8.006
 1005    HG2  GLU 571           HG2      GLU 571  67.090  22.516   6.436
 1006    HG3  GLU 571           HG1      GLU 571  66.381  23.525   7.702
 1007    H    HIS 572           HN       HIS 572  66.770  22.012  10.823
 1008    HA   HIS 572           HA       HIS 572  68.701  20.736  12.465
 1009    HB2  HIS 572           HB2      HIS 572  65.940  21.606  13.366
 1010    HB3  HIS 572           HB1      HIS 572  67.391  21.477  14.361
 1011    HD2  HIS 572           HD2      HIS 572  69.194  22.890  11.721
 1012    HE1  HIS 572           HE1      HIS 572  67.119  26.336  12.968
 1013    H    PHE 573           HN       PHE 573  66.243  19.286  10.787
 1014    HA   PHE 573           HA       PHE 573  66.305  16.899  12.613
 1015    HB2  PHE 573           HB2      PHE 573  64.042  18.203  12.328
 1016    HB3  PHE 573           HB1      PHE 573  64.024  17.465  10.734
 1017    HD1  PHE 573           HD1      PHE 573  63.499  15.149  10.435
 1018    HD2  PHE 573           HD2      PHE 573  64.151  16.737  14.373
 1019    HE1  PHE 573           HE1      PHE 573  62.656  13.037  11.426
 1020    HE2  PHE 573           HE2      PHE 573  63.309  14.625  15.364
 1021    HZ   PHE 573           HZ       PHE 573  62.561  12.775  13.891
 1022    H    VAL 574           HN       VAL 574  68.278  17.130  10.889
 1023    HA   VAL 574           HA       VAL 574  67.608  15.929   8.295
 1024    HB   VAL 574           HB       VAL 574  70.069  16.127   7.880
 1025   HG11  VAL 574          HG11      VAL 574  69.354  18.048   6.935
 1026   HG12  VAL 574          HG12      VAL 574  69.709  18.884   8.426
 1027   HG13  VAL 574          HG13      VAL 574  68.092  18.236   8.137
 1028   HG21  VAL 574          HG21      VAL 574  71.324  17.569   9.519
 1029   HG22  VAL 574          HG22      VAL 574  70.877  15.986  10.163
 1030   HG23  VAL 574          HG23      VAL 574  69.962  17.427  10.624
 1031    H    CYS 575           HN       CYS 575  69.350  14.211   7.593
 1032    HA   CYS 575           HA       CYS 575  69.097  11.881   9.344
 1033    HB2  CYS 575           HB2      CYS 575  69.183  10.935   7.281
 1034    HB3  CYS 575           HB1      CYS 575  69.726  12.450   6.583
 1035    H    ALA 576           HN       ALA 576  70.903  10.765  10.408
 1036    HA   ALA 576           HA       ALA 576  73.145  12.696  10.899
 1037    HB1  ALA 576           HB1      ALA 576  73.749  10.964  12.686
 1038    HB2  ALA 576           HB2      ALA 576  72.214  10.184  12.300
 1039    HB3  ALA 576           HB3      ALA 576  72.233  11.837  12.916
 1040    H    PHE 577           HN       PHE 577  73.872  12.268   8.726
 1041    HA   PHE 577           HA       PHE 577  76.172  10.518   8.778
 1042    HB2  PHE 577           HB2      PHE 577  74.332   9.107   7.582
 1043    HB3  PHE 577           HB1      PHE 577  74.405  10.314   6.304
 1044    HD1  PHE 577           HD1      PHE 577  74.978   7.531   5.584
 1045    HD2  PHE 577           HD2      PHE 577  77.721  10.461   7.197
 1046    HE1  PHE 577           HE1      PHE 577  76.888   6.340   4.588
 1047    HE2  PHE 577           HE2      PHE 577  79.588   9.242   6.195
 1048    HZ   PHE 577           HZ       PHE 577  79.187   7.188   4.890
 1049    H    CYS 578           HN       CYS 578  74.005  12.349   6.768
 1050    HA   CYS 578           HA       CYS 578  76.093  14.389   6.118
 1051    HB2  CYS 578           HB2      CYS 578  74.646  14.842   4.102
 1052    HB3  CYS 578           HB1      CYS 578  75.381  13.248   4.084
 1053    H    LEU 579           HN       LEU 579  75.609  16.283   7.149
 1054    HA   LEU 579           HA       LEU 579  73.148  16.621   8.601
 1055    HB2  LEU 579           HB2      LEU 579  75.615  18.263   8.109
 1056    HB3  LEU 579           HB1      LEU 579  74.202  19.066   8.779
 1057    HG   LEU 579           HG       LEU 579  74.138  17.330  10.585
 1058   HD11  LEU 579          HD11      LEU 579  76.456  16.295   9.016
 1059   HD12  LEU 579          HD12      LEU 579  75.297  15.434  10.024
 1060   HD13  LEU 579          HD13      LEU 579  76.651  16.278  10.770
 1061   HD21  LEU 579          HD21      LEU 579  76.868  18.526  10.809
 1062   HD22  LEU 579          HD22      LEU 579  75.493  18.644  11.905
 1063   HD23  LEU 579          HD23      LEU 579  75.565  19.664  10.480
 1064    H    LYS 580           HN       LYS 580  73.226  16.787   5.296
 1065    HA   LYS 580           HA       LYS 580  72.147  19.545   5.115
 1066    HB2  LYS 580           HB2      LYS 580  72.632  19.471   2.880
 1067    HB3  LYS 580           HB1      LYS 580  73.731  18.226   3.447
 1068    HG2  LYS 580           HG2      LYS 580  70.964  17.669   2.295
 1069    HG3  LYS 580           HG1      LYS 580  72.467  17.574   1.397
 1070    HD2  LYS 580           HD2      LYS 580  73.207  15.679   2.514
 1071    HD3  LYS 580           HD1      LYS 580  72.252  16.013   3.955
 1072    HE2  LYS 580           HE2      LYS 580  71.395  14.088   2.575
 1073    HE3  LYS 580           HE1      LYS 580  70.216  15.371   2.836
 1074    HZ1  LYS 580           HZ1      LYS 580  71.932  15.544   0.475
 1075    HZ2  LYS 580           HZ2      LYS 580  70.322  16.046   0.684
 1076    HZ3  LYS 580           HZ3      LYS 580  70.680  14.401   0.456
 1077    H    GLN 581           HN       GLN 581  70.607  16.246   4.595
 1078    HA   GLN 581           HA       GLN 581  68.116  17.604   5.182
 1079    HB2  GLN 581           HB2      GLN 581  68.584  18.254   2.822
 1080    HB3  GLN 581           HB1      GLN 581  68.281  16.578   2.372
 1081    HG2  GLN 581           HG2      GLN 581  66.200  17.703   2.107
 1082    HG3  GLN 581           HG1      GLN 581  66.047  16.828   3.616
 1083   HE21  GLN 581          HE21      GLN 581  66.466  18.138   5.649
 1084   HE22  GLN 581          HE22      GLN 581  66.103  19.788   5.615
 1085    H    LEU 582           HN       LEU 582  66.454  16.453   5.723
 1086    HA   LEU 582           HA       LEU 582  66.269  13.583   5.087
 1087    HB2  LEU 582           HB2      LEU 582  67.364  13.978   7.354
 1088    HB3  LEU 582           HB1      LEU 582  65.814  14.606   7.886
 1089    HG   LEU 582           HG       LEU 582  64.770  12.442   7.267
 1090   HD11  LEU 582          HD11      LEU 582  66.811  10.602   7.099
 1091   HD12  LEU 582          HD12      LEU 582  67.483  11.947   6.174
 1092   HD13  LEU 582          HD13      LEU 582  65.936  11.248   5.713
 1093   HD21  LEU 582          HD21      LEU 582  66.981  12.659   9.286
 1094   HD22  LEU 582          HD22      LEU 582  66.176  11.104   9.072
 1095   HD23  LEU 582          HD23      LEU 582  65.244  12.530   9.532
 1096    H    ASN 583           HN       ASN 583  63.950  12.849   5.745
 1097    HA   ASN 583           HA       ASN 583  61.996  15.074   5.937
 1098    HB2  ASN 583           HB2      ASN 583  62.343  13.298   3.519
 1099    HB3  ASN 583           HB1      ASN 583  60.752  13.931   3.920
 1100   HD21  ASN 583          HD21      ASN 583  61.943  14.717   1.538
 1101   HD22  ASN 583          HD22      ASN 583  62.405  16.343   1.639
 1102    H    LYS 584           HN       LYS 584  60.195  14.414   7.066
 1103    HA   LYS 584           HA       LYS 584  60.173  11.997   8.504
 1104    HB2  LYS 584           HB2      LYS 584  57.743  12.492   8.855
 1105    HB3  LYS 584           HB1      LYS 584  58.797  13.867   9.175
 1106    HG2  LYS 584           HG2      LYS 584  57.956  15.098   7.418
 1107    HG3  LYS 584           HG1      LYS 584  57.877  13.703   6.343
 1108    HD2  LYS 584           HD2      LYS 584  55.624  14.462   6.752
 1109    HD3  LYS 584           HD1      LYS 584  55.850  12.936   7.597
 1110    HE2  LYS 584           HE2      LYS 584  54.791  14.278   9.215
 1111    HE3  LYS 584           HE1      LYS 584  56.493  14.428   9.643
 1112    HZ1  LYS 584           HZ1      LYS 584  55.611  16.594   9.610
 1113    HZ2  LYS 584           HZ2      LYS 584  54.826  16.346   8.123
 1114    HZ3  LYS 584           HZ3      LYS 584  56.520  16.448   8.186
 1115    H    GLY 585           HN       GLY 585  59.505  12.582   5.232
 1116    HA2  GLY 585           HA2      GLY 585  57.821  10.163   4.905
 1117    HA3  GLY 585           HA1      GLY 585  58.194  11.352   3.658
 1118    H    THR 586           HN       THR 586  61.044  11.174   4.792
 1119    HA   THR 586           HA       THR 586  61.859   8.562   3.605
 1120    HB   THR 586           HB       THR 586  63.394   9.541   2.128
 1121    HG1  THR 586           HG1      THR 586  63.237  11.650   3.946
 1122   HG21  THR 586          HG21      THR 586  60.995   9.994   1.519
 1123   HG22  THR 586          HG22      THR 586  62.131  11.158   0.835
 1124   HG23  THR 586          HG23      THR 586  61.164  11.591   2.247
 1125    H    PHE 587           HN       PHE 587  61.675   9.750   6.368
 1126    HA   PHE 587           HA       PHE 587  64.542   9.967   7.098
 1127    HB2  PHE 587           HB2      PHE 587  63.877  10.683   9.220
 1128    HB3  PHE 587           HB1      PHE 587  62.661  11.373   8.169
 1129    HD1  PHE 587           HD1      PHE 587  60.628   9.554   7.682
 1130    HD2  PHE 587           HD2      PHE 587  63.069   9.769  11.209
 1131    HE1  PHE 587           HE1      PHE 587  58.865   8.390   8.969
 1132    HE2  PHE 587           HE2      PHE 587  61.302   8.603  12.497
 1133    HZ   PHE 587           HZ       PHE 587  59.200   7.913  11.378
 1134    H    LYS 588           HN       LYS 588  65.585   8.128   7.138
 1135    HA   LYS 588           HA       LYS 588  64.296   5.658   8.175
 1136    HB2  LYS 588           HB2      LYS 588  65.964   6.201   5.968
 1137    HB3  LYS 588           HB1      LYS 588  67.025   5.445   7.111
 1138    HG2  LYS 588           HG2      LYS 588  65.948   3.849   5.503
 1139    HG3  LYS 588           HG1      LYS 588  65.717   3.448   7.192
 1140    HD2  LYS 588           HD2      LYS 588  63.707   3.280   5.510
 1141    HD3  LYS 588           HD1      LYS 588  63.433   3.902   7.117
 1142    HE2  LYS 588           HE2      LYS 588  63.139   6.097   6.346
 1143    HE3  LYS 588           HE1      LYS 588  64.108   5.819   4.916
 1144    HZ1  LYS 588           HZ1      LYS 588  61.663   5.969   4.545
 1145    HZ2  LYS 588           HZ2      LYS 588  61.513   4.493   5.373
 1146    HZ3  LYS 588           HZ3      LYS 588  62.401   4.573   3.926
 1147    H    GLU 589           HN       GLU 589  65.753   4.322   9.644
 1148    HA   GLU 589           HA       GLU 589  67.722   5.915  11.166
 1149    HB2  GLU 589           HB2      GLU 589  65.875   6.684  12.371
 1150    HB3  GLU 589           HB1      GLU 589  65.010   5.159  12.236
 1151    HG2  GLU 589           HG2      GLU 589  66.428   4.121  13.868
 1152    HG3  GLU 589           HG1      GLU 589  67.579   5.460  13.827
 1153    H    GLN 590           HN       GLN 590  68.855   4.716  12.688
 1154    HA   GLN 590           HA       GLN 590  68.519   1.837  12.913
 1155    HB2  GLN 590           HB2      GLN 590  69.900   2.444  10.716
 1156    HB3  GLN 590           HB1      GLN 590  71.204   2.726  11.859
 1157    HG2  GLN 590           HG2      GLN 590  71.550   0.462  11.508
 1158    HG3  GLN 590           HG1      GLN 590  70.371   0.345  12.809
 1159   HE21  GLN 590          HE21      GLN 590  71.033  -1.092   9.965
 1160   HE22  GLN 590          HE22      GLN 590  69.466  -1.427   9.405
 1161    H    ASN 591           HN       ASN 591  69.667   1.121  14.781
 1162    HA   ASN 591           HA       ASN 591  70.456   1.486  16.952
 1163    HB2  ASN 591           HB2      ASN 591  72.663   3.166  16.613
 1164    HB3  ASN 591           HB1      ASN 591  72.688   1.421  16.487
 1165   HD21  ASN 591          HD21      ASN 591  71.625   0.824  14.110
 1166   HD22  ASN 591          HD22      ASN 591  72.409   1.615  12.834
 1167    H    ASP 592           HN       ASP 592  68.500   3.491  15.798
 1168    HA   ASP 592           HA       ASP 592  67.318   5.252  16.830
 1169    HB2  ASP 592           HB2      ASP 592  69.681   5.919  18.568
 1170    HB3  ASP 592           HB1      ASP 592  67.965   6.150  18.889
 1171    H    LYS 593           HN       LYS 593  70.248   5.423  15.224
 1172    HA   LYS 593           HA       LYS 593  70.475   8.338  15.222
 1173    HB2  LYS 593           HB2      LYS 593  71.887   6.257  13.569
 1174    HB3  LYS 593           HB1      LYS 593  72.346   7.944  13.739
 1175    HG2  LYS 593           HG2      LYS 593  72.308   7.277  16.352
 1176    HG3  LYS 593           HG1      LYS 593  72.656   5.686  15.677
 1177    HD2  LYS 593           HD2      LYS 593  74.561   6.672  14.405
 1178    HD3  LYS 593           HD1      LYS 593  74.236   8.226  15.172
 1179    HE2  LYS 593           HE2      LYS 593  74.424   6.792  17.409
 1180    HE3  LYS 593           HE1      LYS 593  75.363   5.713  16.372
 1181    HZ1  LYS 593           HZ1      LYS 593  76.292   7.946  17.620
 1182    HZ2  LYS 593           HZ2      LYS 593  76.061   8.465  16.018
 1183    HZ3  LYS 593           HZ3      LYS 593  77.057   7.128  16.346
 1184    HA   PRO 594           HA       PRO 594  67.368   8.451  11.835
 1185    HB2  PRO 594           HB2      PRO 594  68.598  11.129  11.403
 1186    HB3  PRO 594           HB1      PRO 594  66.898  10.699  11.601
 1187    HG2  PRO 594           HG2      PRO 594  68.356  11.933  13.547
 1188    HG3  PRO 594           HG1      PRO 594  67.007  10.844  13.906
 1189    HD2  PRO 594           HD2      PRO 594  69.924  10.384  14.264
 1190    HD3  PRO 594           HD1      PRO 594  68.549   9.574  15.057
 1191    H    TYR 595           HN       TYR 595  67.549   8.705   9.428
 1192    HA   TYR 595           HA       TYR 595  70.151   9.021   8.180
 1193    HB2  TYR 595           HB2      TYR 595  69.052   6.258   8.658
 1194    HB3  TYR 595           HB1      TYR 595  70.088   6.573   7.278
 1195    HD1  TYR 595           HD1      TYR 595  72.266   8.161   8.097
 1196    HD2  TYR 595           HD2      TYR 595  70.158   5.210  10.411
 1197    HE1  TYR 595           HE1      TYR 595  74.284   7.792   9.489
 1198    HE2  TYR 595           HE2      TYR 595  72.180   4.852  11.789
 1199    HH   TYR 595           HH       TYR 595  75.228   6.518  11.053
 1200    H    CYS 596           HN       CYS 596  69.848   9.334   5.927
 1201    HA   CYS 596           HA       CYS 596  67.103   9.373   4.912
 1202    HB2  CYS 596           HB2      CYS 596  69.529   9.279   3.105
 1203    HB3  CYS 596           HB1      CYS 596  67.997  10.098   2.846
 1204    H    GLN 597           HN       GLN 597  66.326   7.767   3.266
 1205    HA   GLN 597           HA       GLN 597  67.097   5.116   3.969
 1206    HB2  GLN 597           HB2      GLN 597  64.997   5.162   2.948
 1207    HB3  GLN 597           HB1      GLN 597  65.485   6.360   1.784
 1208    HG2  GLN 597           HG2      GLN 597  65.323   4.489   0.409
 1209    HG3  GLN 597           HG1      GLN 597  67.008   4.383   0.874
 1210   HE21  GLN 597          HE21      GLN 597  66.335   3.589   3.659
 1211   HE22  GLN 597          HE22      GLN 597  65.833   1.989   3.572
 1212    H    ASN 598           HN       ASN 598  67.830   7.023   1.051
 1213    HA   ASN 598           HA       ASN 598  69.711   5.374  -0.155
 1214    HB2  ASN 598           HB2      ASN 598  70.337   8.305   0.029
 1215    HB3  ASN 598           HB1      ASN 598  70.366   7.244  -1.373
 1216   HD21  ASN 598          HD21      ASN 598  67.927   6.183  -1.562
 1217   HD22  ASN 598          HD22      ASN 598  66.721   7.366  -1.654
 1218    H    CYS 599           HN       CYS 599  70.048   7.286   2.761
 1219    HA   CYS 599           HA       CYS 599  72.942   6.861   2.926
 1220    HB2  CYS 599           HB2      CYS 599  70.849   8.133   4.677
 1221    HB3  CYS 599           HB1      CYS 599  72.403   7.698   5.381
 1222    H    PHE 600           HN       PHE 600  70.213   5.907   5.023
 1223    HA   PHE 600           HA       PHE 600  71.488   3.942   6.550
 1224    HB2  PHE 600           HB2      PHE 600  69.374   4.368   7.367
 1225    HB3  PHE 600           HB1      PHE 600  68.698   4.596   5.763
 1226    HD1  PHE 600           HD1      PHE 600  69.348   2.215   8.461
 1227    HD2  PHE 600           HD2      PHE 600  67.965   2.642   4.427
 1228    HE1  PHE 600           HE1      PHE 600  68.345  -0.051   8.566
 1229    HE2  PHE 600           HE2      PHE 600  66.967   0.376   4.523
 1230    HZ   PHE 600           HZ       PHE 600  67.157  -0.972   6.595
 1231    H    LEU 601           HN       LEU 601  69.580   3.388   3.583
 1232    HA   LEU 601           HA       LEU 601  69.989   0.637   3.412
 1233    HB2  LEU 601           HB2      LEU 601  68.773   0.890   1.508
 1234    HB3  LEU 601           HB1      LEU 601  68.785   2.610   1.863
 1235    HG   LEU 601           HG       LEU 601  70.919   2.781   0.508
 1236   HD11  LEU 601          HD11      LEU 601  70.616   0.489  -1.161
 1237   HD12  LEU 601          HD12      LEU 601  70.634  -0.115   0.493
 1238   HD13  LEU 601          HD13      LEU 601  71.966   0.869  -0.098
 1239   HD21  LEU 601          HD21      LEU 601  69.733   2.768  -1.622
 1240   HD22  LEU 601          HD22      LEU 601  68.642   3.332  -0.361
 1241   HD23  LEU 601          HD23      LEU 601  68.506   1.685  -0.966
 1242    H    LYS 602           HN       LYS 602  72.106   3.225   2.228
 1243    HA   LYS 602           HA       LYS 602  73.961   1.516   0.924
 1244    HB2  LYS 602           HB2      LYS 602  73.792   4.220   1.207
 1245    HB3  LYS 602           HB1      LYS 602  75.120   3.907   2.297
 1246    HG2  LYS 602           HG2      LYS 602  74.956   3.163  -0.625
 1247    HG3  LYS 602           HG1      LYS 602  75.991   4.383   0.087
 1248    HD2  LYS 602           HD2      LYS 602  77.016   2.500   1.460
 1249    HD3  LYS 602           HD1      LYS 602  76.159   1.382   0.411
 1250    HE2  LYS 602           HE2      LYS 602  77.288   2.260  -1.542
 1251    HE3  LYS 602           HE1      LYS 602  78.041   3.531  -0.578
 1252    HZ1  LYS 602           HZ1      LYS 602  78.676   0.686  -0.727
 1253    HZ2  LYS 602           HZ2      LYS 602  78.847   1.439   0.786
 1254    HZ3  LYS 602           HZ3      LYS 602  79.710   2.019  -0.558
 1255    H    LEU 603           HN       LEU 603  73.483   2.100   4.342
 1256    HA   LEU 603           HA       LEU 603  76.160   1.043   5.011
 1257    HB2  LEU 603           HB2      LEU 603  74.234   1.487   7.221
 1258    HB3  LEU 603           HB1      LEU 603  75.913   1.994   7.072
 1259    HG   LEU 603           HG       LEU 603  73.544   3.271   5.690
 1260   HD11  LEU 603          HD11      LEU 603  73.750   5.047   7.231
 1261   HD12  LEU 603          HD12      LEU 603  75.329   4.490   7.786
 1262   HD13  LEU 603          HD13      LEU 603  73.874   3.592   8.215
 1263   HD21  LEU 603          HD21      LEU 603  76.390   4.302   5.825
 1264   HD22  LEU 603          HD22      LEU 603  75.069   4.914   4.834
 1265   HD23  LEU 603          HD23      LEU 603  75.803   3.366   4.459
 1266    H    PHE 604           HN       PHE 604  72.813   0.111   5.917
 1267    HA   PHE 604           HA       PHE 604  73.861  -2.613   6.563
 1268    HB2  PHE 604           HB2      PHE 604  71.046  -1.832   7.216
 1269    HB3  PHE 604           HB1      PHE 604  72.205  -2.766   8.164
 1270    HD1  PHE 604           HD1      PHE 604  73.878  -1.637   9.579
 1271    HD2  PHE 604           HD2      PHE 604  71.076   0.600   7.223
 1272    HE1  PHE 604           HE1      PHE 604  74.446   0.409  10.853
 1273    HE2  PHE 604           HE2      PHE 604  71.642   2.651   8.500
 1274    HZ   PHE 604           HZ       PHE 604  73.325   2.554  10.313
 1275    H    CYS 605           HN       CYS 605  72.611  -1.199   3.877
 1276    HA   CYS 605           HA       CYS 605  71.551  -3.800   2.935
 1277    HB2  CYS 605           HB2      CYS 605  69.864  -1.391   2.306
 1278    HB3  CYS 605           HB1      CYS 605  69.403  -3.090   2.385
 1279    HG   CYS 605           HG       CYS 605  70.145  -1.664   5.050
  Start of MODEL   12
    1    H    MET   1           HT1      MET   1  92.376 -32.759  11.426
    2    HA   MET   1           HA       MET   1  90.652 -31.419  11.800
    3    HB2  MET   1           HB2      MET   1  92.112 -30.523  13.781
    4    HB3  MET   1           HB1      MET   1  92.410 -29.143  12.725
    5    HG2  MET   1           HG2      MET   1  89.905 -28.920  12.460
    6    HG3  MET   1           HG1      MET   1  89.728 -30.147  13.715
    7    HE1  MET   1           HE1      MET   1  89.508 -29.665  16.059
    8    HE2  MET   1           HE2      MET   1  90.617 -28.621  16.944
    9    HE3  MET   1           HE3      MET   1  91.253 -29.947  15.974
   10    H    ALA   2           HN       ALA   2  91.323 -28.322  11.460
   11    HA   ALA   2           HA       ALA   2  92.161 -28.191   8.665
   12    HB1  ALA   2           HB1      ALA   2  89.937 -28.890   8.168
   13    HB2  ALA   2           HB2      ALA   2  89.921 -27.136   7.979
   14    HB3  ALA   2           HB3      ALA   2  89.256 -27.873   9.436
   15    H    LEU   3           HN       LEU   3  90.445 -26.580  11.316
   16    HA   LEU   3           HA       LEU   3  90.942 -23.890  10.605
   17    HB2  LEU   3           HB2      LEU   3  90.831 -25.199  13.314
   18    HB3  LEU   3           HB1      LEU   3  90.709 -23.467  13.015
   19    HG   LEU   3           HG       LEU   3  88.756 -24.052  11.420
   20   HD11  LEU   3          HD11      LEU   3  88.694 -26.341  11.110
   21   HD12  LEU   3          HD12      LEU   3  87.569 -26.208  12.455
   22   HD13  LEU   3          HD13      LEU   3  89.234 -26.701  12.748
   23   HD21  LEU   3          HD21      LEU   3  88.494 -24.502  14.392
   24   HD22  LEU   3          HD22      LEU   3  87.175 -24.071  13.304
   25   HD23  LEU   3          HD23      LEU   3  88.501 -22.941  13.576
   26    H    ASP   4           HN       ASP   4  92.586 -25.734  13.119
   27    HA   ASP   4           HA       ASP   4  94.883 -23.990  13.066
   28    HB2  ASP   4           HB2      ASP   4  94.196 -25.138  15.130
   29    HB3  ASP   4           HB1      ASP   4  94.474 -26.698  14.351
   30    H    GLY   5           HN       GLY   5  94.010 -25.697  10.666
   31    HA2  GLY   5           HA2      GLY   5  95.980 -27.687  10.129
   32    HA3  GLY   5           HA1      GLY   5  95.102 -26.774   8.896
   33    H    ILE   6           HN       ILE   6  96.116 -24.343  10.398
   34    HA   ILE   6           HA       ILE   6  98.723 -24.150   8.958
   35    HB   ILE   6           HB       ILE   6  97.933 -21.551   9.646
   36   HG12  ILE   6          HG12      ILE   6  95.718 -22.610  10.362
   37   HG13  ILE   6          HG11      ILE   6  95.619 -21.291   9.201
   38   HG21  ILE   6          HG21      ILE   6  97.504 -23.158   7.138
   39   HG22  ILE   6          HG22      ILE   6  98.830 -22.051   7.506
   40   HG23  ILE   6          HG23      ILE   6  97.206 -21.421   7.234
   41   HD11  ILE   6          HD11      ILE   6  94.741 -22.631   7.595
   42   HD12  ILE   6          HD12      ILE   6  94.426 -23.764   8.905
   43   HD13  ILE   6          HD13      ILE   6  95.873 -23.944   7.920
   44    H    ARG   7           HN       ARG   7  97.880 -21.796  11.398
   45    HA   ARG   7           HA       ARG   7  99.465 -23.147  13.469
   46    HB2  ARG   7           HB2      ARG   7 100.973 -21.100  13.640
   47    HB3  ARG   7           HB1      ARG   7 101.265 -22.180  12.284
   48    HG2  ARG   7           HG2      ARG   7  99.320 -19.996  11.720
   49    HG3  ARG   7           HG1      ARG   7 100.968 -19.464  12.032
   50    HD2  ARG   7           HD2      ARG   7 101.833 -20.826  10.251
   51    HD3  ARG   7           HD1      ARG   7 100.283 -21.635  10.045
   52    HE   ARG   7           HE       ARG   7  99.825 -18.873   9.660
   53   HH11  ARG   7          HH11      ARG   7  99.753 -18.032   7.563
   54   HH12  ARG   7          HH12      ARG   7 100.508 -18.902   6.270
   55   HH21  ARG   7          HH21      ARG   7 101.604 -21.492   8.300
   56   HH22  ARG   7          HH22      ARG   7 101.557 -20.863   6.687
   57    H    MET   8           HN       MET   8  99.342 -19.671  13.467
   58    HA   MET   8           HA       MET   8  96.820 -19.661  15.015
   59    HB2  MET   8           HB2      MET   8  98.630 -18.132  16.618
   60    HB3  MET   8           HB1      MET   8  97.811 -19.621  17.041
   61    HG2  MET   8           HG2      MET   8  99.595 -20.975  16.178
   62    HG3  MET   8           HG1      MET   8 100.414 -19.599  15.471
   63    HE1  MET   8           HE1      MET   8 102.352 -20.913  16.682
   64    HE2  MET   8           HE2      MET   8 103.038 -20.047  18.055
   65    HE3  MET   8           HE3      MET   8 102.651 -19.172  16.576
   66    HA   PRO   9           HA       PRO   9  98.115 -14.932  14.182
   67    HB2  PRO   9           HB2      PRO   9  99.950 -15.724  11.923
   68    HB3  PRO   9           HB1      PRO   9  99.956 -14.236  12.897
   69    HG2  PRO   9           HG2      PRO   9 101.686 -16.148  13.413
   70    HG3  PRO   9           HG1      PRO   9 100.857 -15.304  14.735
   71    HD2  PRO   9           HD2      PRO   9 100.403 -18.074  13.723
   72    HD3  PRO   9           HD1      PRO   9 100.217 -17.416  15.343
   73    H    ASP  10           HN       ASP  10  98.090 -17.540  11.894
   74    HA   ASP  10           HA       ASP  10  95.903 -16.219  10.307
   75    HB2  ASP  10           HB2      ASP  10  98.161 -16.746   9.157
   76    HB3  ASP  10           HB1      ASP  10  97.688 -18.438   9.294
   77    H    GLY  11           HN       GLY  11  96.989 -19.016  12.040
   78    HA2  GLY  11           HA2      GLY  11  94.723 -20.684  11.231
   79    HA3  GLY  11           HA1      GLY  11  95.925 -21.086  12.452
   80    H    CYS  12           HN       CYS  12  94.836 -17.998  13.026
   81    HA   CYS  12           HA       CYS  12  92.341 -18.532  14.359
   82    HB2  CYS  12           HB2      CYS  12  93.622 -19.782  15.944
   83    HB3  CYS  12           HB1      CYS  12  94.879 -18.546  15.992
   84    HG   CYS  12           HG       CYS  12  93.409 -18.093  18.071
   85    H    TYR  13           HN       TYR  13  95.284 -16.554  14.841
   86    HA   TYR  13           HA       TYR  13  95.556 -14.226  14.681
   87    HB2  TYR  13           HB2      TYR  13  93.485 -14.563  12.969
   88    HB3  TYR  13           HB1      TYR  13  92.613 -13.728  14.255
   89    HD1  TYR  13           HD1      TYR  13  93.966 -11.626  15.268
   90    HD2  TYR  13           HD2      TYR  13  94.471 -13.232  11.314
   91    HE1  TYR  13           HE1      TYR  13  94.887  -9.455  14.501
   92    HE2  TYR  13           HE2      TYR  13  95.392 -11.061  10.551
   93    HH   TYR  13           HH       TYR  13  96.639  -9.039  11.842
   94    H    ALA  14           HN       ALA  14  92.590 -15.406  16.161
   95    HA   ALA  14           HA       ALA  14  92.967 -15.177  18.805
   96    HB1  ALA  14           HB1      ALA  14  92.033 -12.726  19.237
   97    HB2  ALA  14           HB2      ALA  14  92.740 -12.409  17.652
   98    HB3  ALA  14           HB3      ALA  14  93.758 -12.978  18.974
   99    H    ASP  15           HN       ASP  15  90.989 -14.299  16.133
  100    HA   ASP  15           HA       ASP  15  88.766 -15.828  17.037
  101    HB2  ASP  15           HB2      ASP  15  88.436 -13.946  18.589
  102    HB3  ASP  15           HB1      ASP  15  88.435 -12.821  17.237
  103    H    GLY  16           HN       GLY  16  90.254 -13.549  14.890
  104    HA2  GLY  16           HA2      GLY  16  90.071 -14.020  12.459
  105    HA3  GLY  16           HA1      GLY  16  88.356 -14.332  12.706
  106    H    THR  17           HN       THR  17  89.569 -11.731  14.553
  107    HA   THR  17           HA       THR  17  88.126  -9.831  12.760
  108    HB   THR  17           HB       THR  17  87.340  -9.526  14.970
  109    HG1  THR  17           HG1      THR  17  89.503  -7.747  14.687
  110   HG21  THR  17          HG21      THR  17  90.216  -9.590  15.897
  111   HG22  THR  17          HG22      THR  17  89.074 -10.919  16.073
  112   HG23  THR  17          HG23      THR  17  88.797  -9.404  16.924
  113    H    TRP  18           HN       TRP  18  89.227  -8.488  11.551
  114    HA   TRP  18           HA       TRP  18  92.021  -7.735  12.294
  115    HB2  TRP  18           HB2      TRP  18  92.308  -7.587   9.705
  116    HB3  TRP  18           HB1      TRP  18  92.462  -9.146  10.486
  117    HD1  TRP  18           HD1      TRP  18  89.903 -10.546  10.536
  118    HE1  TRP  18           HE1      TRP  18  88.330 -10.817   8.477
  119    HE3  TRP  18           HE3      TRP  18  91.502  -6.694   7.637
  120    HZ2  TRP  18           HZ2      TRP  18  87.870  -9.604   5.986
  121    HZ3  TRP  18           HZ3      TRP  18  90.493  -6.302   5.436
  122    HH2  TRP  18           HH2      TRP  18  88.664  -7.722   4.598
  123    H    GLU  19           HN       GLU  19  92.175  -5.572  12.521
  124    HA   GLU  19           HA       GLU  19  89.945  -3.877  11.734
  125    HB2  GLU  19           HB2      GLU  19  91.996  -2.115  12.457
  126    HB3  GLU  19           HB1      GLU  19  90.764  -2.746  13.539
  127    HG2  GLU  19           HG2      GLU  19  93.067  -3.088  14.396
  128    HG3  GLU  19           HG1      GLU  19  92.186  -4.595  14.158
  129    H    LEU  20           HN       LEU  20  89.805  -2.496  10.015
  130    HA   LEU  20           HA       LEU  20  91.785  -2.878   7.888
  131    HB2  LEU  20           HB2      LEU  20  89.051  -2.453   7.880
  132    HB3  LEU  20           HB1      LEU  20  89.640  -0.849   7.485
  133    HG   LEU  20           HG       LEU  20  89.371  -1.852   5.384
  134   HD11  LEU  20          HD11      LEU  20  92.222  -2.740   5.778
  135   HD12  LEU  20          HD12      LEU  20  91.807  -1.026   5.861
  136   HD13  LEU  20          HD13      LEU  20  91.469  -1.960   4.403
  137   HD21  LEU  20          HD21      LEU  20  90.544  -4.348   6.610
  138   HD22  LEU  20          HD22      LEU  20  90.183  -4.149   4.898
  139   HD23  LEU  20          HD23      LEU  20  88.877  -4.098   6.079
  140    H    SER  21           HN       SER  21  93.431  -1.415   7.492
  141    HA   SER  21           HA       SER  21  93.665   0.894   9.279
  142    HB2  SER  21           HB2      SER  21  95.511  -0.667   8.016
  143    HB3  SER  21           HB1      SER  21  95.439   0.696   6.900
  144    HG   SER  21           HG       SER  21  95.553   1.933   9.044
  145    H    VAL  22           HN       VAL  22  93.414   3.028   8.706
  146    HA   VAL  22           HA       VAL  22  92.533   3.602   5.928
  147    HB   VAL  22           HB       VAL  22  91.014   4.245   8.459
  148   HG11  VAL  22          HG11      VAL  22  90.948   5.669   5.786
  149   HG12  VAL  22          HG12      VAL  22  91.125   6.383   7.390
  150   HG13  VAL  22          HG13      VAL  22  89.585   5.690   6.900
  151   HG21  VAL  22          HG21      VAL  22  90.419   2.198   7.240
  152   HG22  VAL  22          HG22      VAL  22  90.254   3.131   5.742
  153   HG23  VAL  22          HG23      VAL  22  89.134   3.402   7.081
  154    H    HIS  23           HN       HIS  23  92.845   5.756   5.286
  155    HA   HIS  23           HA       HIS  23  94.655   7.386   7.031
  156    HB2  HIS  23           HB2      HIS  23  94.763   6.693   4.091
  157    HB3  HIS  23           HB1      HIS  23  95.481   8.190   4.674
  158    HD1  HIS  23           HD1      HIS  23  95.602   4.486   5.611
  159    HD2  HIS  23           HD2      HIS  23  98.084   7.834   5.508
  160    HE1  HIS  23           HE1      HIS  23  97.900   3.696   6.322
  161    H    VAL  24           HN       VAL  24  93.117   8.894   7.744
  162    HA   VAL  24           HA       VAL  24  91.016   9.816   5.978
  163    HB   VAL  24           HB       VAL  24  91.928  11.499   8.306
  164   HG11  VAL  24          HG11      VAL  24  89.876  11.993   6.917
  165   HG12  VAL  24          HG12      VAL  24  89.537  11.754   8.633
  166   HG13  VAL  24          HG13      VAL  24  89.200  10.466   7.480
  167   HG21  VAL  24          HG21      VAL  24  92.219   9.314   9.255
  168   HG22  VAL  24          HG22      VAL  24  90.752   8.713   8.482
  169   HG23  VAL  24          HG23      VAL  24  90.641   9.882   9.798
  170    H    THR  25           HN       THR  25  91.750  10.737   4.107
  171    HA   THR  25           HA       THR  25  94.132  12.394   4.036
  172    HB   THR  25           HB       THR  25  93.454  12.782   1.668
  173    HG1  THR  25           HG1      THR  25  91.225  12.759   1.977
  174   HG21  THR  25          HG21      THR  25  93.450   9.980   2.786
  175   HG22  THR  25          HG22      THR  25  94.773  10.840   1.998
  176   HG23  THR  25          HG23      THR  25  93.393  10.283   1.049
  177    H    ASP  26           HN       ASP  26  90.649  12.998   4.145
  178    HA   ASP  26           HA       ASP  26  90.940  15.874   3.750
  179    HB2  ASP  26           HB2      ASP  26  88.833  14.560   3.250
  180    HB3  ASP  26           HB1      ASP  26  88.607  14.384   4.991
  181    H    LEU  27           HN       LEU  27  92.349  14.275   5.970
  182    HA   LEU  27           HA       LEU  27  91.995  16.314   8.055
  183    HB2  LEU  27           HB2      LEU  27  90.857  13.620   8.228
  184    HB3  LEU  27           HB1      LEU  27  91.919  13.950   9.582
  185    HG   LEU  27           HG       LEU  27  89.788  15.923   8.737
  186   HD11  LEU  27          HD11      LEU  27  89.541  13.563  10.623
  187   HD12  LEU  27          HD12      LEU  27  88.612  13.843   9.151
  188   HD13  LEU  27          HD13      LEU  27  88.383  14.893  10.550
  189   HD21  LEU  27          HD21      LEU  27  90.111  16.841  10.904
  190   HD22  LEU  27          HD22      LEU  27  91.742  16.463  10.353
  191   HD23  LEU  27          HD23      LEU  27  90.927  15.393  11.490
  192    H    ASN  28           HN       ASN  28  93.655  13.546   6.719
  193    HA   ASN  28           HA       ASN  28  95.972  13.148   6.620
  194    HB2  ASN  28           HB2      ASN  28  96.173  15.686   7.193
  195    HB3  ASN  28           HB1      ASN  28  96.495  15.136   8.832
  196   HD21  ASN  28          HD21      ASN  28  97.702  12.603   7.636
  197   HD22  ASN  28          HD22      ASN  28  99.263  13.066   7.171
  198    H    ARG  29           HN       ARG  29  93.849  12.311   8.844
  199    HA   ARG  29           HA       ARG  29  95.753  11.349  10.888
  200    HB2  ARG  29           HB2      ARG  29  92.750  11.114  10.661
  201    HB3  ARG  29           HB1      ARG  29  93.712  10.546  12.026
  202    HG2  ARG  29           HG2      ARG  29  94.483  12.812  12.474
  203    HG3  ARG  29           HG1      ARG  29  93.630  13.410  11.059
  204    HD2  ARG  29           HD2      ARG  29  92.130  13.884  12.811
  205    HD3  ARG  29           HD1      ARG  29  91.520  12.359  12.162
  206    HE   ARG  29           HE       ARG  29  92.086  11.347  14.210
  207   HH11  ARG  29          HH11      ARG  29  93.036  11.313  16.259
  208   HH12  ARG  29          HH12      ARG  29  94.089  12.604  16.733
  209   HH21  ARG  29          HH21      ARG  29  93.777  14.313  13.732
  210   HH22  ARG  29          HH22      ARG  29  94.509  14.303  15.301
  211    H    ASP  30           HN       ASP  30  94.973   9.043  11.632
  212    HA   ASP  30           HA       ASP  30  94.538   7.248   9.325
  213    HB2  ASP  30           HB2      ASP  30  96.855   7.134  11.263
  214    HB3  ASP  30           HB1      ASP  30  96.302   5.703  10.389
  215    H    VAL  31           HN       VAL  31  92.860   5.986   9.852
  216    HA   VAL  31           HA       VAL  31  92.377   5.392  12.762
  217    HB   VAL  31           HB       VAL  31  90.279   5.508  10.587
  218   HG11  VAL  31          HG11      VAL  31  89.725   4.258  12.638
  219   HG12  VAL  31          HG12      VAL  31  88.783   5.747  12.546
  220   HG13  VAL  31          HG13      VAL  31  90.181   5.651  13.617
  221   HG21  VAL  31          HG21      VAL  31  89.748   7.781  11.459
  222   HG22  VAL  31          HG22      VAL  31  91.369   7.728  10.770
  223   HG23  VAL  31          HG23      VAL  31  91.155   7.699  12.519
  224    H    THR  32           HN       THR  32  91.489   3.366  13.257
  225    HA   THR  32           HA       THR  32  91.660   1.270  11.135
  226    HB   THR  32           HB       THR  32  92.370   0.093  13.658
  227    HG1  THR  32           HG1      THR  32  93.709   1.439  14.540
  228   HG21  THR  32          HG21      THR  32  94.348   0.794  11.493
  229   HG22  THR  32          HG22      THR  32  93.137  -0.467  11.257
  230   HG23  THR  32          HG23      THR  32  94.327  -0.620  12.547
  231    H    LEU  33           HN       LEU  33  89.825   0.075  11.100
  232    HA   LEU  33           HA       LEU  33  87.918   0.268  13.401
  233    HB2  LEU  33           HB2      LEU  33  87.621   0.314  10.426
  234    HB3  LEU  33           HB1      LEU  33  86.322  -0.404  11.355
  235    HG   LEU  33           HG       LEU  33  86.106   2.094  10.816
  236   HD11  LEU  33          HD11      LEU  33  84.958   0.769  12.737
  237   HD12  LEU  33          HD12      LEU  33  84.941   2.529  12.794
  238   HD13  LEU  33          HD13      LEU  33  86.081   1.628  13.790
  239   HD21  LEU  33          HD21      LEU  33  87.401   3.676  12.022
  240   HD22  LEU  33          HD22      LEU  33  88.578   2.509  11.427
  241   HD23  LEU  33          HD23      LEU  33  88.044   2.464  13.102
  242    H    ARG  34           HN       ARG  34  87.880  -1.554  14.508
  243    HA   ARG  34           HA       ARG  34  88.873  -4.086  13.723
  244    HB2  ARG  34           HB2      ARG  34  88.381  -3.294  16.088
  245    HB3  ARG  34           HB1      ARG  34  86.680  -3.576  15.742
  246    HG2  ARG  34           HG2      ARG  34  87.379  -5.588  16.768
  247    HG3  ARG  34           HG1      ARG  34  87.384  -5.955  15.047
  248    HD2  ARG  34           HD2      ARG  34  89.725  -5.915  14.913
  249    HD3  ARG  34           HD1      ARG  34  89.888  -4.959  16.369
  250    HE   ARG  34           HE       ARG  34  88.710  -7.527  16.947
  251   HH11  ARG  34          HH11      ARG  34  90.019  -8.943  18.141
  252   HH12  ARG  34          HH12      ARG  34  91.725  -8.660  18.221
  253   HH21  ARG  34          HH21      ARG  34  91.613  -5.802  16.263
  254   HH22  ARG  34          HH22      ARG  34  92.627  -6.882  17.159
  255    H    VAL  35           HN       VAL  35  88.063  -5.196  12.030
  256    HA   VAL  35           HA       VAL  35  85.112  -5.619  11.887
  257    HB   VAL  35           HB       VAL  35  85.291  -5.379   9.391
  258   HG11  VAL  35          HG11      VAL  35  85.958  -2.954  11.091
  259   HG12  VAL  35          HG12      VAL  35  84.341  -3.584  10.770
  260   HG13  VAL  35          HG13      VAL  35  85.292  -2.887   9.458
  261   HG21  VAL  35          HG21      VAL  35  87.229  -4.053   8.551
  262   HG22  VAL  35          HG22      VAL  35  87.706  -5.638   9.160
  263   HG23  VAL  35          HG23      VAL  35  87.982  -4.199  10.137
  264    H    THR  36           HN       THR  36  84.919  -7.153   9.742
  265    HA   THR  36           HA       THR  36  86.940  -9.316   9.850
  266    HB   THR  36           HB       THR  36  84.938 -10.940   9.975
  267    HG1  THR  36           HG1      THR  36  83.727  -8.661  11.136
  268   HG21  THR  36          HG21      THR  36  84.698 -10.542  12.532
  269   HG22  THR  36          HG22      THR  36  85.902  -9.282  12.291
  270   HG23  THR  36          HG23      THR  36  86.282 -10.955  11.889
  271    H    GLY  37           HN       GLY  37  86.122 -10.992   8.062
  272    HA2  GLY  37           HA2      GLY  37  85.638  -9.410   5.651
  273    HA3  GLY  37           HA1      GLY  37  85.980 -11.141   5.717
  274    H    GLU  38           HN       GLU  38  83.520  -9.236   7.375
  275    HA   GLU  38           HA       GLU  38  81.397 -10.454   5.704
  276    HB2  GLU  38           HB2      GLU  38  80.103 -11.052   7.789
  277    HB3  GLU  38           HB1      GLU  38  81.517 -12.061   7.488
  278    HG2  GLU  38           HG2      GLU  38  82.760 -11.069   9.199
  279    HG3  GLU  38           HG1      GLU  38  81.775  -9.605   9.210
  280    H    VAL  39           HN       VAL  39  82.733  -7.763   7.080
  281    HA   VAL  39           HA       VAL  39  80.187  -6.473   7.776
  282    HB   VAL  39           HB       VAL  39  81.416  -4.726   8.683
  283   HG11  VAL  39          HG11      VAL  39  83.094  -5.749  10.034
  284   HG12  VAL  39          HG12      VAL  39  83.408  -6.982   8.810
  285   HG13  VAL  39          HG13      VAL  39  81.886  -6.988   9.698
  286   HG21  VAL  39          HG21      VAL  39  82.709  -4.031   6.733
  287   HG22  VAL  39          HG22      VAL  39  83.686  -5.499   6.814
  288   HG23  VAL  39          HG23      VAL  39  83.816  -4.275   8.074
  289    H    HIS  40           HN       HIS  40  79.085  -5.122   6.424
  290    HA   HIS  40           HA       HIS  40  79.900  -5.028   3.630
  291    HB2  HIS  40           HB2      HIS  40  77.778  -3.231   4.798
  292    HB3  HIS  40           HB1      HIS  40  77.830  -4.011   3.216
  293    HD1  HIS  40           HD1      HIS  40  77.923  -6.835   3.519
  294    HD2  HIS  40           HD2      HIS  40  76.048  -4.564   6.470
  295    HE1  HIS  40           HE1      HIS  40  76.402  -8.418   4.783
  296    H    ILE  41           HN       ILE  41  80.676  -3.154   2.501
  297    HA   ILE  41           HA       ILE  41  82.555  -1.515   3.770
  298    HB   ILE  41           HB       ILE  41  80.803  -0.764   1.414
  299   HG12  ILE  41          HG12      ILE  41  83.589  -1.961   1.370
  300   HG13  ILE  41          HG11      ILE  41  82.121  -2.941   1.267
  301   HG21  ILE  41          HG21      ILE  41  82.895   0.595   0.826
  302   HG22  ILE  41          HG22      ILE  41  83.393   0.343   2.502
  303   HG23  ILE  41          HG23      ILE  41  81.900   1.211   2.148
  304   HD11  ILE  41          HD11      ILE  41  81.519  -2.078  -0.801
  305   HD12  ILE  41          HD12      ILE  41  83.278  -2.075  -0.941
  306   HD13  ILE  41          HD13      ILE  41  82.418  -0.582  -0.566
  307    H    GLY  42           HN       GLY  42  79.187  -0.695   2.997
  308    HA2  GLY  42           HA2      GLY  42  79.124   1.852   4.225
  309    HA3  GLY  42           HA1      GLY  42  77.713   0.826   4.003
  310    H    GLY  43           HN       GLY  43  79.562  -1.188   5.555
  311    HA2  GLY  43           HA2      GLY  43  78.294  -0.724   8.137
  312    HA3  GLY  43           HA1      GLY  43  79.451  -2.007   7.759
  313    H    VAL  44           HN       VAL  44  81.317  -0.021   6.606
  314    HA   VAL  44           HA       VAL  44  82.684   0.721   9.107
  315    HB   VAL  44           HB       VAL  44  83.380   0.522   6.191
  316   HG11  VAL  44          HG11      VAL  44  84.141   2.772   6.526
  317   HG12  VAL  44          HG12      VAL  44  85.568   1.754   6.721
  318   HG13  VAL  44          HG13      VAL  44  84.742   2.398   8.141
  319   HG21  VAL  44          HG21      VAL  44  85.236  -0.729   7.019
  320   HG22  VAL  44          HG22      VAL  44  83.858  -1.207   8.011
  321   HG23  VAL  44          HG23      VAL  44  85.051  -0.068   8.645
  322    H    MET  45           HN       MET  45  81.238   2.315   6.263
  323    HA   MET  45           HA       MET  45  81.801   5.003   6.753
  324    HB2  MET  45           HB2      MET  45  79.248   3.644   5.857
  325    HB3  MET  45           HB1      MET  45  79.367   5.395   5.943
  326    HG2  MET  45           HG2      MET  45  81.555   5.003   4.485
  327    HG3  MET  45           HG1      MET  45  80.750   3.493   4.074
  328    HE1  MET  45           HE1      MET  45  77.895   3.834   4.021
  329    HE2  MET  45           HE2      MET  45  78.619   3.309   2.500
  330    HE3  MET  45           HE3      MET  45  77.408   4.589   2.502
  331    H    LEU  46           HN       LEU  46  79.543   2.878   8.390
  332    HA   LEU  46           HA       LEU  46  78.344   4.907  10.066
  333    HB2  LEU  46           HB2      LEU  46  77.455   2.547   9.470
  334    HB3  LEU  46           HB1      LEU  46  78.544   1.963  10.724
  335    HG   LEU  46           HG       LEU  46  77.337   3.975  12.115
  336   HD11  LEU  46          HD11      LEU  46  75.836   4.620  10.296
  337   HD12  LEU  46          HD12      LEU  46  74.903   3.903  11.608
  338   HD13  LEU  46          HD13      LEU  46  75.247   2.957  10.159
  339   HD21  LEU  46          HD21      LEU  46  77.495   1.619  12.828
  340   HD22  LEU  46          HD22      LEU  46  76.190   1.191  11.722
  341   HD23  LEU  46          HD23      LEU  46  75.870   2.250  13.096
  342    H    LYS  47           HN       LYS  47  80.444   2.179  11.020
  343    HA   LYS  47           HA       LYS  47  81.073   3.088  13.589
  344    HB2  LYS  47           HB2      LYS  47  83.012   1.618  11.797
  345    HB3  LYS  47           HB1      LYS  47  82.944   1.582  13.559
  346    HG2  LYS  47           HG2      LYS  47  80.790   0.458  13.505
  347    HG3  LYS  47           HG1      LYS  47  80.721   0.606  11.752
  348    HD2  LYS  47           HD2      LYS  47  82.947  -0.708  11.732
  349    HD3  LYS  47           HD1      LYS  47  82.572  -1.109  13.407
  350    HE2  LYS  47           HE2      LYS  47  80.697  -1.627  11.081
  351    HE3  LYS  47           HE1      LYS  47  81.787  -2.835  11.761
  352    HZ1  LYS  47           HZ1      LYS  47  79.759  -1.364  13.350
  353    HZ2  LYS  47           HZ2      LYS  47  80.694  -2.692  13.850
  354    HZ3  LYS  47           HZ3      LYS  47  79.491  -2.893  12.668
  355    H    LEU  48           HN       LEU  48  83.151   3.562  10.683
  356    HA   LEU  48           HA       LEU  48  85.167   5.048  11.844
  357    HB2  LEU  48           HB2      LEU  48  84.222   4.632   9.178
  358    HB3  LEU  48           HB1      LEU  48  84.450   6.370   9.337
  359    HG   LEU  48           HG       LEU  48  86.547   4.330  10.109
  360   HD11  LEU  48          HD11      LEU  48  86.176   4.167   7.724
  361   HD12  LEU  48          HD12      LEU  48  87.705   4.986   8.045
  362   HD13  LEU  48          HD13      LEU  48  86.282   5.920   7.566
  363   HD21  LEU  48          HD21      LEU  48  86.926   7.250   9.458
  364   HD22  LEU  48          HD22      LEU  48  88.028   6.167  10.307
  365   HD23  LEU  48          HD23      LEU  48  86.551   6.715  11.095
  366    H    VAL  49           HN       VAL  49  82.187   6.534  10.487
  367    HA   VAL  49           HA       VAL  49  82.740   9.153  11.470
  368    HB   VAL  49           HB       VAL  49  80.084   7.803  10.938
  369   HG11  VAL  49          HG11      VAL  49  79.311  10.226  10.703
  370   HG12  VAL  49          HG12      VAL  49  80.807  10.682  11.517
  371   HG13  VAL  49          HG13      VAL  49  79.621   9.676  12.350
  372   HG21  VAL  49          HG21      VAL  49  81.803   8.100   9.050
  373   HG22  VAL  49          HG22      VAL  49  81.555   9.836   9.249
  374   HG23  VAL  49          HG23      VAL  49  80.207   8.800   8.775
  375    H    GLU  50           HN       GLU  50  80.795   6.523  12.943
  376    HA   GLU  50           HA       GLU  50  79.841   7.780  15.220
  377    HB2  GLU  50           HB2      GLU  50  80.995   5.007  14.900
  378    HB3  GLU  50           HB1      GLU  50  80.287   5.540  16.417
  379    HG2  GLU  50           HG2      GLU  50  78.839   5.624  13.758
  380    HG3  GLU  50           HG1      GLU  50  78.681   4.314  14.921
  381    H    LYS  51           HN       LYS  51  83.144   6.608  14.688
  382    HA   LYS  51           HA       LYS  51  84.088   7.136  17.331
  383    HB2  LYS  51           HB2      LYS  51  85.509   6.992  14.666
  384    HB3  LYS  51           HB1      LYS  51  86.339   7.106  16.218
  385    HG2  LYS  51           HG2      LYS  51  85.186   5.058  16.983
  386    HG3  LYS  51           HG1      LYS  51  84.392   4.925  15.413
  387    HD2  LYS  51           HD2      LYS  51  86.374   4.377  14.299
  388    HD3  LYS  51           HD1      LYS  51  87.390   5.118  15.532
  389    HE2  LYS  51           HE2      LYS  51  86.804   3.326  17.114
  390    HE3  LYS  51           HE1      LYS  51  85.760   2.589  15.900
  391    HZ1  LYS  51           HZ1      LYS  51  88.447   2.132  16.262
  392    HZ2  LYS  51           HZ2      LYS  51  88.357   3.087  14.859
  393    HZ3  LYS  51           HZ3      LYS  51  87.499   1.623  14.951
  394    H    LEU  52           HN       LEU  52  84.571   9.095  14.338
  395    HA   LEU  52           HA       LEU  52  85.666  11.298  15.773
  396    HB2  LEU  52           HB2      LEU  52  85.119  10.594  13.057
  397    HB3  LEU  52           HB1      LEU  52  84.319  12.127  13.333
  398    HG   LEU  52           HG       LEU  52  86.556  12.891  14.387
  399   HD11  LEU  52          HD11      LEU  52  87.477  10.465  12.815
  400   HD12  LEU  52          HD12      LEU  52  87.527  10.625  14.569
  401   HD13  LEU  52          HD13      LEU  52  88.538  11.661  13.561
  402   HD21  LEU  52          HD21      LEU  52  86.141  13.963  12.383
  403   HD22  LEU  52          HD22      LEU  52  85.968  12.459  11.478
  404   HD23  LEU  52          HD23      LEU  52  87.571  13.046  11.920
  405    H    ASP  53           HN       ASP  53  82.500  11.148  14.157
  406    HA   ASP  53           HA       ASP  53  80.428  12.002  14.786
  407    HB2  ASP  53           HB2      ASP  53  81.185  10.626  16.843
  408    HB3  ASP  53           HB1      ASP  53  81.472  12.181  17.593
  409    H    VAL  54           HN       VAL  54  80.825  13.948  13.715
  410    HA   VAL  54           HA       VAL  54  81.006  16.249  15.522
  411    HB   VAL  54           HB       VAL  54  83.301  15.875  15.260
  412   HG11  VAL  54          HG11      VAL  54  84.290  15.564  12.939
  413   HG12  VAL  54          HG12      VAL  54  82.635  15.322  12.377
  414   HG13  VAL  54          HG13      VAL  54  83.327  14.230  13.583
  415   HG21  VAL  54          HG21      VAL  54  83.005  17.802  12.972
  416   HG22  VAL  54          HG22      VAL  54  84.037  17.905  14.392
  417   HG23  VAL  54          HG23      VAL  54  82.316  18.253  14.530
  418    H    LYS  55           HN       LYS  55  79.022  15.137  13.784
  419    HA   LYS  55           HA       LYS  55  77.566  15.752  12.048
  420    HB2  LYS  55           HB2      LYS  55  77.389  17.422  14.080
  421    HB3  LYS  55           HB1      LYS  55  78.032  18.580  12.922
  422    HG2  LYS  55           HG2      LYS  55  75.634  18.695  12.836
  423    HG3  LYS  55           HG1      LYS  55  76.179  17.952  11.350
  424    HD2  LYS  55           HD2      LYS  55  75.295  15.873  11.897
  425    HD3  LYS  55           HD1      LYS  55  75.502  16.123  13.628
  426    HE2  LYS  55           HE2      LYS  55  73.552  17.447  13.784
  427    HE3  LYS  55           HE1      LYS  55  73.510  17.740  12.045
  428    HZ1  LYS  55           HZ1      LYS  55  73.229  15.027  13.191
  429    HZ2  LYS  55           HZ2      LYS  55  72.830  15.556  11.627
  430    HZ3  LYS  55           HZ3      LYS  55  71.893  16.044  12.957
  431    H    LYS  56           HN       LYS  56  80.617  16.027  11.470
  432    HA   LYS  56           HA       LYS  56  80.684  18.194   9.498
  433    HB2  LYS  56           HB2      LYS  56  82.707  17.383  10.723
  434    HB3  LYS  56           HB1      LYS  56  82.618  15.881   9.816
  435    HG2  LYS  56           HG2      LYS  56  82.684  17.338   7.706
  436    HG3  LYS  56           HG1      LYS  56  83.132  18.671   8.765
  437    HD2  LYS  56           HD2      LYS  56  84.623  16.035   8.603
  438    HD3  LYS  56           HD1      LYS  56  85.105  17.500   7.751
  439    HE2  LYS  56           HE2      LYS  56  85.005  17.044  10.742
  440    HE3  LYS  56           HE1      LYS  56  86.405  17.450   9.754
  441    HZ1  LYS  56           HZ1      LYS  56  84.119  19.178  10.483
  442    HZ2  LYS  56           HZ2      LYS  56  85.150  19.556   9.186
  443    HZ3  LYS  56           HZ3      LYS  56  85.771  19.441  10.763
  444    H    ASP  57           HN       ASP  57  80.628  17.947   7.249
  445    HA   ASP  57           HA       ASP  57  78.843  16.037   6.171
  446    HB2  ASP  57           HB2      ASP  57  80.077  16.692   3.944
  447    HB3  ASP  57           HB1      ASP  57  79.167  17.922   4.817
  448    H    TRP  58           HN       TRP  58  79.165  13.874   6.109
  449    HA   TRP  58           HA       TRP  58  81.923  12.837   5.586
  450    HB2  TRP  58           HB2      TRP  58  79.638  11.686   7.198
  451    HB3  TRP  58           HB1      TRP  58  81.098  10.803   6.801
  452    HD1  TRP  58           HD1      TRP  58  79.719  12.687   9.509
  453    HE1  TRP  58           HE1      TRP  58  81.534  13.692  11.050
  454    HE3  TRP  58           HE3      TRP  58  83.855  12.131   6.527
  455    HZ2  TRP  58           HZ2      TRP  58  84.318  14.203  11.010
  456    HZ3  TRP  58           HZ3      TRP  58  86.067  12.895   7.317
  457    HH2  TRP  58           HH2      TRP  58  86.309  13.925   9.557
  458    H    SER  59           HN       SER  59  78.501  12.527   4.845
  459    HA   SER  59           HA       SER  59  78.322  10.229   3.322
  460    HB2  SER  59           HB2      SER  59  76.352  11.493   3.464
  461    HB3  SER  59           HB1      SER  59  77.150  12.962   2.903
  462    HG   SER  59           HG       SER  59  77.131  10.734   1.219
  463    H    ASP  60           HN       ASP  60  79.332  13.386   1.967
  464    HA   ASP  60           HA       ASP  60  80.013  12.492  -0.603
  465    HB2  ASP  60           HB2      ASP  60  80.085  14.851  -0.073
  466    HB3  ASP  60           HB1      ASP  60  81.332  14.587   1.145
  467    H    HIS  61           HN       HIS  61  81.954  12.465   2.357
  468    HA   HIS  61           HA       HIS  61  84.266  11.242   1.144
  469    HB2  HIS  61           HB2      HIS  61  83.416  11.415   4.042
  470    HB3  HIS  61           HB1      HIS  61  85.018  10.956   3.471
  471    HD1  HIS  61           HD1      HIS  61  82.679  13.842   2.571
  472    HD2  HIS  61           HD2      HIS  61  86.638  13.173   3.692
  473    HE1  HIS  61           HE1      HIS  61  83.818  16.104   2.563
  474    H    ALA  62           HN       ALA  62  84.719   9.147   0.854
  475    HA   ALA  62           HA       ALA  62  83.132   7.048   2.231
  476    HB1  ALA  62           HB1      ALA  62  81.854   7.215   0.239
  477    HB2  ALA  62           HB2      ALA  62  82.980   5.898  -0.093
  478    HB3  ALA  62           HB3      ALA  62  83.283   7.507  -0.752
  479    H    LEU  63           HN       LEU  63  84.207   4.792   1.320
  480    HA   LEU  63           HA       LEU  63  87.125   5.210   1.767
  481    HB2  LEU  63           HB2      LEU  63  85.642   2.580   1.625
  482    HB3  LEU  63           HB1      LEU  63  87.253   2.869   2.260
  483    HG   LEU  63           HG       LEU  63  85.801   2.680   4.129
  484   HD11  LEU  63          HD11      LEU  63  87.503   4.614   4.003
  485   HD12  LEU  63          HD12      LEU  63  86.284   4.677   5.276
  486   HD13  LEU  63          HD13      LEU  63  86.093   5.659   3.824
  487   HD21  LEU  63          HD21      LEU  63  83.665   3.504   4.306
  488   HD22  LEU  63          HD22      LEU  63  83.744   3.496   2.549
  489   HD23  LEU  63          HD23      LEU  63  84.038   4.989   3.438
  490    H    TRP  64           HN       TRP  64  88.668   4.765   0.301
  491    HA   TRP  64           HA       TRP  64  87.855   3.584  -2.348
  492    HB2  TRP  64           HB2      TRP  64  88.488   5.523  -3.380
  493    HB3  TRP  64           HB1      TRP  64  88.638   6.253  -1.807
  494    HD1  TRP  64           HD1      TRP  64  91.288   5.241  -0.691
  495    HE1  TRP  64           HE1      TRP  64  93.533   5.687  -1.864
  496    HE3  TRP  64           HE3      TRP  64  89.625   6.255  -5.409
  497    HZ2  TRP  64           HZ2      TRP  64  94.498   6.432  -4.454
  498    HZ3  TRP  64           HZ3      TRP  64  91.224   6.855  -7.203
  499    HH2  TRP  64           HH2      TRP  64  93.657   6.948  -6.732
  500    H    TRP  65           HN       TRP  65  89.496   2.219  -3.297
  501    HA   TRP  65           HA       TRP  65  91.533   1.294  -1.313
  502    HB2  TRP  65           HB2      TRP  65  89.791  -0.317  -2.318
  503    HB3  TRP  65           HB1      TRP  65  90.707  -0.185  -3.814
  504    HD1  TRP  65           HD1      TRP  65  93.361   0.105  -1.480
  505    HE1  TRP  65           HE1      TRP  65  94.429  -2.147  -0.882
  506    HE3  TRP  65           HE3      TRP  65  89.734  -3.084  -3.164
  507    HZ2  TRP  65           HZ2      TRP  65  93.856  -4.932  -1.098
  508    HZ3  TRP  65           HZ3      TRP  65  90.038  -5.533  -2.960
  509    HH2  TRP  65           HH2      TRP  65  92.090  -6.462  -1.930
  510    H    GLU  66           HN       GLU  66  93.190   2.833  -1.808
  511    HA   GLU  66           HA       GLU  66  93.988   3.652  -4.376
  512    HB2  GLU  66           HB2      GLU  66  96.262   4.011  -3.333
  513    HB3  GLU  66           HB1      GLU  66  94.913   4.758  -2.488
  514    HG2  GLU  66           HG2      GLU  66  94.817   2.821  -0.949
  515    HG3  GLU  66           HG1      GLU  66  96.195   2.119  -1.784
  516    H    LYS  67           HN       LYS  67  94.531   0.550  -2.841
  517    HA   LYS  67           HA       LYS  67  96.767  -0.202  -4.521
  518    HB2  LYS  67           HB2      LYS  67  94.659  -2.069  -3.399
  519    HB3  LYS  67           HB1      LYS  67  96.302  -2.487  -3.870
  520    HG2  LYS  67           HG2      LYS  67  95.531  -0.660  -1.580
  521    HG3  LYS  67           HG1      LYS  67  96.113  -2.315  -1.428
  522    HD2  LYS  67           HD2      LYS  67  98.181  -1.497  -2.748
  523    HD3  LYS  67           HD1      LYS  67  97.610   0.126  -2.358
  524    HE2  LYS  67           HE2      LYS  67  99.024  -0.313  -0.547
  525    HE3  LYS  67           HE1      LYS  67  97.460  -0.818   0.099
  526    HZ1  LYS  67           HZ1      LYS  67  98.132  -2.917   0.215
  527    HZ2  LYS  67           HZ2      LYS  67  99.710  -2.354  -0.069
  528    HZ3  LYS  67           HZ3      LYS  67  98.754  -2.903  -1.363
  529    H    LYS  68           HN       LYS  68  93.560   0.486  -5.021
  530    HA   LYS  68           HA       LYS  68  93.530  -0.779  -7.718
  531    HB2  LYS  68           HB2      LYS  68  90.984  -0.470  -6.140
  532    HB3  LYS  68           HB1      LYS  68  91.369  -1.618  -7.420
  533    HG2  LYS  68           HG2      LYS  68  92.723  -1.742  -4.705
  534    HG3  LYS  68           HG1      LYS  68  91.207  -2.544  -5.038
  535    HD2  LYS  68           HD2      LYS  68  92.152  -3.953  -6.682
  536    HD3  LYS  68           HD1      LYS  68  93.592  -2.946  -6.827
  537    HE2  LYS  68           HE2      LYS  68  94.553  -3.808  -4.906
  538    HE3  LYS  68           HE1      LYS  68  93.005  -4.156  -4.142
  539    HZ1  LYS  68           HZ1      LYS  68  94.402  -6.095  -5.024
  540    HZ2  LYS  68           HZ2      LYS  68  93.859  -5.614  -6.560
  541    HZ3  LYS  68           HZ3      LYS  68  92.742  -6.082  -5.369
  542    H    ARG  69           HN       ARG  69  93.177   2.001  -5.773
  543    HA   ARG  69           HA       ARG  69  92.392   4.162  -6.229
  544    HB2  ARG  69           HB2      ARG  69  93.069   3.196  -9.031
  545    HB3  ARG  69           HB1      ARG  69  92.537   4.834  -8.688
  546    HG2  ARG  69           HG2      ARG  69  94.848   5.115  -8.598
  547    HG3  ARG  69           HG1      ARG  69  94.502   4.785  -6.903
  548    HD2  ARG  69           HD2      ARG  69  96.363   3.396  -7.545
  549    HD3  ARG  69           HD1      ARG  69  94.952   2.356  -7.376
  550    HE   ARG  69           HE       ARG  69  95.002   1.965  -9.712
  551   HH11  ARG  69          HH11      ARG  69  95.984   2.147 -11.736
  552   HH12  ARG  69          HH12      ARG  69  97.205   3.349 -11.988
  553   HH21  ARG  69          HH21      ARG  69  97.043   4.570  -8.747
  554   HH22  ARG  69          HH22      ARG  69  97.804   4.722 -10.296
  555    H    THR  70           HN       THR  70  90.448   2.294  -5.744
  556    HA   THR  70           HA       THR  70  88.331   2.804  -7.812
  557    HB   THR  70           HB       THR  70  89.060   0.425  -7.153
  558    HG1  THR  70           HG1      THR  70  86.487   0.238  -6.638
  559   HG21  THR  70          HG21      THR  70  88.977   1.133  -4.639
  560   HG22  THR  70          HG22      THR  70  88.447  -0.483  -5.100
  561   HG23  THR  70          HG23      THR  70  87.256   0.781  -4.790
  562    H    TRP  71           HN       TRP  71  86.115   2.380  -6.417
  563    HA   TRP  71           HA       TRP  71  86.171   4.176  -4.041
  564    HB2  TRP  71           HB2      TRP  71  83.807   4.884  -4.901
  565    HB3  TRP  71           HB1      TRP  71  85.223   5.660  -5.581
  566    HD1  TRP  71           HD1      TRP  71  84.490   2.127  -6.774
  567    HE1  TRP  71           HE1      TRP  71  83.618   2.219  -9.157
  568    HE3  TRP  71           HE3      TRP  71  83.874   7.169  -7.303
  569    HZ2  TRP  71           HZ2      TRP  71  82.786   4.152 -11.096
  570    HZ3  TRP  71           HZ3      TRP  71  83.044   8.106  -9.441
  571    HH2  TRP  71           HH2      TRP  71  82.500   6.605 -11.338
  572    H    LEU  72           HN       LEU  72  85.951   2.590  -2.577
  573    HA   LEU  72           HA       LEU  72  84.526   0.195  -2.965
  574    HB2  LEU  72           HB2      LEU  72  85.097   1.626  -0.373
  575    HB3  LEU  72           HB1      LEU  72  84.697  -0.081  -0.534
  576    HG   LEU  72           HG       LEU  72  87.029   1.199  -1.967
  577   HD11  LEU  72          HD11      LEU  72  88.458   0.194  -0.207
  578   HD12  LEU  72          HD12      LEU  72  87.001  -0.211   0.703
  579   HD13  LEU  72          HD13      LEU  72  87.415   1.477   0.403
  580   HD21  LEU  72          HD21      LEU  72  87.764  -1.332  -1.791
  581   HD22  LEU  72          HD22      LEU  72  86.633  -0.826  -3.043
  582   HD23  LEU  72          HD23      LEU  72  86.037  -1.613  -1.580
  583    H    LEU  73           HN       LEU  73  82.607   0.685  -3.889
  584    HA   LEU  73           HA       LEU  73  80.463   1.677  -2.051
  585    HB2  LEU  73           HB2      LEU  73  79.229   2.410  -4.118
  586    HB3  LEU  73           HB1      LEU  73  80.703   3.319  -3.807
  587    HG   LEU  73           HG       LEU  73  81.711   1.343  -5.423
  588   HD11  LEU  73          HD11      LEU  73  79.223   0.576  -5.697
  589   HD12  LEU  73          HD12      LEU  73  80.233   0.715  -7.137
  590   HD13  LEU  73          HD13      LEU  73  79.072   1.981  -6.745
  591   HD21  LEU  73          HD21      LEU  73  81.987   3.787  -5.711
  592   HD22  LEU  73          HD22      LEU  73  80.368   3.890  -6.386
  593   HD23  LEU  73          HD23      LEU  73  81.624   2.998  -7.241
  594    H    LYS  74           HN       LYS  74  81.786  -0.988  -3.025
  595    HA   LYS  74           HA       LYS  74  79.628  -2.463  -4.299
  596    HB2  LYS  74           HB2      LYS  74  81.933  -3.631  -2.727
  597    HB3  LYS  74           HB1      LYS  74  81.023  -4.379  -4.029
  598    HG2  LYS  74           HG2      LYS  74  82.739  -1.904  -4.392
  599    HG3  LYS  74           HG1      LYS  74  83.317  -3.539  -4.680
  600    HD2  LYS  74           HD2      LYS  74  82.580  -3.199  -6.826
  601    HD3  LYS  74           HD1      LYS  74  80.986  -3.541  -6.175
  602    HE2  LYS  74           HE2      LYS  74  80.708  -1.109  -5.760
  603    HE3  LYS  74           HE1      LYS  74  82.264  -0.825  -6.513
  604    HZ1  LYS  74           HZ1      LYS  74  80.985  -2.394  -8.309
  605    HZ2  LYS  74           HZ2      LYS  74  81.117  -0.703  -8.403
  606    HZ3  LYS  74           HZ3      LYS  74  79.730  -1.413  -7.726
  607    H    THR  75           HN       THR  75  78.615  -1.147  -2.000
  608    HA   THR  75           HA       THR  75  78.598  -2.658   0.381
  609    HB   THR  75           HB       THR  75  76.109  -1.318  -0.687
  610    HG1  THR  75           HG1      THR  75  77.528   0.419   0.651
  611   HG21  THR  75          HG21      THR  75  77.149  -0.908   2.075
  612   HG22  THR  75          HG22      THR  75  76.564  -2.535   1.706
  613   HG23  THR  75          HG23      THR  75  75.490  -1.149   1.524
  614    H    HIS  76           HN       HIS  76  77.618  -3.661  -2.660
  615    HA   HIS  76           HA       HIS  76  75.272  -5.153  -2.216
  616    HB2  HIS  76           HB2      HIS  76  77.636  -5.787  -3.996
  617    HB3  HIS  76           HB1      HIS  76  76.072  -6.598  -4.087
  618    HD1  HIS  76           HD1      HIS  76  74.019  -4.535  -4.070
  619    HD2  HIS  76           HD2      HIS  76  77.693  -3.806  -5.901
  620    HE1  HIS  76           HE1      HIS  76  73.643  -2.632  -5.700
  621    H    TRP  77           HN       TRP  77  78.519  -6.657  -2.333
  622    HA   TRP  77           HA       TRP  77  77.501  -8.790  -0.511
  623    HB2  TRP  77           HB2      TRP  77  80.012  -8.634  -2.162
  624    HB3  TRP  77           HB1      TRP  77  79.553 -10.009  -1.173
  625    HD1  TRP  77           HD1      TRP  77  78.384  -7.998  -4.215
  626    HE1  TRP  77           HE1      TRP  77  76.933  -9.521  -5.678
  627    HE3  TRP  77           HE3      TRP  77  78.158 -12.138  -1.239
  628    HZ2  TRP  77           HZ2      TRP  77  75.806 -12.155  -5.616
  629    HZ3  TRP  77           HZ3      TRP  77  76.891 -14.140  -1.964
  630    HH2  TRP  77           HH2      TRP  77  75.715 -14.155  -4.147
  631    H    THR  78           HN       THR  78  80.868  -8.755  -0.412
  632    HA   THR  78           HA       THR  78  81.047  -6.842   1.834
  633    HB   THR  78           HB       THR  78  82.058  -9.422   2.780
  634    HG1  THR  78           HG1      THR  78  80.442 -10.234   1.413
  635   HG21  THR  78          HG21      THR  78  80.086  -7.354   3.749
  636   HG22  THR  78          HG22      THR  78  81.576  -7.930   4.505
  637   HG23  THR  78          HG23      THR  78  80.130  -8.940   4.506
  638    H    LEU  79           HN       LEU  79  83.218  -6.498   2.518
  639    HA   LEU  79           HA       LEU  79  85.139  -6.286   0.564
  640    HB2  LEU  79           HB2      LEU  79  86.754  -6.018   2.251
  641    HB3  LEU  79           HB1      LEU  79  85.293  -5.257   2.726
  642    HG   LEU  79           HG       LEU  79  86.306  -7.897   3.685
  643   HD11  LEU  79          HD11      LEU  79  85.883  -5.352   5.246
  644   HD12  LEU  79          HD12      LEU  79  87.426  -5.755   4.491
  645   HD13  LEU  79          HD13      LEU  79  86.761  -6.793   5.756
  646   HD21  LEU  79          HD21      LEU  79  83.927  -8.099   3.850
  647   HD22  LEU  79          HD22      LEU  79  83.749  -6.388   4.204
  648   HD23  LEU  79          HD23      LEU  79  84.383  -7.474   5.434
  649    H    ASP  80           HN       ASP  80  84.917  -9.026   2.816
  650    HA   ASP  80           HA       ASP  80  87.000 -10.624   1.932
  651    HB2  ASP  80           HB2      ASP  80  85.106 -11.041   3.624
  652    HB3  ASP  80           HB1      ASP  80  84.212 -11.717   2.277
  653    H    LYS  81           HN       LYS  81  83.961  -9.921   0.308
  654    HA   LYS  81           HA       LYS  81  84.344 -11.941  -1.738
  655    HB2  LYS  81           HB2      LYS  81  82.136 -11.528  -1.992
  656    HB3  LYS  81           HB1      LYS  81  82.254 -10.093  -1.005
  657    HG2  LYS  81           HG2      LYS  81  83.089 -10.022  -3.899
  658    HG3  LYS  81           HG1      LYS  81  81.411  -9.882  -3.463
  659    HD2  LYS  81           HD2      LYS  81  82.170  -8.000  -1.879
  660    HD3  LYS  81           HD1      LYS  81  83.671  -8.035  -2.754
  661    HE2  LYS  81           HE2      LYS  81  82.156  -7.883  -4.884
  662    HE3  LYS  81           HE1      LYS  81  80.971  -7.259  -3.740
  663    HZ1  LYS  81           HZ1      LYS  81  83.729  -6.205  -3.939
  664    HZ2  LYS  81           HZ2      LYS  81  82.407  -5.512  -3.126
  665    HZ3  LYS  81           HZ3      LYS  81  82.434  -5.560  -4.824
  666    H    TYR  82           HN       TYR  82  85.213  -8.635  -1.262
  667    HA   TYR  82           HA       TYR  82  86.149  -8.219  -3.973
  668    HB2  TYR  82           HB2      TYR  82  85.574  -6.505  -1.983
  669    HB3  TYR  82           HB1      TYR  82  87.295  -6.661  -1.676
  670    HD1  TYR  82           HD1      TYR  82  85.125  -4.518  -3.133
  671    HD2  TYR  82           HD2      TYR  82  88.571  -6.835  -4.247
  672    HE1  TYR  82           HE1      TYR  82  85.593  -2.940  -4.987
  673    HE2  TYR  82           HE2      TYR  82  89.033  -5.258  -6.097
  674    HH   TYR  82           HH       TYR  82  87.340  -2.241  -6.411
  675    H    GLY  83           HN       GLY  83  87.721  -8.920  -0.825
  676    HA2  GLY  83           HA2      GLY  83  89.477 -10.801  -1.001
  677    HA3  GLY  83           HA1      GLY  83  90.123  -9.940  -2.398
  678    H    ILE  84           HN       ILE  84  88.957  -7.764  -0.264
  679    HA   ILE  84           HA       ILE  84  91.427  -6.543   0.411
  680    HB   ILE  84           HB       ILE  84  88.669  -6.505   1.581
  681   HG12  ILE  84          HG12      ILE  84  89.974  -4.314  -0.014
  682   HG13  ILE  84          HG11      ILE  84  89.164  -5.668  -0.793
  683   HG21  ILE  84          HG21      ILE  84  89.253  -4.372   2.650
  684   HG22  ILE  84          HG22      ILE  84  90.939  -4.629   2.184
  685   HG23  ILE  84          HG23      ILE  84  90.145  -5.733   3.302
  686   HD11  ILE  84          HD11      ILE  84  87.775  -4.097   1.373
  687   HD12  ILE  84          HD12      ILE  84  87.065  -5.107   0.116
  688   HD13  ILE  84          HD13      ILE  84  87.755  -3.541  -0.303
  689    H    GLN  85           HN       GLN  85  92.327  -6.389   2.679
  690    HA   GLN  85           HA       GLN  85  91.535  -8.473   4.574
  691    HB2  GLN  85           HB2      GLN  85  93.354  -9.341   2.760
  692    HB3  GLN  85           HB1      GLN  85  94.442  -8.633   3.947
  693    HG2  GLN  85           HG2      GLN  85  94.242 -10.765   4.870
  694    HG3  GLN  85           HG1      GLN  85  92.864  -9.997   5.675
  695   HE21  GLN  85          HE21      GLN  85  90.991  -9.896   3.646
  696   HE22  GLN  85          HE22      GLN  85  90.582 -11.459   3.147
  697    H    ALA  86           HN       ALA  86  93.825  -8.378   6.211
  698    HA   ALA  86           HA       ALA  86  93.553  -5.744   7.404
  699    HB1  ALA  86           HB1      ALA  86  94.140  -8.156   8.402
  700    HB2  ALA  86           HB2      ALA  86  94.683  -6.678   9.198
  701    HB3  ALA  86           HB3      ALA  86  95.789  -7.586   8.160
  702    H    ASP  87           HN       ASP  87  95.690  -7.155   5.080
  703    HA   ASP  87           HA       ASP  87  97.803  -5.151   5.507
  704    HB2  ASP  87           HB2      ASP  87  98.649  -6.269   3.303
  705    HB3  ASP  87           HB1      ASP  87  98.678  -7.210   4.794
  706    H    ALA  88           HN       ALA  88  94.810  -4.970   4.223
  707    HA   ALA  88           HA       ALA  88  95.544  -3.374   1.828
  708    HB1  ALA  88           HB1      ALA  88  93.703  -4.620   1.218
  709    HB2  ALA  88           HB2      ALA  88  92.824  -3.278   1.950
  710    HB3  ALA  88           HB3      ALA  88  93.131  -4.752   2.878
  711    H    LYS  89           HN       LYS  89  96.029  -1.256   2.244
  712    HA   LYS  89           HA       LYS  89  94.711   0.117   4.541
  713    HB2  LYS  89           HB2      LYS  89  96.823   1.394   2.816
  714    HB3  LYS  89           HB1      LYS  89  96.474   1.653   4.524
  715    HG2  LYS  89           HG2      LYS  89  97.651  -0.897   3.379
  716    HG3  LYS  89           HG1      LYS  89  98.575   0.382   4.140
  717    HD2  LYS  89           HD2      LYS  89  97.578   0.005   6.264
  718    HD3  LYS  89           HD1      LYS  89  96.309  -1.003   5.574
  719    HE2  LYS  89           HE2      LYS  89  98.018  -2.397   6.652
  720    HE3  LYS  89           HE1      LYS  89  97.981  -2.673   4.909
  721    HZ1  LYS  89           HZ1      LYS  89 100.039  -1.898   4.683
  722    HZ2  LYS  89           HZ2      LYS  89 100.179  -2.021   6.372
  723    HZ3  LYS  89           HZ3      LYS  89  99.741  -0.543   5.658
  724    H    LEU  90           HN       LEU  90  93.080   1.412   4.223
  725    HA   LEU  90           HA       LEU  90  92.498   2.423   1.453
  726    HB2  LEU  90           HB2      LEU  90  90.350   2.368   3.545
  727    HB3  LEU  90           HB1      LEU  90  90.226   2.136   1.804
  728    HG   LEU  90           HG       LEU  90  91.459   0.156   3.719
  729   HD11  LEU  90          HD11      LEU  90  89.363  -1.167   3.139
  730   HD12  LEU  90          HD12      LEU  90  88.713   0.331   2.475
  731   HD13  LEU  90          HD13      LEU  90  89.118   0.229   4.189
  732   HD21  LEU  90          HD21      LEU  90  90.618  -0.160   0.821
  733   HD22  LEU  90          HD22      LEU  90  91.437  -1.366   1.815
  734   HD23  LEU  90          HD23      LEU  90  92.281   0.104   1.338
  735    H    GLN  91           HN       GLN  91  90.956   4.436   1.703
  736    HA   GLN  91           HA       GLN  91  92.072   6.296   3.768
  737    HB2  GLN  91           HB2      GLN  91  91.405   7.127   0.933
  738    HB3  GLN  91           HB1      GLN  91  92.261   8.057   2.158
  739    HG2  GLN  91           HG2      GLN  91  94.262   6.890   1.867
  740    HG3  GLN  91           HG1      GLN  91  93.462   5.446   1.268
  741   HE21  GLN  91          HE21      GLN  91  92.240   8.314  -0.106
  742   HE22  GLN  91          HE22      GLN  91  93.033   8.194  -1.592
  743    H    PHE  92           HN       PHE  92  90.563   8.250   3.948
  744    HA   PHE  92           HA       PHE  92  87.735   7.456   3.401
  745    HB2  PHE  92           HB2      PHE  92  88.257   7.181   5.764
  746    HB3  PHE  92           HB1      PHE  92  88.889   8.805   5.856
  747    HD1  PHE  92           HD1      PHE  92  85.834   8.383   3.809
  748    HD2  PHE  92           HD2      PHE  92  87.339   9.084   7.782
  749    HE1  PHE  92           HE1      PHE  92  83.607   9.145   4.525
  750    HE2  PHE  92           HE2      PHE  92  85.099   9.860   8.481
  751    HZ   PHE  92           HZ       PHE  92  83.235   9.888   6.856
  752    H    THR  93           HN       THR  93  87.713   8.697   1.517
  753    HA   THR  93           HA       THR  93  87.655  11.652   1.920
  754    HB   THR  93           HB       THR  93  89.619  11.966   0.805
  755    HG1  THR  93           HG1      THR  93  89.699  11.513  -1.348
  756   HG21  THR  93          HG21      THR  93  90.401   9.862   1.750
  757   HG22  THR  93          HG22      THR  93  91.007  10.024   0.103
  758   HG23  THR  93          HG23      THR  93  89.642   8.958   0.437
  759    HA   PRO  94           HA       PRO  94  84.286  12.205  -0.907
  760    HB2  PRO  94           HB2      PRO  94  86.352  13.059  -2.926
  761    HB3  PRO  94           HB1      PRO  94  84.761  13.775  -2.581
  762    HG2  PRO  94           HG2      PRO  94  86.966  14.854  -1.579
  763    HG3  PRO  94           HG1      PRO  94  85.482  14.759  -0.613
  764    HD2  PRO  94           HD2      PRO  94  88.005  13.225  -0.306
  765    HD3  PRO  94           HD1      PRO  94  86.752  13.566   0.903
  766    H    TYR 541           HT1      TYR 541  57.287  32.272   4.630
  767    HA   TYR 541           HA       TYR 541  57.890  35.095   5.196
  768    HB2  TYR 541           HB2      TYR 541  58.477  33.534   2.691
  769    HB3  TYR 541           HB1      TYR 541  57.878  35.184   2.529
  770    HD1  TYR 541           HD1      TYR 541  59.361  37.003   2.732
  771    HD2  TYR 541           HD2      TYR 541  60.509  33.162   4.279
  772    HE1  TYR 541           HE1      TYR 541  61.634  37.872   3.206
  773    HE2  TYR 541           HE2      TYR 541  62.780  34.033   4.754
  774    HH   TYR 541           HH       TYR 541  63.531  37.395   4.590
  775    H    HIS 542           HN       HIS 542  55.709  32.746   5.191
  776    HA   HIS 542           HA       HIS 542  53.665  33.418   3.394
  777    HB2  HIS 542           HB2      HIS 542  53.376  32.553   6.286
  778    HB3  HIS 542           HB1      HIS 542  52.134  32.444   5.046
  779    HD1  HIS 542           HD1      HIS 542  55.293  31.741   3.492
  780    HD2  HIS 542           HD2      HIS 542  52.586  29.520   5.757
  781    HE1  HIS 542           HE1      HIS 542  55.826  29.302   3.059
  782    H    GLU 543           HN       GLU 543  53.292  34.355   6.832
  783    HA   GLU 543           HA       GLU 543  52.689  37.147   5.950
  784    HB2  GLU 543           HB2      GLU 543  50.847  37.006   7.785
  785    HB3  GLU 543           HB1      GLU 543  50.509  36.301   6.213
  786    HG2  GLU 543           HG2      GLU 543  51.768  34.580   8.346
  787    HG3  GLU 543           HG1      GLU 543  50.042  34.908   8.419
  788    H    ARG 544           HN       ARG 544  52.040  36.126   9.179
  789    HA   ARG 544           HA       ARG 544  54.134  37.877  10.191
  790    HB2  ARG 544           HB2      ARG 544  51.920  36.265  11.459
  791    HB3  ARG 544           HB1      ARG 544  53.147  37.052  12.441
  792    HG2  ARG 544           HG2      ARG 544  51.311  38.593  12.265
  793    HG3  ARG 544           HG1      ARG 544  52.610  39.201  11.252
  794    HD2  ARG 544           HD2      ARG 544  51.524  38.673   9.271
  795    HD3  ARG 544           HD1      ARG 544  50.543  37.422  10.034
  796    HE   ARG 544           HE       ARG 544  49.648  39.707  11.262
  797   HH11  ARG 544          HH11      ARG 544  47.976  40.989  10.429
  798   HH12  ARG 544          HH12      ARG 544  47.665  40.981   8.725
  799   HH21  ARG 544          HH21      ARG 544  50.191  38.716   8.006
  800   HH22  ARG 544          HH22      ARG 544  48.918  39.693   7.354
  801    H    ARG 545           HN       ARG 545  53.426  34.933  11.940
  802    HA   ARG 545           HA       ARG 545  56.314  34.343  12.002
  803    HB2  ARG 545           HB2      ARG 545  55.195  32.397  13.584
  804    HB3  ARG 545           HB1      ARG 545  55.624  33.997  14.154
  805    HG2  ARG 545           HG2      ARG 545  53.350  33.441  14.844
  806    HG3  ARG 545           HG1      ARG 545  53.318  34.783  13.710
  807    HD2  ARG 545           HD2      ARG 545  51.577  33.311  13.014
  808    HD3  ARG 545           HD1      ARG 545  52.894  33.022  11.883
  809    HE   ARG 545           HE       ARG 545  53.328  31.157  13.884
  810   HH11  ARG 545          HH11      ARG 545  52.411  29.090  13.855
  811   HH12  ARG 545          HH12      ARG 545  50.960  28.814  12.952
  812   HH21  ARG 545          HH21      ARG 545  50.705  32.094  11.853
  813   HH22  ARG 545          HH22      ARG 545  49.994  30.515  11.817
  814    H    GLY 546           HN       GLY 546  54.358  31.525  12.308
  815    HA2  GLY 546           HA2      GLY 546  54.007  30.522   9.757
  816    HA3  GLY 546           HA1      GLY 546  55.734  30.291  10.058
  817    H    SER 547           HN       SER 547  56.402  28.742  11.570
  818    HA   SER 547           HA       SER 547  54.388  27.355  13.219
  819    HB2  SER 547           HB2      SER 547  55.703  26.130  10.811
  820    HB3  SER 547           HB1      SER 547  55.410  25.118  12.225
  821    HG   SER 547           HG       SER 547  53.244  26.597  11.755
  822    H    LEU 548           HN       LEU 548  55.445  27.389  15.136
  823    HA   LEU 548           HA       LEU 548  58.234  27.773  15.406
  824    HB2  LEU 548           HB2      LEU 548  55.955  27.170  17.190
  825    HB3  LEU 548           HB1      LEU 548  57.504  26.613  17.808
  826    HG   LEU 548           HG       LEU 548  58.405  28.949  17.338
  827   HD11  LEU 548          HD11      LEU 548  55.489  29.382  16.732
  828   HD12  LEU 548          HD12      LEU 548  56.895  29.862  15.791
  829   HD13  LEU 548          HD13      LEU 548  56.514  30.704  17.285
  830   HD21  LEU 548          HD21      LEU 548  57.507  28.070  19.590
  831   HD22  LEU 548          HD22      LEU 548  56.076  29.038  19.242
  832   HD23  LEU 548          HD23      LEU 548  57.654  29.815  19.389
  833    H    CYS 549           HN       CYS 549  59.958  26.405  15.580
  834    HA   CYS 549           HA       CYS 549  59.488  23.584  14.867
  835    HB2  CYS 549           HB2      CYS 549  61.406  24.459  13.805
  836    HB3  CYS 549           HB1      CYS 549  61.888  25.374  15.222
  837    H    SER 550           HN       SER 550  58.655  22.533  16.573
  838    HA   SER 550           HA       SER 550  58.911  23.082  19.278
  839    HB2  SER 550           HB2      SER 550  57.309  21.481  18.772
  840    HB3  SER 550           HB1      SER 550  58.412  20.543  17.770
  841    HG   SER 550           HG       SER 550  59.110  19.539  19.492
  842    H    GLY 551           HN       GLY 551  60.500  23.054  20.641
  843    HA2  GLY 551           HA2      GLY 551  62.423  21.900  21.706
  844    HA3  GLY 551           HA1      GLY 551  62.944  21.404  20.090
  845    H    CYS 552           HN       CYS 552  62.249  23.851  18.835
  846    HA   CYS 552           HA       CYS 552  64.476  25.607  19.771
  847    HB2  CYS 552           HB2      CYS 552  63.140  25.030  17.139
  848    HB3  CYS 552           HB1      CYS 552  63.940  26.576  17.372
  849    H    GLN 553           HN       GLN 553  61.105  25.391  18.855
  850    HA   GLN 553           HA       GLN 553  59.350  26.838  19.053
  851    HB2  GLN 553           HB2      GLN 553  60.947  27.756  21.426
  852    HB3  GLN 553           HB1      GLN 553  59.280  28.238  21.100
  853    HG2  GLN 553           HG2      GLN 553  60.189  25.366  21.299
  854    HG3  GLN 553           HG1      GLN 553  59.479  26.252  22.633
  855   HE21  GLN 553          HE21      GLN 553  58.818  24.958  19.404
  856   HE22  GLN 553          HE22      GLN 553  57.127  24.932  19.559
  857    H    LYS 554           HN       LYS 554  60.660  27.520  17.101
  858    HA   LYS 554           HA       LYS 554  60.648  30.475  17.071
  859    HB2  LYS 554           HB2      LYS 554  62.840  28.755  15.889
  860    HB3  LYS 554           HB1      LYS 554  62.656  30.474  15.570
  861    HG2  LYS 554           HG2      LYS 554  63.035  29.272  18.326
  862    HG3  LYS 554           HG1      LYS 554  64.329  29.975  17.363
  863    HD2  LYS 554           HD2      LYS 554  62.711  32.073  17.267
  864    HD3  LYS 554           HD1      LYS 554  62.005  31.334  18.704
  865    HE2  LYS 554           HE2      LYS 554  64.311  31.250  19.708
  866    HE3  LYS 554           HE1      LYS 554  64.890  32.176  18.323
  867    HZ1  LYS 554           HZ1      LYS 554  64.232  34.007  19.349
  868    HZ2  LYS 554           HZ2      LYS 554  63.600  33.107  20.644
  869    HZ3  LYS 554           HZ3      LYS 554  62.626  33.465  19.298
  870    HA   PRO 555           HA       PRO 555  57.762  29.304  13.763
  871    HB2  PRO 555           HB2      PRO 555  58.735  31.800  12.484
  872    HB3  PRO 555           HB1      PRO 555  57.083  31.275  12.806
  873    HG2  PRO 555           HG2      PRO 555  58.369  33.172  14.310
  874    HG3  PRO 555           HG1      PRO 555  57.083  32.143  14.948
  875    HD2  PRO 555           HD2      PRO 555  59.963  32.096  15.591
  876    HD3  PRO 555           HD1      PRO 555  58.615  31.311  16.451
  877    H    ILE 556           HN       ILE 556  57.934  28.130  11.989
  878    HA   ILE 556           HA       ILE 556  60.572  27.851  10.649
  879    HB   ILE 556           HB       ILE 556  58.024  26.201  10.648
  880   HG12  ILE 556          HG12      ILE 556  60.737  25.280  11.595
  881   HG13  ILE 556          HG11      ILE 556  59.761  26.266  12.663
  882   HG21  ILE 556          HG21      ILE 556  60.619  25.895   9.130
  883   HG22  ILE 556          HG22      ILE 556  58.974  25.900   8.492
  884   HG23  ILE 556          HG23      ILE 556  59.548  24.531   9.447
  885   HD11  ILE 556          HD11      ILE 556  58.259  24.581  13.058
  886   HD12  ILE 556          HD12      ILE 556  59.581  23.545  12.532
  887   HD13  ILE 556          HD13      ILE 556  58.314  23.994  11.394
  888    H    THR 557           HN       THR 557  60.592  29.566   9.163
  889    HA   THR 557           HA       THR 557  58.203  29.966   7.430
  890    HB   THR 557           HB       THR 557  59.228  32.087   6.859
  891    HG1  THR 557           HG1      THR 557  61.287  32.398   7.122
  892   HG21  THR 557          HG21      THR 557  57.979  31.901   8.977
  893   HG22  THR 557          HG22      THR 557  59.293  33.069   9.123
  894   HG23  THR 557          HG23      THR 557  59.464  31.456   9.817
  895    H    GLY 558           HN       GLY 558  58.422  28.214   6.039
  896    HA2  GLY 558           HA2      GLY 558  59.508  28.456   3.565
  897    HA3  GLY 558           HA1      GLY 558  60.867  27.790   4.481
  898    H    ARG 559           HN       ARG 559  60.784  25.681   5.157
  899    HA   ARG 559           HA       ARG 559  58.433  24.039   4.310
  900    HB2  ARG 559           HB2      ARG 559  61.408  23.570   4.300
  901    HB3  ARG 559           HB1      ARG 559  60.348  22.181   4.536
  902    HG2  ARG 559           HG2      ARG 559  59.799  24.099   2.284
  903    HG3  ARG 559           HG1      ARG 559  61.067  22.897   2.095
  904    HD2  ARG 559           HD2      ARG 559  59.490  21.098   2.587
  905    HD3  ARG 559           HD1      ARG 559  58.198  22.253   2.880
  906    HE   ARG 559           HE       ARG 559  59.027  21.176   0.335
  907   HH11  ARG 559          HH11      ARG 559  58.527  22.138  -1.620
  908   HH12  ARG 559          HH12      ARG 559  57.948  23.770  -1.650
  909   HH21  ARG 559          HH21      ARG 559  58.073  24.164   1.787
  910   HH22  ARG 559          HH22      ARG 559  57.692  24.912   0.272
  911    H    CYS 560           HN       CYS 560  57.793  22.382   5.851
  912    HA   CYS 560           HA       CYS 560  59.077  22.540   8.517
  913    HB2  CYS 560           HB2      CYS 560  56.888  22.831   9.642
  914    HB3  CYS 560           HB1      CYS 560  57.354  24.235   8.676
  915    HG   CYS 560           HG       CYS 560  55.278  22.113   7.667
  916    H    ILE 561           HN       ILE 561  59.342  20.642   9.344
  917    HA   ILE 561           HA       ILE 561  57.896  18.322   8.224
  918    HB   ILE 561           HB       ILE 561  60.154  18.560  10.238
  919   HG12  ILE 561          HG12      ILE 561  60.014  17.760   7.337
  920   HG13  ILE 561          HG11      ILE 561  60.715  19.244   7.957
  921   HG21  ILE 561          HG21      ILE 561  58.720  16.474  10.508
  922   HG22  ILE 561          HG22      ILE 561  60.402  16.165  10.077
  923   HG23  ILE 561          HG23      ILE 561  59.146  16.060   8.842
  924   HD11  ILE 561          HD11      ILE 561  62.283  17.797   9.328
  925   HD12  ILE 561          HD12      ILE 561  62.547  17.741   7.584
  926   HD13  ILE 561          HD13      ILE 561  61.701  16.417   8.394
  927    H    THR 562           HN       THR 562  56.599  17.066   9.481
  928    HA   THR 562           HA       THR 562  55.807  18.167  12.152
  929    HB   THR 562           HB       THR 562  53.921  16.714  10.308
  930    HG1  THR 562           HG1      THR 562  54.073  19.507  10.690
  931   HG21  THR 562          HG21      THR 562  52.235  17.616  11.789
  932   HG22  THR 562          HG22      THR 562  53.440  18.596  12.627
  933   HG23  THR 562          HG23      THR 562  53.472  16.838  12.780
  934    H    ALA 563           HN       ALA 563  55.362  16.730  13.727
  935    HA   ALA 563           HA       ALA 563  56.083  13.875  13.206
  936    HB1  ALA 563           HB1      ALA 563  56.604  15.431  15.736
  937    HB2  ALA 563           HB2      ALA 563  57.792  15.296  14.435
  938    HB3  ALA 563           HB3      ALA 563  57.245  13.847  15.294
  939    H    MET 564           HN       MET 564  55.475  13.991  16.308
  940    HA   MET 564           HA       MET 564  52.884  12.783  16.164
  941    HB2  MET 564           HB2      MET 564  53.987  14.060  18.654
  942    HB3  MET 564           HB1      MET 564  53.091  12.550  18.486
  943    HG2  MET 564           HG2      MET 564  55.133  11.731  17.109
  944    HG3  MET 564           HG1      MET 564  55.971  13.113  17.812
  945    HE1  MET 564           HE1      MET 564  54.251   9.425  19.880
  946    HE2  MET 564           HE2      MET 564  55.138   9.370  18.359
  947    HE3  MET 564           HE3      MET 564  53.625  10.268  18.456
  948    H    ALA 565           HN       ALA 565  53.254  15.505  15.109
  949    HA   ALA 565           HA       ALA 565  51.447  17.084  14.725
  950    HB1  ALA 565           HB1      ALA 565  51.090  17.151  17.734
  951    HB2  ALA 565           HB2      ALA 565  50.082  16.155  16.675
  952    HB3  ALA 565           HB3      ALA 565  50.076  17.907  16.510
  953    H    LYS 566           HN       LYS 566  54.227  16.753  16.508
  954    HA   LYS 566           HA       LYS 566  54.620  19.585  17.159
  955    HB2  LYS 566           HB2      LYS 566  56.654  17.342  17.053
  956    HB3  LYS 566           HB1      LYS 566  56.815  18.870  17.896
  957    HG2  LYS 566           HG2      LYS 566  54.681  16.815  18.526
  958    HG3  LYS 566           HG1      LYS 566  56.211  16.931  19.380
  959    HD2  LYS 566           HD2      LYS 566  55.103  18.358  20.792
  960    HD3  LYS 566           HD1      LYS 566  55.328  19.556  19.521
  961    HE2  LYS 566           HE2      LYS 566  53.022  19.679  19.885
  962    HE3  LYS 566           HE1      LYS 566  53.093  18.521  18.558
  963    HZ1  LYS 566           HZ1      LYS 566  53.347  17.384  21.209
  964    HZ2  LYS 566           HZ2      LYS 566  52.452  16.840  19.871
  965    HZ3  LYS 566           HZ3      LYS 566  51.834  18.070  20.866
  966    H    LYS 567           HN       LYS 567  56.080  20.970  16.010
  967    HA   LYS 567           HA       LYS 567  56.462  20.179  13.162
  968    HB2  LYS 567           HB2      LYS 567  57.096  22.906  14.224
  969    HB3  LYS 567           HB1      LYS 567  56.476  22.454  12.649
  970    HG2  LYS 567           HG2      LYS 567  54.931  22.387  15.265
  971    HG3  LYS 567           HG1      LYS 567  54.720  23.554  13.969
  972    HD2  LYS 567           HD2      LYS 567  54.258  20.554  13.647
  973    HD3  LYS 567           HD1      LYS 567  52.991  21.742  13.949
  974    HE2  LYS 567           HE2      LYS 567  53.876  22.977  11.871
  975    HE3  LYS 567           HE1      LYS 567  54.753  21.491  11.516
  976    HZ1  LYS 567           HZ1      LYS 567  52.745  20.276  11.415
  977    HZ2  LYS 567           HZ2      LYS 567  52.509  21.672  10.476
  978    HZ3  LYS 567           HZ3      LYS 567  51.838  21.570  12.033
  979    H    PHE 568           HN       PHE 568  58.664  21.172  12.235
  980    HA   PHE 568           HA       PHE 568  60.850  21.101  14.201
  981    HB2  PHE 568           HB2      PHE 568  60.021  18.691  12.721
  982    HB3  PHE 568           HB1      PHE 568  61.717  19.053  12.467
  983    HD1  PHE 568           HD1      PHE 568  62.886  19.931  14.809
  984    HD2  PHE 568           HD2      PHE 568  59.575  17.210  14.480
  985    HE1  PHE 568           HE1      PHE 568  63.427  19.000  17.043
  986    HE2  PHE 568           HE2      PHE 568  60.118  16.281  16.714
  987    HZ   PHE 568           HZ       PHE 568  62.043  17.176  17.995
  988    H    HIS 569           HN       HIS 569  62.564  22.228  13.427
  989    HA   HIS 569           HA       HIS 569  62.458  23.682  11.000
  990    HB2  HIS 569           HB2      HIS 569  64.636  22.888  12.885
  991    HB3  HIS 569           HB1      HIS 569  65.103  23.587  11.348
  992    HD2  HIS 569           HD2      HIS 569  63.429  26.196  11.003
  993    HE1  HIS 569           HE1      HIS 569  64.057  26.987  15.098
  994    HA   PRO 570           HA       PRO 570  62.845  19.898   8.463
  995    HB2  PRO 570           HB2      PRO 570  63.817  21.871   6.438
  996    HB3  PRO 570           HB1      PRO 570  62.565  20.627   6.285
  997    HG2  PRO 570           HG2      PRO 570  61.964  23.270   6.558
  998    HG3  PRO 570           HG1      PRO 570  60.916  21.986   7.169
  999    HD2  PRO 570           HD2      PRO 570  62.607  23.884   8.695
 1000    HD3  PRO 570           HD1      PRO 570  61.204  22.931   9.239
 1001    H    GLU 571           HN       GLU 571  65.273  22.092   9.436
 1002    HA   GLU 571           HA       GLU 571  67.471  20.462   8.280
 1003    HB2  GLU 571           HB2      GLU 571  67.870  22.937   9.947
 1004    HB3  GLU 571           HB1      GLU 571  68.860  22.309   8.631
 1005    HG2  GLU 571           HG2      GLU 571  66.885  22.768   7.095
 1006    HG3  GLU 571           HG1      GLU 571  66.164  23.648   8.446
 1007    H    HIS 572           HN       HIS 572  66.540  21.887  11.418
 1008    HA   HIS 572           HA       HIS 572  68.463  20.512  12.970
 1009    HB2  HIS 572           HB2      HIS 572  65.664  21.194  13.913
 1010    HB3  HIS 572           HB1      HIS 572  67.110  21.024  14.907
 1011    HD2  HIS 572           HD2      HIS 572  68.869  22.753  12.426
 1012    HE1  HIS 572           HE1      HIS 572  66.676  25.980  14.014
 1013    H    PHE 573           HN       PHE 573  66.040  19.156  11.134
 1014    HA   PHE 573           HA       PHE 573  66.169  16.611  12.731
 1015    HB2  PHE 573           HB2      PHE 573  63.874  17.854  12.567
 1016    HB3  PHE 573           HB1      PHE 573  63.881  17.308  10.894
 1017    HD1  PHE 573           HD1      PHE 573  64.314  16.046  14.392
 1018    HD2  PHE 573           HD2      PHE 573  63.128  15.138  10.364
 1019    HE1  PHE 573           HE1      PHE 573  63.530  13.810  15.126
 1020    HE2  PHE 573           HE2      PHE 573  62.345  12.902  11.098
 1021    HZ   PHE 573           HZ       PHE 573  62.546  12.239  13.479
 1022    H    VAL 574           HN       VAL 574  68.149  17.096  10.999
 1023    HA   VAL 574           HA       VAL 574  67.470  16.032   8.345
 1024    HB   VAL 574           HB       VAL 574  69.937  16.347   7.921
 1025   HG11  VAL 574          HG11      VAL 574  67.851  18.287   8.072
 1026   HG12  VAL 574          HG12      VAL 574  69.304  18.346   7.094
 1027   HG13  VAL 574          HG13      VAL 574  69.310  19.067   8.683
 1028   HG21  VAL 574          HG21      VAL 574  70.624  16.154  10.293
 1029   HG22  VAL 574          HG22      VAL 574  69.799  17.675  10.651
 1030   HG23  VAL 574          HG23      VAL 574  71.197  17.662   9.578
 1031    H    CYS 575           HN       CYS 575  69.255  14.397   7.514
 1032    HA   CYS 575           HA       CYS 575  69.154  12.003   9.210
 1033    HB2  CYS 575           HB2      CYS 575  69.171  11.132   7.105
 1034    HB3  CYS 575           HB1      CYS 575  69.711  12.662   6.430
 1035    H    ALA 576           HN       ALA 576  70.983  11.055  10.326
 1036    HA   ALA 576           HA       ALA 576  73.167  13.066  10.698
 1037    HB1  ALA 576           HB1      ALA 576  73.756  11.844  12.629
 1038    HB2  ALA 576           HB2      ALA 576  73.021  10.356  12.032
 1039    HB3  ALA 576           HB3      ALA 576  71.999  11.686  12.578
 1040    H    PHE 577           HN       PHE 577  73.742  12.678   8.425
 1041    HA   PHE 577           HA       PHE 577  76.139  11.062   8.289
 1042    HB2  PHE 577           HB2      PHE 577  74.166   9.610   7.246
 1043    HB3  PHE 577           HB1      PHE 577  74.314  10.716   5.893
 1044    HD1  PHE 577           HD1      PHE 577  74.898   7.688   5.800
 1045    HD2  PHE 577           HD2      PHE 577  77.508  11.058   6.487
 1046    HE1  PHE 577           HE1      PHE 577  76.828   6.402   4.970
 1047    HE2  PHE 577           HE2      PHE 577  79.398   9.741   5.664
 1048    HZ   PHE 577           HZ       PHE 577  79.073   7.429   4.904
 1049    H    CYS 578           HN       CYS 578  73.816  12.558   6.179
 1050    HA   CYS 578           HA       CYS 578  75.711  14.718   5.365
 1051    HB2  CYS 578           HB2      CYS 578  74.193  14.922   3.382
 1052    HB3  CYS 578           HB1      CYS 578  74.945  13.340   3.472
 1053    H    LEU 579           HN       LEU 579  75.131  15.820   7.296
 1054    HA   LEU 579           HA       LEU 579  72.609  16.309   8.326
 1055    HB2  LEU 579           HB2      LEU 579  73.946  18.667   8.932
 1056    HB3  LEU 579           HB1      LEU 579  74.068  17.170   9.839
 1057    HG   LEU 579           HG       LEU 579  76.253  18.291   9.135
 1058   HD11  LEU 579          HD11      LEU 579  75.514  15.426   8.977
 1059   HD12  LEU 579          HD12      LEU 579  76.770  16.227   9.908
 1060   HD13  LEU 579          HD13      LEU 579  77.052  15.841   8.216
 1061   HD21  LEU 579          HD21      LEU 579  76.852  18.550   6.990
 1062   HD22  LEU 579          HD22      LEU 579  75.159  18.311   6.592
 1063   HD23  LEU 579          HD23      LEU 579  76.282  16.955   6.516
 1064    H    LYS 580           HN       LYS 580  72.926  17.008   5.162
 1065    HA   LYS 580           HA       LYS 580  72.016  19.821   5.352
 1066    HB2  LYS 580           HB2      LYS 580  72.449  20.002   3.103
 1067    HB3  LYS 580           HB1      LYS 580  73.485  18.636   3.472
 1068    HG2  LYS 580           HG2      LYS 580  70.653  18.349   2.382
 1069    HG3  LYS 580           HG1      LYS 580  72.099  18.360   1.391
 1070    HD2  LYS 580           HD2      LYS 580  72.847  16.311   2.173
 1071    HD3  LYS 580           HD1      LYS 580  71.980  16.447   3.700
 1072    HE2  LYS 580           HE2      LYS 580  71.056  14.776   1.974
 1073    HE3  LYS 580           HE1      LYS 580  69.911  15.901   2.702
 1074    HZ1  LYS 580           HZ1      LYS 580  70.574  17.367   0.678
 1075    HZ2  LYS 580           HZ2      LYS 580  69.425  16.128   0.492
 1076    HZ3  LYS 580           HZ3      LYS 580  71.030  15.886  -0.012
 1077    H    GLN 581           HN       GLN 581  70.386  16.671   4.517
 1078    HA   GLN 581           HA       GLN 581  67.930  17.954   5.348
 1079    HB2  GLN 581           HB2      GLN 581  68.264  18.848   3.048
 1080    HB3  GLN 581           HB1      GLN 581  67.997  17.217   2.437
 1081    HG2  GLN 581           HG2      GLN 581  65.869  18.281   2.361
 1082    HG3  GLN 581           HG1      GLN 581  65.802  17.262   3.784
 1083   HE21  GLN 581          HE21      GLN 581  66.299  18.409   5.919
 1084   HE22  GLN 581          HE22      GLN 581  65.865  20.035   6.050
 1085    H    LEU 582           HN       LEU 582  66.289  16.686   5.839
 1086    HA   LEU 582           HA       LEU 582  66.283  13.840   4.989
 1087    HB2  LEU 582           HB2      LEU 582  67.273  14.166   7.299
 1088    HB3  LEU 582           HB1      LEU 582  65.691  14.724   7.815
 1089    HG   LEU 582           HG       LEU 582  64.729  12.549   7.165
 1090   HD11  LEU 582          HD11      LEU 582  65.913  11.517   5.494
 1091   HD12  LEU 582          HD12      LEU 582  66.752  10.755   6.842
 1092   HD13  LEU 582          HD13      LEU 582  67.460  12.159   6.038
 1093   HD21  LEU 582          HD21      LEU 582  67.021  12.704   9.103
 1094   HD22  LEU 582          HD22      LEU 582  66.183  11.175   8.871
 1095   HD23  LEU 582          HD23      LEU 582  65.299  12.597   9.424
 1096    H    ASN 583           HN       ASN 583  64.017  12.900   5.570
 1097    HA   ASN 583           HA       ASN 583  61.891  14.984   5.677
 1098    HB2  ASN 583           HB2      ASN 583  62.385  13.083   3.377
 1099    HB3  ASN 583           HB1      ASN 583  60.765  13.684   3.714
 1100   HD21  ASN 583          HD21      ASN 583  61.870  14.396   1.301
 1101   HD22  ASN 583          HD22      ASN 583  62.316  16.029   1.316
 1102    H    LYS 584           HN       LYS 584  60.284  14.298   6.974
 1103    HA   LYS 584           HA       LYS 584  60.335  11.947   8.479
 1104    HB2  LYS 584           HB2      LYS 584  57.862  12.342   8.770
 1105    HB3  LYS 584           HB1      LYS 584  58.864  13.753   9.116
 1106    HG2  LYS 584           HG2      LYS 584  58.480  14.609   6.838
 1107    HG3  LYS 584           HG1      LYS 584  57.493  13.202   6.466
 1108    HD2  LYS 584           HD2      LYS 584  56.902  15.387   8.486
 1109    HD3  LYS 584           HD1      LYS 584  56.017  15.041   7.003
 1110    HE2  LYS 584           HE2      LYS 584  55.648  12.678   8.070
 1111    HE3  LYS 584           HE1      LYS 584  56.060  13.492   9.580
 1112    HZ1  LYS 584           HZ1      LYS 584  53.684  13.707   7.964
 1113    HZ2  LYS 584           HZ2      LYS 584  54.318  15.206   8.453
 1114    HZ3  LYS 584           HZ3      LYS 584  53.910  14.034   9.613
 1115    H    GLY 585           HN       GLY 585  59.319  12.420   5.209
 1116    HA2  GLY 585           HA2      GLY 585  57.806   9.903   5.079
 1117    HA3  GLY 585           HA1      GLY 585  58.111  11.009   3.742
 1118    H    THR 586           HN       THR 586  61.001  10.998   4.713
 1119    HA   THR 586           HA       THR 586  61.832   8.319   3.675
 1120    HB   THR 586           HB       THR 586  63.291   9.249   2.100
 1121    HG1  THR 586           HG1      THR 586  64.194  11.199   2.335
 1122   HG21  THR 586          HG21      THR 586  61.983  10.832   0.803
 1123   HG22  THR 586          HG22      THR 586  61.075  11.322   2.237
 1124   HG23  THR 586          HG23      THR 586  60.866   9.702   1.571
 1125    H    PHE 587           HN       PHE 587  61.685   9.633   6.373
 1126    HA   PHE 587           HA       PHE 587  64.556   9.949   7.040
 1127    HB2  PHE 587           HB2      PHE 587  63.910  10.784   9.113
 1128    HB3  PHE 587           HB1      PHE 587  62.646  11.361   8.055
 1129    HD1  PHE 587           HD1      PHE 587  60.852   9.061   7.736
 1130    HD2  PHE 587           HD2      PHE 587  62.991  10.379  11.222
 1131    HE1  PHE 587           HE1      PHE 587  59.174   7.961   9.179
 1132    HE2  PHE 587           HE2      PHE 587  61.312   9.270  12.664
 1133    HZ   PHE 587           HZ       PHE 587  59.404   8.061  11.645
 1134    H    LYS 588           HN       LYS 588  65.654   8.147   7.180
 1135    HA   LYS 588           HA       LYS 588  64.456   5.710   8.387
 1136    HB2  LYS 588           HB2      LYS 588  66.069   6.167   6.122
 1137    HB3  LYS 588           HB1      LYS 588  67.178   5.525   7.289
 1138    HG2  LYS 588           HG2      LYS 588  66.126   3.793   5.804
 1139    HG3  LYS 588           HG1      LYS 588  65.952   3.490   7.519
 1140    HD2  LYS 588           HD2      LYS 588  63.912   3.132   5.910
 1141    HD3  LYS 588           HD1      LYS 588  63.650   3.853   7.479
 1142    HE2  LYS 588           HE2      LYS 588  63.217   5.962   6.569
 1143    HE3  LYS 588           HE1      LYS 588  64.197   5.655   5.153
 1144    HZ1  LYS 588           HZ1      LYS 588  62.125   3.785   5.221
 1145    HZ2  LYS 588           HZ2      LYS 588  62.412   5.002   4.070
 1146    HZ3  LYS 588           HZ3      LYS 588  61.454   5.328   5.435
 1147    H    GLU 589           HN       GLU 589  66.055   4.492   9.881
 1148    HA   GLU 589           HA       GLU 589  67.904   6.297  11.324
 1149    HB2  GLU 589           HB2      GLU 589  66.001   6.938  12.511
 1150    HB3  GLU 589           HB1      GLU 589  65.271   5.341  12.426
 1151    HG2  GLU 589           HG2      GLU 589  66.759   4.480  14.090
 1152    HG3  GLU 589           HG1      GLU 589  67.807   5.900  13.997
 1153    H    GLN 590           HN       GLN 590  69.161   5.243  12.865
 1154    HA   GLN 590           HA       GLN 590  69.125   2.312  13.063
 1155    HB2  GLN 590           HB2      GLN 590  70.542   3.150  10.988
 1156    HB3  GLN 590           HB1      GLN 590  71.704   3.639  12.203
 1157    HG2  GLN 590           HG2      GLN 590  72.505   1.502  12.084
 1158    HG3  GLN 590           HG1      GLN 590  71.075   1.041  13.001
 1159   HE21  GLN 590          HE21      GLN 590  70.518  -0.943  11.985
 1160   HE22  GLN 590          HE22      GLN 590  70.216  -1.100  10.320
 1161    H    ASN 591           HN       ASN 591  70.164   1.704  15.023
 1162    HA   ASN 591           HA       ASN 591  70.691   2.125  17.266
 1163    HB2  ASN 591           HB2      ASN 591  72.899   3.685  17.273
 1164    HB3  ASN 591           HB1      ASN 591  72.933   2.003  16.779
 1165   HD21  ASN 591          HD21      ASN 591  72.265   1.769  14.335
 1166   HD22  ASN 591          HD22      ASN 591  73.018   2.851  13.275
 1167    H    ASP 592           HN       ASP 592  68.753   4.052  16.054
 1168    HA   ASP 592           HA       ASP 592  67.495   5.794  17.039
 1169    HB2  ASP 592           HB2      ASP 592  69.826   6.606  18.756
 1170    HB3  ASP 592           HB1      ASP 592  68.103   6.803  19.057
 1171    H    LYS 593           HN       LYS 593  70.438   6.039  15.456
 1172    HA   LYS 593           HA       LYS 593  70.534   8.956  15.310
 1173    HB2  LYS 593           HB2      LYS 593  72.079   6.832  13.846
 1174    HB3  LYS 593           HB1      LYS 593  72.459   8.547  13.883
 1175    HG2  LYS 593           HG2      LYS 593  72.402   8.147  16.521
 1176    HG3  LYS 593           HG1      LYS 593  72.746   6.487  16.046
 1177    HD2  LYS 593           HD2      LYS 593  74.719   7.223  14.789
 1178    HD3  LYS 593           HD1      LYS 593  74.363   8.905  15.180
 1179    HE2  LYS 593           HE2      LYS 593  74.459   8.108  17.663
 1180    HE3  LYS 593           HE1      LYS 593  75.302   6.702  17.010
 1181    HZ1  LYS 593           HZ1      LYS 593  77.134   7.889  16.676
 1182    HZ2  LYS 593           HZ2      LYS 593  76.428   9.104  17.630
 1183    HZ3  LYS 593           HZ3      LYS 593  76.289   9.160  15.938
 1184    HA   PRO 594           HA       PRO 594  67.477   8.768  11.881
 1185    HB2  PRO 594           HB2      PRO 594  68.623  11.462  11.324
 1186    HB3  PRO 594           HB1      PRO 594  66.936  10.981  11.511
 1187    HG2  PRO 594           HG2      PRO 594  68.294  12.363  13.419
 1188    HG3  PRO 594           HG1      PRO 594  66.999  11.221  13.813
 1189    HD2  PRO 594           HD2      PRO 594  69.934  10.927  14.212
 1190    HD3  PRO 594           HD1      PRO 594  68.593  10.104  15.045
 1191    H    TYR 595           HN       TYR 595  67.629   8.893   9.480
 1192    HA   TYR 595           HA       TYR 595  70.186   9.264   8.158
 1193    HB2  TYR 595           HB2      TYR 595  69.281   6.477   8.870
 1194    HB3  TYR 595           HB1      TYR 595  70.204   6.750   7.402
 1195    HD1  TYR 595           HD1      TYR 595  70.525   5.818  10.739
 1196    HD2  TYR 595           HD2      TYR 595  72.327   8.377   7.807
 1197    HE1  TYR 595           HE1      TYR 595  72.672   5.728  11.972
 1198    HE2  TYR 595           HE2      TYR 595  74.474   8.290   9.064
 1199    HH   TYR 595           HH       TYR 595  74.906   6.157  11.816
 1200    H    CYS 596           HN       CYS 596  69.808   9.454   5.922
 1201    HA   CYS 596           HA       CYS 596  67.052   9.328   4.960
 1202    HB2  CYS 596           HB2      CYS 596  69.489   9.265   3.162
 1203    HB3  CYS 596           HB1      CYS 596  67.902   9.945   2.828
 1204    H    GLN 597           HN       GLN 597  66.331   7.651   3.340
 1205    HA   GLN 597           HA       GLN 597  67.155   5.063   4.194
 1206    HB2  GLN 597           HB2      GLN 597  65.053   4.984   3.197
 1207    HB3  GLN 597           HB1      GLN 597  65.494   6.128   1.965
 1208    HG2  GLN 597           HG2      GLN 597  65.330   4.154   0.728
 1209    HG3  GLN 597           HG1      GLN 597  67.038   4.177   1.105
 1210   HE21  GLN 597          HE21      GLN 597  66.396   3.536   4.011
 1211   HE22  GLN 597          HE22      GLN 597  66.045   1.893   4.016
 1212    H    ASN 598           HN       ASN 598  67.887   6.824   1.182
 1213    HA   ASN 598           HA       ASN 598  69.754   5.100   0.058
 1214    HB2  ASN 598           HB2      ASN 598  70.427   8.026   0.105
 1215    HB3  ASN 598           HB1      ASN 598  70.429   6.901  -1.246
 1216   HD21  ASN 598          HD21      ASN 598  67.987   5.887  -1.413
 1217   HD22  ASN 598          HD22      ASN 598  66.794   7.081  -1.537
 1218    H    CYS 599           HN       CYS 599  70.123   7.176   2.862
 1219    HA   CYS 599           HA       CYS 599  73.005   6.736   3.069
 1220    HB2  CYS 599           HB2      CYS 599  70.929   7.971   4.896
 1221    HB3  CYS 599           HB1      CYS 599  72.605   7.772   5.380
 1222    H    PHE 600           HN       PHE 600  70.174   5.807   5.028
 1223    HA   PHE 600           HA       PHE 600  71.474   3.935   6.722
 1224    HB2  PHE 600           HB2      PHE 600  69.353   4.613   7.453
 1225    HB3  PHE 600           HB1      PHE 600  68.643   4.444   5.857
 1226    HD1  PHE 600           HD1      PHE 600  67.989   2.197   5.001
 1227    HD2  PHE 600           HD2      PHE 600  69.510   2.764   8.968
 1228    HE1  PHE 600           HE1      PHE 600  67.154  -0.048   5.640
 1229    HE2  PHE 600           HE2      PHE 600  68.677   0.519   9.613
 1230    HZ   PHE 600           HZ       PHE 600  67.497  -0.887   7.948
 1231    H    LEU 601           HN       LEU 601  69.503   3.299   3.803
 1232    HA   LEU 601           HA       LEU 601  69.806   0.529   3.762
 1233    HB2  LEU 601           HB2      LEU 601  68.607   0.749   1.845
 1234    HB3  LEU 601           HB1      LEU 601  68.721   2.480   2.083
 1235    HG   LEU 601           HG       LEU 601  70.870   2.438   0.743
 1236   HD11  LEU 601          HD11      LEU 601  71.802   0.413   0.329
 1237   HD12  LEU 601          HD12      LEU 601  70.490   0.096  -0.797
 1238   HD13  LEU 601          HD13      LEU 601  70.362  -0.441   0.875
 1239   HD21  LEU 601          HD21      LEU 601  68.404   1.393  -0.672
 1240   HD22  LEU 601          HD22      LEU 601  69.700   2.349  -1.391
 1241   HD23  LEU 601          HD23      LEU 601  68.639   3.070  -0.181
 1242    H    LYS 602           HN       LYS 602  72.032   2.974   2.437
 1243    HA   LYS 602           HA       LYS 602  73.833   1.129   1.275
 1244    HB2  LYS 602           HB2      LYS 602  73.859   3.968   1.972
 1245    HB3  LYS 602           HB1      LYS 602  75.444   3.255   2.243
 1246    HG2  LYS 602           HG2      LYS 602  74.972   2.220  -0.209
 1247    HG3  LYS 602           HG1      LYS 602  73.941   3.641  -0.330
 1248    HD2  LYS 602           HD2      LYS 602  75.968   4.495  -1.098
 1249    HD3  LYS 602           HD1      LYS 602  76.081   4.883   0.618
 1250    HE2  LYS 602           HE2      LYS 602  78.168   3.851   0.177
 1251    HE3  LYS 602           HE1      LYS 602  77.206   2.523   0.824
 1252    HZ1  LYS 602           HZ1      LYS 602  78.070   3.027  -1.924
 1253    HZ2  LYS 602           HZ2      LYS 602  76.570   2.265  -1.692
 1254    HZ3  LYS 602           HZ3      LYS 602  77.986   1.567  -1.066
 1255    H    LEU 603           HN       LEU 603  73.243   1.777   4.623
 1256    HA   LEU 603           HA       LEU 603  75.859   0.632   5.426
 1257    HB2  LEU 603           HB2      LEU 603  73.705   1.202   7.428
 1258    HB3  LEU 603           HB1      LEU 603  75.444   1.467   7.545
 1259    HG   LEU 603           HG       LEU 603  73.487   3.076   5.899
 1260   HD11  LEU 603          HD11      LEU 603  73.703   4.780   7.480
 1261   HD12  LEU 603          HD12      LEU 603  75.191   4.108   8.139
 1262   HD13  LEU 603          HD13      LEU 603  73.646   3.334   8.486
 1263   HD21  LEU 603          HD21      LEU 603  75.604   4.573   5.678
 1264   HD22  LEU 603          HD22      LEU 603  75.508   3.146   4.658
 1265   HD23  LEU 603          HD23      LEU 603  76.499   3.120   6.114
 1266    H    PHE 604           HN       PHE 604  72.425  -0.111   6.130
 1267    HA   PHE 604           HA       PHE 604  73.223  -2.952   6.637
 1268    HB2  PHE 604           HB2      PHE 604  71.008  -1.181   7.659
 1269    HB3  PHE 604           HB1      PHE 604  70.759  -2.925   7.626
 1270    HD1  PHE 604           HD1      PHE 604  72.824  -0.187   9.060
 1271    HD2  PHE 604           HD2      PHE 604  71.978  -4.405   9.087
 1272    HE1  PHE 604           HE1      PHE 604  74.142  -0.441  11.142
 1273    HE2  PHE 604           HE2      PHE 604  73.298  -4.652  11.171
 1274    HZ   PHE 604           HZ       PHE 604  74.379  -2.672  12.198
 1275    H    CYS 605           HN       CYS 605  72.849  -1.829   3.923
 1276    HA   CYS 605           HA       CYS 605  70.440  -2.260   2.644
 1277    HB2  CYS 605           HB2      CYS 605  72.286  -1.680   1.255
 1278    HB3  CYS 605           HB1      CYS 605  73.234  -3.060   1.802
 1279    HG   CYS 605           HG       CYS 605  71.410  -3.101  -0.554
  Start of MODEL   13
    1    H    MET   1           HT1      MET   1  90.616 -26.462  10.503
    2    HA   MET   1           HA       MET   1  89.433 -28.696  12.003
    3    HB2  MET   1           HB2      MET   1  91.923 -28.358  10.294
    4    HB3  MET   1           HB1      MET   1  91.371 -29.877  11.003
    5    HG2  MET   1           HG2      MET   1  89.231 -29.554   9.785
    6    HG3  MET   1           HG1      MET   1  89.977 -28.198   8.957
    7    HE1  MET   1           HE1      MET   1  91.101 -28.347   6.861
    8    HE2  MET   1           HE2      MET   1  92.357 -29.525   6.492
    9    HE3  MET   1           HE3      MET   1  92.506 -28.509   7.924
   10    H    ALA   2           HN       ALA   2  92.633 -28.909  11.846
   11    HA   ALA   2           HA       ALA   2  93.397 -27.403  14.259
   12    HB1  ALA   2           HB1      ALA   2  92.250 -29.365  15.237
   13    HB2  ALA   2           HB2      ALA   2  93.980 -29.406  15.579
   14    HB3  ALA   2           HB3      ALA   2  93.306 -30.435  14.315
   15    H    LEU   3           HN       LEU   3  94.236 -30.083  12.081
   16    HA   LEU   3           HA       LEU   3  97.013 -30.112  12.346
   17    HB2  LEU   3           HB2      LEU   3  95.184 -30.498   9.990
   18    HB3  LEU   3           HB1      LEU   3  96.929 -30.633   9.791
   19    HG   LEU   3           HG       LEU   3  95.250 -32.249  11.721
   20   HD11  LEU   3          HD11      LEU   3  95.883 -34.081  10.102
   21   HD12  LEU   3          HD12      LEU   3  96.533 -32.823   9.044
   22   HD13  LEU   3          HD13      LEU   3  94.811 -32.850   9.431
   23   HD21  LEU   3          HD21      LEU   3  97.591 -33.594  11.526
   24   HD22  LEU   3          HD22      LEU   3  97.325 -32.349  12.740
   25   HD23  LEU   3          HD23      LEU   3  98.197 -31.957  11.258
   26    H    ASP   4           HN       ASP   4  95.360 -28.608   9.700
   27    HA   ASP   4           HA       ASP   4  95.728 -26.796   8.382
   28    HB2  ASP   4           HB2      ASP   4  96.697 -24.727   9.359
   29    HB3  ASP   4           HB1      ASP   4  95.378 -25.406  10.280
   30    H    GLY   5           HN       GLY   5  98.545 -27.738  10.179
   31    HA2  GLY   5           HA2      GLY   5 100.414 -28.801   8.951
   32    HA3  GLY   5           HA1      GLY   5 100.089 -27.671   7.640
   33    H    ILE   6           HN       ILE   6  99.567 -25.705   9.892
   34    HA   ILE   6           HA       ILE   6 102.407 -24.890  10.330
   35    HB   ILE   6           HB       ILE   6 100.861 -22.583  10.623
   36   HG12  ILE   6          HG12      ILE   6  98.936 -24.086   9.671
   37   HG13  ILE   6          HG11      ILE   6  99.172 -22.503   8.994
   38   HG21  ILE   6          HG21      ILE   6 101.662 -22.086   8.259
   39   HG22  ILE   6          HG22      ILE   6 102.345 -23.713   8.264
   40   HG23  ILE   6          HG23      ILE   6 102.901 -22.518   9.438
   41   HD11  ILE   6          HD11      ILE   6 100.658 -24.764   7.726
   42   HD12  ILE   6          HD12      ILE   6  99.995 -23.306   6.993
   43   HD13  ILE   6          HD13      ILE   6  98.925 -24.635   7.430
   44    H    ARG   7           HN       ARG   7 100.002 -23.053  12.032
   45    HA   ARG   7           HA       ARG   7 100.028 -24.787  14.373
   46    HB2  ARG   7           HB2      ARG   7 101.079 -22.955  15.788
   47    HB3  ARG   7           HB1      ARG   7 102.152 -23.860  14.741
   48    HG2  ARG   7           HG2      ARG   7 100.991 -21.408  13.520
   49    HG3  ARG   7           HG1      ARG   7 102.112 -21.137  14.855
   50    HD2  ARG   7           HD2      ARG   7 103.788 -22.557  13.694
   51    HD3  ARG   7           HD1      ARG   7 102.666 -22.729  12.350
   52    HE   ARG   7           HE       ARG   7 103.163 -20.505  11.695
   53   HH11  ARG   7          HH11      ARG   7 104.357 -18.596  11.882
   54   HH12  ARG   7          HH12      ARG   7 105.271 -18.299  13.323
   55   HH21  ARG   7          HH21      ARG   7 104.341 -21.273  14.845
   56   HH22  ARG   7          HH22      ARG   7 105.262 -19.814  15.000
   57    H    MET   8           HN       MET   8  99.839 -21.298  14.811
   58    HA   MET   8           HA       MET   8  96.855 -21.503  14.742
   59    HB2  MET   8           HB2      MET   8  97.755 -19.785  16.943
   60    HB3  MET   8           HB1      MET   8  96.601 -21.105  16.947
   61    HG2  MET   8           HG2      MET   8  98.521 -22.724  16.934
   62    HG3  MET   8           HG1      MET   8  99.618 -21.368  17.152
   63    HE1  MET   8           HE1      MET   8  98.985 -19.906  20.475
   64    HE2  MET   8           HE2      MET   8  97.808 -19.411  19.261
   65    HE3  MET   8           HE3      MET   8  99.481 -19.696  18.790
   66    HA   PRO   9           HA       PRO   9  97.877 -16.796  14.201
   67    HB2  PRO   9           HB2      PRO   9 100.762 -17.021  13.399
   68    HB3  PRO   9           HB1      PRO   9  99.943 -15.720  14.297
   69    HG2  PRO   9           HG2      PRO   9 101.443 -17.381  15.622
   70    HG3  PRO   9           HG1      PRO   9  99.818 -17.003  16.244
   71    HD2  PRO   9           HD2      PRO   9 100.670 -19.426  14.675
   72    HD3  PRO   9           HD1      PRO   9  99.771 -19.353  16.192
   73    H    ASP  10           HN       ASP  10  99.635 -19.220  12.396
   74    HA   ASP  10           HA       ASP  10  98.579 -18.148   9.810
   75    HB2  ASP  10           HB2      ASP  10 101.116 -18.549  10.176
   76    HB3  ASP  10           HB1      ASP  10 100.719 -20.265  10.112
   77    H    GLY  11           HN       GLY  11  98.604 -20.770  12.065
   78    HA2  GLY  11           HA2      GLY  11  97.213 -22.629  10.257
   79    HA3  GLY  11           HA1      GLY  11  97.616 -22.922  11.947
   80    H    CYS  12           HN       CYS  12  96.386 -19.973  12.114
   81    HA   CYS  12           HA       CYS  12  93.530 -20.524  11.831
   82    HB2  CYS  12           HB2      CYS  12  93.828 -21.657  13.929
   83    HB3  CYS  12           HB1      CYS  12  94.832 -20.353  14.559
   84    HG   CYS  12           HG       CYS  12  92.796 -18.991  15.064
   85    H    TYR  13           HN       TYR  13  94.413 -18.412  14.417
   86    HA   TYR  13           HA       TYR  13  94.944 -16.058  12.803
   87    HB2  TYR  13           HB2      TYR  13  92.170 -16.520  13.927
   88    HB3  TYR  13           HB1      TYR  13  92.779 -14.893  13.618
   89    HD1  TYR  13           HD1      TYR  13  90.953 -17.531  12.202
   90    HD2  TYR  13           HD2      TYR  13  93.993 -14.657  11.211
   91    HE1  TYR  13           HE1      TYR  13  90.402 -17.775   9.797
   92    HE2  TYR  13           HE2      TYR  13  93.439 -14.904   8.808
   93    HH   TYR  13           HH       TYR  13  91.508 -15.612   7.430
   94    H    ALA  14           HN       ALA  14  92.988 -15.211  15.402
   95    HA   ALA  14           HA       ALA  14  94.727 -15.633  17.627
   96    HB1  ALA  14           HB1      ALA  14  96.341 -14.202  16.635
   97    HB2  ALA  14           HB2      ALA  14  95.489 -13.174  17.786
   98    HB3  ALA  14           HB3      ALA  14  95.108 -13.077  16.066
   99    H    ASP  15           HN       ASP  15  92.407 -13.461  16.083
  100    HA   ASP  15           HA       ASP  15  90.804 -13.527  18.583
  101    HB2  ASP  15           HB2      ASP  15  92.260 -11.448  18.571
  102    HB3  ASP  15           HB1      ASP  15  91.380 -10.935  17.130
  103    H    GLY  16           HN       GLY  16  90.943 -13.962  15.326
  104    HA2  GLY  16           HA2      GLY  16  89.182 -14.415  13.803
  105    HA3  GLY  16           HA1      GLY  16  88.050 -13.980  15.068
  106    H    THR  17           HN       THR  17  90.637 -11.906  13.940
  107    HA   THR  17           HA       THR  17  88.807 -10.387  12.288
  108    HB   THR  17           HB       THR  17  87.820  -9.727  14.359
  109    HG1  THR  17           HG1      THR  17  87.909  -7.941  13.243
  110   HG21  THR  17          HG21      THR  17  90.671  -9.306  15.245
  111   HG22  THR  17          HG22      THR  17  89.415 -10.275  16.018
  112   HG23  THR  17          HG23      THR  17  89.319  -8.511  16.057
  113    H    TRP  18           HN       TRP  18  89.666  -8.170  12.047
  114    HA   TRP  18           HA       TRP  18  92.524  -7.708  12.203
  115    HB2  TRP  18           HB2      TRP  18  92.430  -7.601   9.507
  116    HB3  TRP  18           HB1      TRP  18  92.901  -9.055  10.369
  117    HD1  TRP  18           HD1      TRP  18  89.882  -7.484   8.591
  118    HE1  TRP  18           HE1      TRP  18  88.258  -9.378   7.914
  119    HE3  TRP  18           HE3      TRP  18  92.174 -11.468  10.823
  120    HZ2  TRP  18           HZ2      TRP  18  87.974 -12.191   8.270
  121    HZ3  TRP  18           HZ3      TRP  18  91.199 -13.736  10.639
  122    HH2  TRP  18           HH2      TRP  18  89.108 -14.105   9.366
  123    H    GLU  19           HN       GLU  19  92.732  -5.497  12.277
  124    HA   GLU  19           HA       GLU  19  90.403  -3.848  11.565
  125    HB2  GLU  19           HB2      GLU  19  92.423  -2.055  12.270
  126    HB3  GLU  19           HB1      GLU  19  91.222  -2.715  13.373
  127    HG2  GLU  19           HG2      GLU  19  93.521  -3.023  14.222
  128    HG3  GLU  19           HG1      GLU  19  92.704  -4.557  13.935
  129    H    LEU  20           HN       LEU  20  90.161  -2.678   9.785
  130    HA   LEU  20           HA       LEU  20  92.196  -2.933   7.686
  131    HB2  LEU  20           HB2      LEU  20  89.366  -2.610   7.760
  132    HB3  LEU  20           HB1      LEU  20  89.976  -1.132   7.027
  133    HG   LEU  20           HG       LEU  20  89.572  -2.673   5.250
  134   HD11  LEU  20          HD11      LEU  20  91.541  -2.453   4.138
  135   HD12  LEU  20          HD12      LEU  20  92.500  -3.173   5.425
  136   HD13  LEU  20          HD13      LEU  20  91.990  -1.486   5.542
  137   HD21  LEU  20          HD21      LEU  20  90.751  -4.656   7.155
  138   HD22  LEU  20          HD22      LEU  20  91.044  -4.932   5.444
  139   HD23  LEU  20          HD23      LEU  20  89.396  -4.824   6.044
  140    H    SER  21           HN       SER  21  93.609  -1.316   7.149
  141    HA   SER  21           HA       SER  21  93.786   0.968   8.953
  142    HB2  SER  21           HB2      SER  21  95.683  -0.395   7.665
  143    HB3  SER  21           HB1      SER  21  95.385   0.827   6.432
  144    HG   SER  21           HG       SER  21  95.952   1.324   9.174
  145    H    VAL  22           HN       VAL  22  93.432   3.125   8.426
  146    HA   VAL  22           HA       VAL  22  92.293   3.690   5.740
  147    HB   VAL  22           HB       VAL  22  90.937   4.219   8.382
  148   HG11  VAL  22          HG11      VAL  22  90.609   5.656   5.732
  149   HG12  VAL  22          HG12      VAL  22  90.844   6.370   7.330
  150   HG13  VAL  22          HG13      VAL  22  89.321   5.588   6.930
  151   HG21  VAL  22          HG21      VAL  22  89.937   3.194   5.714
  152   HG22  VAL  22          HG22      VAL  22  89.060   3.181   7.243
  153   HG23  VAL  22          HG23      VAL  22  90.472   2.145   7.032
  154    H    HIS  23           HN       HIS  23  93.538   5.183   4.903
  155    HA   HIS  23           HA       HIS  23  95.005   7.101   6.590
  156    HB2  HIS  23           HB2      HIS  23  94.909   6.383   3.664
  157    HB3  HIS  23           HB1      HIS  23  95.687   7.883   4.172
  158    HD1  HIS  23           HD1      HIS  23  95.772   4.378   5.701
  159    HD2  HIS  23           HD2      HIS  23  98.384   7.303   4.285
  160    HE1  HIS  23           HE1      HIS  23  98.114   3.513   6.124
  161    H    VAL  24           HN       VAL  24  93.589   8.698   7.377
  162    HA   VAL  24           HA       VAL  24  91.380   9.647   5.767
  163    HB   VAL  24           HB       VAL  24  92.547  11.337   7.973
  164   HG11  VAL  24          HG11      VAL  24  90.219  11.746   8.473
  165   HG12  VAL  24          HG12      VAL  24  89.710  10.418   7.436
  166   HG13  VAL  24          HG13      VAL  24  90.398  11.875   6.721
  167   HG21  VAL  24          HG21      VAL  24  91.266   8.611   8.290
  168   HG22  VAL  24          HG22      VAL  24  91.301   9.803   9.590
  169   HG23  VAL  24          HG23      VAL  24  92.810   9.161   8.943
  170    H    THR  25           HN       THR  25  91.861  10.605   3.858
  171    HA   THR  25           HA       THR  25  94.331  12.093   3.478
  172    HB   THR  25           HB       THR  25  93.373  12.521   1.203
  173    HG1  THR  25           HG1      THR  25  91.396  11.506   0.747
  174   HG21  THR  25          HG21      THR  25  93.185  10.034   0.608
  175   HG22  THR  25          HG22      THR  25  93.404   9.720   2.331
  176   HG23  THR  25          HG23      THR  25  94.671  10.539   1.415
  177    H    ASP  26           HN       ASP  26  90.886  12.952   3.792
  178    HA   ASP  26           HA       ASP  26  91.376  15.790   3.405
  179    HB2  ASP  26           HB2      ASP  26  89.069  16.081   4.164
  180    HB3  ASP  26           HB1      ASP  26  89.144  14.725   3.039
  181    H    LEU  27           HN       LEU  27  92.853  14.138   5.522
  182    HA   LEU  27           HA       LEU  27  92.761  16.183   7.627
  183    HB2  LEU  27           HB2      LEU  27  91.559  13.515   7.874
  184    HB3  LEU  27           HB1      LEU  27  92.695  13.845   9.166
  185    HG   LEU  27           HG       LEU  27  90.565  15.852   8.409
  186   HD11  LEU  27          HD11      LEU  27  90.331  13.429  10.197
  187   HD12  LEU  27          HD12      LEU  27  89.267  13.911   8.875
  188   HD13  LEU  27          HD13      LEU  27  89.281  14.836  10.377
  189   HD21  LEU  27          HD21      LEU  27  91.784  15.305  11.116
  190   HD22  LEU  27          HD22      LEU  27  91.000  16.776  10.543
  191   HD23  LEU  27          HD23      LEU  27  92.599  16.337   9.943
  192    H    ASN  28           HN       ASN  28  94.121  13.253   6.259
  193    HA   ASN  28           HA       ASN  28  96.392  12.725   5.914
  194    HB2  ASN  28           HB2      ASN  28  96.810  15.257   6.369
  195    HB3  ASN  28           HB1      ASN  28  97.267  14.738   7.986
  196   HD21  ASN  28          HD21      ASN  28  98.168  12.091   6.726
  197   HD22  ASN  28          HD22      ASN  28  99.704  12.440   6.105
  198    H    ARG  29           HN       ARG  29  94.478  12.049   8.340
  199    HA   ARG  29           HA       ARG  29  96.522  11.056  10.231
  200    HB2  ARG  29           HB2      ARG  29  93.505  10.933  10.308
  201    HB3  ARG  29           HB1      ARG  29  94.586  10.402  11.597
  202    HG2  ARG  29           HG2      ARG  29  95.459  12.653  11.856
  203    HG3  ARG  29           HG1      ARG  29  94.505  13.211  10.488
  204    HD2  ARG  29           HD2      ARG  29  93.163  13.845  12.295
  205    HD3  ARG  29           HD1      ARG  29  92.470  12.283  11.859
  206    HE   ARG  29           HE       ARG  29  94.116  12.858  14.255
  207   HH11  ARG  29          HH11      ARG  29  94.070  11.246  15.822
  208   HH12  ARG  29          HH12      ARG  29  93.366   9.708  15.451
  209   HH21  ARG  29          HH21      ARG  29  92.534  10.561  12.200
  210   HH22  ARG  29          HH22      ARG  29  92.499   9.323  13.409
  211    H    ASP  30           HN       ASP  30  95.714   8.814  11.127
  212    HA   ASP  30           HA       ASP  30  95.050   6.964   8.905
  213    HB2  ASP  30           HB2      ASP  30  97.398   6.738  10.801
  214    HB3  ASP  30           HB1      ASP  30  96.764   5.372   9.880
  215    H    VAL  31           HN       VAL  31  93.275   5.931   9.556
  216    HA   VAL  31           HA       VAL  31  92.917   5.366  12.485
  217    HB   VAL  31           HB       VAL  31  90.740   5.556  10.392
  218   HG11  VAL  31          HG11      VAL  31  89.346   5.869  12.441
  219   HG12  VAL  31          HG12      VAL  31  90.786   5.606  13.425
  220   HG13  VAL  31          HG13      VAL  31  90.165   4.307  12.408
  221   HG21  VAL  31          HG21      VAL  31  91.669   7.692  12.356
  222   HG22  VAL  31          HG22      VAL  31  90.326   7.833  11.223
  223   HG23  VAL  31          HG23      VAL  31  91.978   7.730  10.622
  224    H    THR  32           HN       THR  32  91.946   3.373  13.036
  225    HA   THR  32           HA       THR  32  91.926   1.271  10.918
  226    HB   THR  32           HB       THR  32  92.840   0.084  13.372
  227    HG1  THR  32           HG1      THR  32  94.722   1.304  13.715
  228   HG21  THR  32          HG21      THR  32  93.385  -0.451  10.882
  229   HG22  THR  32          HG22      THR  32  94.648  -0.688  12.087
  230   HG23  THR  32          HG23      THR  32  94.661   0.753  11.072
  231    H    LEU  33           HN       LEU  33  90.124   0.031  11.064
  232    HA   LEU  33           HA       LEU  33  88.414   0.218  13.516
  233    HB2  LEU  33           HB2      LEU  33  87.846   0.334  10.581
  234    HB3  LEU  33           HB1      LEU  33  86.650  -0.446  11.592
  235    HG   LEU  33           HG       LEU  33  86.357   2.068  11.111
  236   HD11  LEU  33          HD11      LEU  33  85.388   2.469  13.272
  237   HD12  LEU  33          HD12      LEU  33  86.413   1.246  14.020
  238   HD13  LEU  33          HD13      LEU  33  85.158   0.767  12.878
  239   HD21  LEU  33          HD21      LEU  33  88.823   2.537  11.669
  240   HD22  LEU  33          HD22      LEU  33  88.344   2.412  13.362
  241   HD23  LEU  33          HD23      LEU  33  87.627   3.637  12.342
  242    H    ARG  34           HN       ARG  34  88.476  -1.712  14.570
  243    HA   ARG  34           HA       ARG  34  89.367  -4.131  13.426
  244    HB2  ARG  34           HB2      ARG  34  89.405  -3.746  15.838
  245    HB3  ARG  34           HB1      ARG  34  87.642  -3.783  15.857
  246    HG2  ARG  34           HG2      ARG  34  89.240  -6.050  14.635
  247    HG3  ARG  34           HG1      ARG  34  88.934  -5.993  16.334
  248    HD2  ARG  34           HD2      ARG  34  86.417  -5.535  15.324
  249    HD3  ARG  34           HD1      ARG  34  87.082  -6.654  14.176
  250    HE   ARG  34           HE       ARG  34  87.057  -8.331  15.839
  251   HH11  ARG  34          HH11      ARG  34  86.514  -9.079  17.899
  252   HH12  ARG  34          HH12      ARG  34  86.132  -7.940  19.147
  253   HH21  ARG  34          HH21      ARG  34  86.598  -5.163  17.123
  254   HH22  ARG  34          HH22      ARG  34  86.180  -5.723  18.708
  255    H    VAL  35           HN       VAL  35  88.381  -5.620  12.341
  256    HA   VAL  35           HA       VAL  35  85.465  -5.863  12.258
  257    HB   VAL  35           HB       VAL  35  85.426  -5.527   9.742
  258   HG11  VAL  35          HG11      VAL  35  85.035  -3.194   9.896
  259   HG12  VAL  35          HG12      VAL  35  86.249  -2.984  11.154
  260   HG13  VAL  35          HG13      VAL  35  84.720  -3.785  11.524
  261   HG21  VAL  35          HG21      VAL  35  88.122  -4.273  10.322
  262   HG22  VAL  35          HG22      VAL  35  87.248  -4.130   8.799
  263   HG23  VAL  35          HG23      VAL  35  87.828  -5.706   9.338
  264    H    THR  36           HN       THR  36  85.110  -7.313  10.042
  265    HA   THR  36           HA       THR  36  87.198  -9.410   9.914
  266    HB   THR  36           HB       THR  36  85.091 -11.043  10.015
  267    HG1  THR  36           HG1      THR  36  84.304  -8.983  11.778
  268   HG21  THR  36          HG21      THR  36  85.418 -11.115  12.561
  269   HG22  THR  36          HG22      THR  36  86.560  -9.791  12.327
  270   HG23  THR  36          HG23      THR  36  86.846 -11.354  11.555
  271    H    GLY  37           HN       GLY  37  86.498 -10.968   8.060
  272    HA2  GLY  37           HA2      GLY  37  85.831  -9.294   5.790
  273    HA3  GLY  37           HA1      GLY  37  86.212 -11.008   5.719
  274    H    GLU  38           HN       GLU  38  83.750  -9.274   7.573
  275    HA   GLU  38           HA       GLU  38  81.599 -10.539   5.971
  276    HB2  GLU  38           HB2      GLU  38  80.524 -11.488   7.891
  277    HB3  GLU  38           HB1      GLU  38  82.193 -12.042   7.916
  278    HG2  GLU  38           HG2      GLU  38  82.051 -11.327  10.117
  279    HG3  GLU  38           HG1      GLU  38  82.505  -9.795   9.372
  280    H    VAL  39           HN       VAL  39  82.899  -7.811   7.276
  281    HA   VAL  39           HA       VAL  39  80.364  -6.626   8.205
  282    HB   VAL  39           HB       VAL  39  81.628  -4.798   8.953
  283   HG11  VAL  39          HG11      VAL  39  83.631  -7.025   9.143
  284   HG12  VAL  39          HG12      VAL  39  82.095  -7.087  10.003
  285   HG13  VAL  39          HG13      VAL  39  83.243  -5.798  10.348
  286   HG21  VAL  39          HG21      VAL  39  82.859  -4.158   6.992
  287   HG22  VAL  39          HG22      VAL  39  83.739  -5.692   6.981
  288   HG23  VAL  39          HG23      VAL  39  84.054  -4.502   8.237
  289    H    HIS  40           HN       HIS  40  79.136  -5.239   6.998
  290    HA   HIS  40           HA       HIS  40  79.677  -5.070   4.147
  291    HB2  HIS  40           HB2      HIS  40  77.672  -3.222   5.393
  292    HB3  HIS  40           HB1      HIS  40  77.530  -4.235   3.956
  293    HD1  HIS  40           HD1      HIS  40  77.362  -4.428   7.727
  294    HD2  HIS  40           HD2      HIS  40  76.472  -6.794   4.412
  295    HE1  HIS  40           HE1      HIS  40  76.090  -6.436   8.602
  296    H    ILE  41           HN       ILE  41  80.467  -3.262   2.999
  297    HA   ILE  41           HA       ILE  41  82.400  -1.604   4.143
  298    HB   ILE  41           HB       ILE  41  80.546  -0.959   1.831
  299   HG12  ILE  41          HG12      ILE  41  83.389  -1.999   1.766
  300   HG13  ILE  41          HG11      ILE  41  81.979  -3.060   1.722
  301   HG21  ILE  41          HG21      ILE  41  81.560   1.094   2.506
  302   HG22  ILE  41          HG22      ILE  41  82.517   0.507   1.145
  303   HG23  ILE  41          HG23      ILE  41  83.115   0.313   2.795
  304   HD11  ILE  41          HD11      ILE  41  83.041  -2.238  -0.536
  305   HD12  ILE  41          HD12      ILE  41  82.149  -0.755  -0.202
  306   HD13  ILE  41          HD13      ILE  41  81.287  -2.285  -0.363
  307    H    GLY  42           HN       GLY  42  79.043  -0.664   3.429
  308    HA2  GLY  42           HA2      GLY  42  79.092   1.868   4.671
  309    HA3  GLY  42           HA1      GLY  42  77.639   0.894   4.479
  310    H    GLY  43           HN       GLY  43  79.515  -1.158   6.012
  311    HA2  GLY  43           HA2      GLY  43  78.295  -0.671   8.616
  312    HA3  GLY  43           HA1      GLY  43  79.437  -1.963   8.223
  313    H    VAL  44           HN       VAL  44  81.297  -0.055   7.014
  314    HA   VAL  44           HA       VAL  44  82.735   0.741   9.451
  315    HB   VAL  44           HB       VAL  44  83.337   0.436   6.527
  316   HG11  VAL  44          HG11      VAL  44  84.766   2.396   8.338
  317   HG12  VAL  44          HG12      VAL  44  84.107   2.698   6.732
  318   HG13  VAL  44          HG13      VAL  44  85.542   1.690   6.920
  319   HG21  VAL  44          HG21      VAL  44  83.884  -1.199   8.420
  320   HG22  VAL  44          HG22      VAL  44  85.117  -0.038   8.926
  321   HG23  VAL  44          HG23      VAL  44  85.209  -0.787   7.330
  322    H    MET  45           HN       MET  45  81.161   2.291   6.643
  323    HA   MET  45           HA       MET  45  81.821   4.980   7.068
  324    HB2  MET  45           HB2      MET  45  79.214   3.681   6.244
  325    HB3  MET  45           HB1      MET  45  79.365   5.431   6.334
  326    HG2  MET  45           HG2      MET  45  81.492   5.033   4.814
  327    HG3  MET  45           HG1      MET  45  80.685   3.517   4.429
  328    HE1  MET  45           HE1      MET  45  78.560   3.293   2.917
  329    HE2  MET  45           HE2      MET  45  77.313   4.545   2.903
  330    HE3  MET  45           HE3      MET  45  77.818   3.829   4.433
  331    H    LEU  46           HN       LEU  46  79.597   2.915   8.830
  332    HA   LEU  46           HA       LEU  46  78.511   5.028  10.493
  333    HB2  LEU  46           HB2      LEU  46  77.590   2.614   9.970
  334    HB3  LEU  46           HB1      LEU  46  78.601   2.132  11.327
  335    HG   LEU  46           HG       LEU  46  77.387   4.266  12.480
  336   HD11  LEU  46          HD11      LEU  46  76.008   4.880  10.588
  337   HD12  LEU  46          HD12      LEU  46  74.960   4.203  11.833
  338   HD13  LEU  46          HD13      LEU  46  75.399   3.227  10.430
  339   HD21  LEU  46          HD21      LEU  46  75.818   2.692  13.520
  340   HD22  LEU  46          HD22      LEU  46  77.405   1.942  13.341
  341   HD23  LEU  46          HD23      LEU  46  76.102   1.527  12.225
  342    H    LYS  47           HN       LYS  47  80.571   2.257  11.444
  343    HA   LYS  47           HA       LYS  47  81.321   3.169  13.967
  344    HB2  LYS  47           HB2      LYS  47  83.200   1.748  12.065
  345    HB3  LYS  47           HB1      LYS  47  83.242   1.712  13.828
  346    HG2  LYS  47           HG2      LYS  47  81.105   0.551  13.901
  347    HG3  LYS  47           HG1      LYS  47  80.941   0.685  12.151
  348    HD2  LYS  47           HD2      LYS  47  83.080  -0.624  11.920
  349    HD3  LYS  47           HD1      LYS  47  83.042  -0.887  13.664
  350    HE2  LYS  47           HE2      LYS  47  80.712  -1.620  11.880
  351    HE3  LYS  47           HE1      LYS  47  82.029  -2.744  12.216
  352    HZ1  LYS  47           HZ1      LYS  47  81.072  -3.226  14.135
  353    HZ2  LYS  47           HZ2      LYS  47  79.817  -2.124  13.822
  354    HZ3  LYS  47           HZ3      LYS  47  81.218  -1.613  14.637
  355    H    LEU  48           HN       LEU  48  83.354   3.621  11.033
  356    HA   LEU  48           HA       LEU  48  85.301   5.250  12.133
  357    HB2  LEU  48           HB2      LEU  48  84.361   4.656   9.488
  358    HB3  LEU  48           HB1      LEU  48  84.569   6.401   9.561
  359    HG   LEU  48           HG       LEU  48  86.697   4.457  10.474
  360   HD11  LEU  48          HD11      LEU  48  86.143   4.209   8.039
  361   HD12  LEU  48          HD12      LEU  48  87.791   4.722   8.391
  362   HD13  LEU  48          HD13      LEU  48  86.601   5.899   7.837
  363   HD21  LEU  48          HD21      LEU  48  86.929   7.332   9.585
  364   HD22  LEU  48          HD22      LEU  48  88.151   6.353  10.396
  365   HD23  LEU  48          HD23      LEU  48  86.712   6.869  11.273
  366    H    VAL  49           HN       VAL  49  82.265   6.471  10.687
  367    HA   VAL  49           HA       VAL  49  82.611   9.180  11.421
  368    HB   VAL  49           HB       VAL  49  80.075   7.553  11.162
  369   HG11  VAL  49          HG11      VAL  49  79.450   9.467  12.417
  370   HG12  VAL  49          HG12      VAL  49  79.083   9.891  10.745
  371   HG13  VAL  49          HG13      VAL  49  80.544  10.513  11.514
  372   HG21  VAL  49          HG21      VAL  49  81.241   9.562   9.227
  373   HG22  VAL  49          HG22      VAL  49  80.015   8.333   8.915
  374   HG23  VAL  49          HG23      VAL  49  81.694   7.858   9.174
  375    H    GLU  50           HN       GLU  50  80.944   6.575  13.251
  376    HA   GLU  50           HA       GLU  50  80.073   8.015  15.467
  377    HB2  GLU  50           HB2      GLU  50  81.355   5.270  15.396
  378    HB3  GLU  50           HB1      GLU  50  80.580   5.937  16.825
  379    HG2  GLU  50           HG2      GLU  50  79.142   5.749  14.175
  380    HG3  GLU  50           HG1      GLU  50  79.140   4.423  15.334
  381    H    LYS  51           HN       LYS  51  83.360   6.853  14.822
  382    HA   LYS  51           HA       LYS  51  84.413   7.831  17.338
  383    HB2  LYS  51           HB2      LYS  51  85.873   7.076  14.798
  384    HB3  LYS  51           HB1      LYS  51  86.570   7.202  16.413
  385    HG2  LYS  51           HG2      LYS  51  85.107   5.403  17.212
  386    HG3  LYS  51           HG1      LYS  51  84.355   5.291  15.620
  387    HD2  LYS  51           HD2      LYS  51  86.323   4.455  14.616
  388    HD3  LYS  51           HD1      LYS  51  87.332   4.970  15.965
  389    HE2  LYS  51           HE2      LYS  51  86.159   3.322  17.428
  390    HE3  LYS  51           HE1      LYS  51  85.254   2.763  16.022
  391    HZ1  LYS  51           HZ1      LYS  51  88.164   2.576  16.521
  392    HZ2  LYS  51           HZ2      LYS  51  87.506   2.391  14.965
  393    HZ3  LYS  51           HZ3      LYS  51  87.068   1.320  16.209
  394    H    LEU  52           HN       LEU  52  84.298   9.119  14.009
  395    HA   LEU  52           HA       LEU  52  86.078  11.255  14.397
  396    HB2  LEU  52           HB2      LEU  52  84.453  10.267  12.355
  397    HB3  LEU  52           HB1      LEU  52  83.759  11.844  12.667
  398    HG   LEU  52           HG       LEU  52  85.370  12.243  11.018
  399   HD11  LEU  52          HD11      LEU  52  87.316  12.806  13.188
  400   HD12  LEU  52          HD12      LEU  52  85.706  13.469  13.436
  401   HD13  LEU  52          HD13      LEU  52  86.614  13.889  11.989
  402   HD21  LEU  52          HD21      LEU  52  87.290  10.484  12.571
  403   HD22  LEU  52          HD22      LEU  52  87.652  11.301  11.052
  404   HD23  LEU  52          HD23      LEU  52  86.435  10.027  11.098
  405    H    ASP  53           HN       ASP  53  82.531  11.464  14.368
  406    HA   ASP  53           HA       ASP  53  81.047  12.732  15.625
  407    HB2  ASP  53           HB2      ASP  53  82.611  11.763  17.440
  408    HB3  ASP  53           HB1      ASP  53  83.291  13.378  17.513
  409    H    VAL  54           HN       VAL  54  81.171  14.174  13.800
  410    HA   VAL  54           HA       VAL  54  81.727  16.883  14.607
  411    HB   VAL  54           HB       VAL  54  84.015  16.287  14.216
  412   HG11  VAL  54          HG11      VAL  54  83.038  15.200  11.565
  413   HG12  VAL  54          HG12      VAL  54  83.586  14.243  12.942
  414   HG13  VAL  54          HG13      VAL  54  84.725  15.276  12.074
  415   HG21  VAL  54          HG21      VAL  54  84.619  17.847  12.478
  416   HG22  VAL  54          HG22      VAL  54  83.152  18.469  13.231
  417   HG23  VAL  54          HG23      VAL  54  83.063  17.646  11.675
  418    H    LYS  55           HN       LYS  55  80.759  18.373  13.202
  419    HA   LYS  55           HA       LYS  55  78.757  17.313  11.431
  420    HB2  LYS  55           HB2      LYS  55  79.256  19.756  12.711
  421    HB3  LYS  55           HB1      LYS  55  79.434  20.154  11.012
  422    HG2  LYS  55           HG2      LYS  55  77.013  18.550  11.800
  423    HG3  LYS  55           HG1      LYS  55  77.049  20.238  12.243
  424    HD2  LYS  55           HD2      LYS  55  77.517  20.848   9.881
  425    HD3  LYS  55           HD1      LYS  55  77.390  19.147   9.439
  426    HE2  LYS  55           HE2      LYS  55  75.229  19.978   9.002
  427    HE3  LYS  55           HE1      LYS  55  75.061  19.253  10.601
  428    HZ1  LYS  55           HZ1      LYS  55  75.965  21.954  10.742
  429    HZ2  LYS  55           HZ2      LYS  55  74.633  21.219  11.499
  430    HZ3  LYS  55           HZ3      LYS  55  74.484  21.838   9.924
  431    H    LYS  56           HN       LYS  56  81.446  16.463  10.716
  432    HA   LYS  56           HA       LYS  56  82.262  17.972   8.359
  433    HB2  LYS  56           HB2      LYS  56  83.867  16.638   9.727
  434    HB3  LYS  56           HB1      LYS  56  83.032  15.169   9.231
  435    HG2  LYS  56           HG2      LYS  56  83.636  15.480   6.941
  436    HG3  LYS  56           HG1      LYS  56  84.192  17.126   7.236
  437    HD2  LYS  56           HD2      LYS  56  85.489  14.867   8.753
  438    HD3  LYS  56           HD1      LYS  56  85.938  15.126   7.070
  439    HE2  LYS  56           HE2      LYS  56  86.071  17.222   9.262
  440    HE3  LYS  56           HE1      LYS  56  87.449  16.357   8.583
  441    HZ1  LYS  56           HZ1      LYS  56  87.354  18.376   7.435
  442    HZ2  LYS  56           HZ2      LYS  56  85.668  18.302   7.242
  443    HZ3  LYS  56           HZ3      LYS  56  86.674  17.249   6.366
  444    H    ASP  57           HN       ASP  57  82.245  16.954   6.172
  445    HA   ASP  57           HA       ASP  57  79.620  15.863   5.587
  446    HB2  ASP  57           HB2      ASP  57  81.981  16.120   3.708
  447    HB3  ASP  57           HB1      ASP  57  80.274  16.045   3.282
  448    H    TRP  58           HN       TRP  58  79.612  13.819   6.633
  449    HA   TRP  58           HA       TRP  58  81.686  11.850   6.195
  450    HB2  TRP  58           HB2      TRP  58  78.816  11.394   6.990
  451    HB3  TRP  58           HB1      TRP  58  80.159  10.305   7.264
  452    HD1  TRP  58           HD1      TRP  58  82.228  12.453   8.428
  453    HE1  TRP  58           HE1      TRP  58  81.820  13.388  10.806
  454    HE3  TRP  58           HE3      TRP  58  77.239  11.493   8.917
  455    HZ2  TRP  58           HZ2      TRP  58  79.659  13.678  12.663
  456    HZ3  TRP  58           HZ3      TRP  58  76.033  12.108  10.989
  457    HH2  TRP  58           HH2      TRP  58  77.235  13.202  12.861
  458    H    SER  59           HN       SER  59  78.299  12.028   5.109
  459    HA   SER  59           HA       SER  59  78.123   9.910   3.370
  460    HB2  SER  59           HB2      SER  59  76.322  11.555   3.821
  461    HB3  SER  59           HB1      SER  59  77.129  12.705   2.764
  462    HG   SER  59           HG       SER  59  76.939  11.095   1.099
  463    H    ASP  60           HN       ASP  60  79.212  13.161   2.331
  464    HA   ASP  60           HA       ASP  60  79.995  12.433  -0.280
  465    HB2  ASP  60           HB2      ASP  60  79.975  14.763   0.337
  466    HB3  ASP  60           HB1      ASP  60  81.122  14.483   1.648
  467    H    HIS  61           HN       HIS  61  81.815  12.383   2.753
  468    HA   HIS  61           HA       HIS  61  84.195  11.221   1.599
  469    HB2  HIS  61           HB2      HIS  61  83.237  11.378   4.468
  470    HB3  HIS  61           HB1      HIS  61  84.856  10.922   3.962
  471    HD1  HIS  61           HD1      HIS  61  84.322  13.469   5.702
  472    HD2  HIS  61           HD2      HIS  61  84.719  13.491   1.554
  473    HE1  HIS  61           HE1      HIS  61  84.987  15.826   5.054
  474    H    ALA  62           HN       ALA  62  84.409   9.184   0.973
  475    HA   ALA  62           HA       ALA  62  82.952   7.019   2.439
  476    HB1  ALA  62           HB1      ALA  62  81.906   7.729   0.178
  477    HB2  ALA  62           HB2      ALA  62  82.240   6.012   0.414
  478    HB3  ALA  62           HB3      ALA  62  83.332   6.999  -0.560
  479    H    LEU  63           HN       LEU  63  84.017   4.796   1.563
  480    HA   LEU  63           HA       LEU  63  86.948   5.223   1.881
  481    HB2  LEU  63           HB2      LEU  63  85.447   2.597   1.860
  482    HB3  LEU  63           HB1      LEU  63  87.097   2.878   2.391
  483    HG   LEU  63           HG       LEU  63  85.735   2.722   4.339
  484   HD11  LEU  63          HD11      LEU  63  86.349   4.704   5.444
  485   HD12  LEU  63          HD12      LEU  63  86.093   5.691   4.007
  486   HD13  LEU  63          HD13      LEU  63  87.485   4.611   4.099
  487   HD21  LEU  63          HD21      LEU  63  83.639   3.614   4.624
  488   HD22  LEU  63          HD22      LEU  63  83.624   3.598   2.865
  489   HD23  LEU  63          HD23      LEU  63  84.012   5.084   3.730
  490    H    TRP  64           HN       TRP  64  88.431   4.671   0.374
  491    HA   TRP  64           HA       TRP  64  87.451   3.578  -2.256
  492    HB2  TRP  64           HB2      TRP  64  88.031   5.548  -3.248
  493    HB3  TRP  64           HB1      TRP  64  88.382   6.208  -1.675
  494    HD1  TRP  64           HD1      TRP  64  91.084   5.035  -0.886
  495    HE1  TRP  64           HE1      TRP  64  93.209   5.441  -2.272
  496    HE3  TRP  64           HE3      TRP  64  88.985   6.315  -5.362
  497    HZ2  TRP  64           HZ2      TRP  64  93.934   6.250  -4.916
  498    HZ3  TRP  64           HZ3      TRP  64  90.418   6.923  -7.289
  499    HH2  TRP  64           HH2      TRP  64  92.888   6.894  -7.072
  500    H    TRP  65           HN       TRP  65  89.024   2.266  -3.376
  501    HA   TRP  65           HA       TRP  65  91.175   1.220  -1.568
  502    HB2  TRP  65           HB2      TRP  65  89.298  -0.325  -2.410
  503    HB3  TRP  65           HB1      TRP  65  90.056  -0.193  -3.992
  504    HD1  TRP  65           HD1      TRP  65  92.956  -0.020  -1.966
  505    HE1  TRP  65           HE1      TRP  65  94.012  -2.312  -1.514
  506    HE3  TRP  65           HE3      TRP  65  89.053  -3.064  -3.248
  507    HZ2  TRP  65           HZ2      TRP  65  93.315  -5.079  -1.677
  508    HZ3  TRP  65           HZ3      TRP  65  89.287  -5.524  -3.093
  509    HH2  TRP  65           HH2      TRP  65  91.409  -6.535  -2.310
  510    H    GLU  66           HN       GLU  66  92.849   2.665  -2.185
  511    HA   GLU  66           HA       GLU  66  93.429   3.534  -4.800
  512    HB2  GLU  66           HB2      GLU  66  95.799   3.786  -3.965
  513    HB3  GLU  66           HB1      GLU  66  94.562   4.552  -2.977
  514    HG2  GLU  66           HG2      GLU  66  94.538   2.568  -1.492
  515    HG3  GLU  66           HG1      GLU  66  95.815   1.854  -2.468
  516    H    LYS  67           HN       LYS  67  93.991   0.374  -3.399
  517    HA   LYS  67           HA       LYS  67  96.028  -0.392  -5.319
  518    HB2  LYS  67           HB2      LYS  67  94.030  -2.254  -4.008
  519    HB3  LYS  67           HB1      LYS  67  95.620  -2.670  -4.637
  520    HG2  LYS  67           HG2      LYS  67  95.082  -0.860  -2.268
  521    HG3  LYS  67           HG1      LYS  67  95.651  -2.523  -2.181
  522    HD2  LYS  67           HD2      LYS  67  97.604  -1.739  -3.667
  523    HD3  LYS  67           HD1      LYS  67  97.093  -0.103  -3.251
  524    HE2  LYS  67           HE2      LYS  67  98.638  -0.526  -1.553
  525    HE3  LYS  67           HE1      LYS  67  97.137  -1.039  -0.775
  526    HZ1  LYS  67           HZ1      LYS  67  97.719  -3.305  -1.844
  527    HZ2  LYS  67           HZ2      LYS  67  98.513  -2.827  -0.420
  528    HZ3  LYS  67           HZ3      LYS  67  99.295  -2.682  -1.921
  529    H    LYS  68           HN       LYS  68  92.819   0.405  -5.472
  530    HA   LYS  68           HA       LYS  68  92.463  -0.842  -8.155
  531    HB2  LYS  68           HB2      LYS  68  90.107  -0.432  -6.324
  532    HB3  LYS  68           HB1      LYS  68  90.301  -1.576  -7.649
  533    HG2  LYS  68           HG2      LYS  68  91.919  -1.804  -5.089
  534    HG3  LYS  68           HG1      LYS  68  90.340  -2.533  -5.275
  535    HD2  LYS  68           HD2      LYS  68  91.050  -3.946  -7.036
  536    HD3  LYS  68           HD1      LYS  68  92.522  -3.010  -7.292
  537    HE2  LYS  68           HE2      LYS  68  93.607  -3.971  -5.489
  538    HE3  LYS  68           HE1      LYS  68  92.120  -4.243  -4.585
  539    HZ1  LYS  68           HZ1      LYS  68  92.841  -6.342  -5.305
  540    HZ2  LYS  68           HZ2      LYS  68  93.177  -5.794  -6.877
  541    HZ3  LYS  68           HZ3      LYS  68  91.568  -5.933  -6.349
  542    H    ARG  69           HN       ARG  69  92.419   1.942  -6.173
  543    HA   ARG  69           HA       ARG  69  91.677   4.137  -6.556
  544    HB2  ARG  69           HB2      ARG  69  92.064   3.147  -9.404
  545    HB3  ARG  69           HB1      ARG  69  91.596   4.797  -9.030
  546    HG2  ARG  69           HG2      ARG  69  93.912   5.024  -9.164
  547    HG3  ARG  69           HG1      ARG  69  93.711   4.738  -7.438
  548    HD2  ARG  69           HD2      ARG  69  95.476   3.292  -8.205
  549    HD3  ARG  69           HD1      ARG  69  94.063   2.288  -7.897
  550    HE   ARG  69           HE       ARG  69  93.916   1.844 -10.216
  551   HH11  ARG  69          HH11      ARG  69  94.703   1.988 -12.327
  552   HH12  ARG  69          HH12      ARG  69  95.900   3.181 -12.712
  553   HH21  ARG  69          HH21      ARG  69  96.046   4.460  -9.493
  554   HH22  ARG  69          HH22      ARG  69  96.659   4.579 -11.109
  555    H    THR  70           HN       THR  70  89.718   2.334  -5.892
  556    HA   THR  70           HA       THR  70  87.439   2.948  -7.751
  557    HB   THR  70           HB       THR  70  88.136   0.533  -7.187
  558    HG1  THR  70           HG1      THR  70  86.005   1.403  -7.923
  559   HG21  THR  70          HG21      THR  70  88.312   1.203  -4.668
  560   HG22  THR  70          HG22      THR  70  87.665  -0.380  -5.094
  561   HG23  THR  70          HG23      THR  70  86.569   0.934  -4.663
  562    H    TRP  71           HN       TRP  71  85.351   2.615  -6.196
  563    HA   TRP  71           HA       TRP  71  85.683   4.345  -3.791
  564    HB2  TRP  71           HB2      TRP  71  83.261   5.139  -4.447
  565    HB3  TRP  71           HB1      TRP  71  84.654   5.911  -5.181
  566    HD1  TRP  71           HD1      TRP  71  83.672   2.445  -6.425
  567    HE1  TRP  71           HE1      TRP  71  82.705   2.652  -8.764
  568    HE3  TRP  71           HE3      TRP  71  83.367   7.529  -6.814
  569    HZ2  TRP  71           HZ2      TRP  71  81.918   4.681 -10.620
  570    HZ3  TRP  71           HZ3      TRP  71  82.508   8.569  -8.893
  571    HH2  TRP  71           HH2      TRP  71  81.784   7.153 -10.796
  572    H    LEU  72           HN       LEU  72  85.515   2.720  -2.346
  573    HA   LEU  72           HA       LEU  72  83.973   0.389  -2.681
  574    HB2  LEU  72           HB2      LEU  72  84.801   1.732  -0.117
  575    HB3  LEU  72           HB1      LEU  72  84.328   0.046  -0.275
  576    HG   LEU  72           HG       LEU  72  86.580   1.272  -1.872
  577   HD11  LEU  72          HD11      LEU  72  86.810  -0.276   0.711
  578   HD12  LEU  72          HD12      LEU  72  87.039   1.465   0.552
  579   HD13  LEU  72          HD13      LEU  72  88.142   0.355  -0.261
  580   HD21  LEU  72          HD21      LEU  72  87.253  -1.269  -1.797
  581   HD22  LEU  72          HD22      LEU  72  86.013  -0.729  -2.926
  582   HD23  LEU  72          HD23      LEU  72  85.550  -1.517  -1.416
  583    H    LEU  73           HN       LEU  73  82.020   1.082  -3.483
  584    HA   LEU  73           HA       LEU  73  80.042   2.040  -1.446
  585    HB2  LEU  73           HB2      LEU  73  78.719   2.940  -3.373
  586    HB3  LEU  73           HB1      LEU  73  80.268   3.749  -3.171
  587    HG   LEU  73           HG       LEU  73  81.039   1.802  -4.912
  588   HD11  LEU  73          HD11      LEU  73  78.857   0.773  -5.197
  589   HD12  LEU  73          HD12      LEU  73  79.267   1.634  -6.676
  590   HD13  LEU  73          HD13      LEU  73  78.120   2.337  -5.537
  591   HD21  LEU  73          HD21      LEU  73  79.624   4.345  -5.769
  592   HD22  LEU  73          HD22      LEU  73  80.834   3.458  -6.695
  593   HD23  LEU  73          HD23      LEU  73  81.288   4.268  -5.201
  594    H    LYS  74           HN       LYS  74  81.191  -0.599  -2.756
  595    HA   LYS  74           HA       LYS  74  78.740  -1.822  -3.805
  596    HB2  LYS  74           HB2      LYS  74  81.560  -2.352  -3.946
  597    HB3  LYS  74           HB1      LYS  74  80.811  -3.760  -3.248
  598    HG2  LYS  74           HG2      LYS  74  80.902  -3.995  -5.683
  599    HG3  LYS  74           HG1      LYS  74  79.236  -3.918  -5.132
  600    HD2  LYS  74           HD2      LYS  74  79.896  -2.548  -7.230
  601    HD3  LYS  74           HD1      LYS  74  78.922  -1.747  -6.014
  602    HE2  LYS  74           HE2      LYS  74  80.797  -0.528  -5.179
  603    HE3  LYS  74           HE1      LYS  74  81.932  -1.560  -6.040
  604    HZ1  LYS  74           HZ1      LYS  74  81.371   0.715  -7.024
  605    HZ2  LYS  74           HZ2      LYS  74  79.907  -0.003  -7.504
  606    HZ3  LYS  74           HZ3      LYS  74  81.385  -0.626  -8.064
  607    H    THR  75           HN       THR  75  78.667  -0.838  -1.057
  608    HA   THR  75           HA       THR  75  79.019  -2.763   0.940
  609    HB   THR  75           HB       THR  75  76.588  -0.967   0.715
  610    HG1  THR  75           HG1      THR  75  78.412   0.163   2.171
  611   HG21  THR  75          HG21      THR  75  78.110  -2.182   3.029
  612   HG22  THR  75          HG22      THR  75  76.438  -2.498   2.572
  613   HG23  THR  75          HG23      THR  75  76.893  -0.922   3.217
  614    H    HIS  76           HN       HIS  76  77.087  -3.045  -1.825
  615    HA   HIS  76           HA       HIS  76  74.844  -4.518  -0.951
  616    HB2  HIS  76           HB2      HIS  76  76.497  -4.708  -3.478
  617    HB3  HIS  76           HB1      HIS  76  75.023  -5.645  -3.236
  618    HD1  HIS  76           HD1      HIS  76  75.880  -1.981  -2.542
  619    HD2  HIS  76           HD2      HIS  76  72.991  -4.272  -4.488
  620    HE1  HIS  76           HE1      HIS  76  74.166  -0.353  -3.451
  621    H    TRP  77           HN       TRP  77  78.168  -5.358  -0.779
  622    HA   TRP  77           HA       TRP  77  77.407  -8.114   0.085
  623    HB2  TRP  77           HB2      TRP  77  79.409  -7.358  -2.026
  624    HB3  TRP  77           HB1      TRP  77  79.647  -8.817  -1.079
  625    HD1  TRP  77           HD1      TRP  77  77.459 -10.521  -1.034
  626    HE1  TRP  77           HE1      TRP  77  75.943 -11.178  -2.999
  627    HE3  TRP  77           HE3      TRP  77  78.423  -6.656  -4.227
  628    HZ2  TRP  77           HZ2      TRP  77  75.221 -10.203  -5.593
  629    HZ3  TRP  77           HZ3      TRP  77  77.308  -6.544  -6.438
  630    HH2  TRP  77           HH2      TRP  77  75.709  -8.312  -7.125
  631    H    THR  78           HN       THR  78  80.760  -8.019  -0.012
  632    HA   THR  78           HA       THR  78  81.033  -6.461   2.494
  633    HB   THR  78           HB       THR  78  82.163  -9.123   2.942
  634    HG1  THR  78           HG1      THR  78  80.485 -10.365   2.590
  635   HG21  THR  78          HG21      THR  78  81.710  -7.934   4.892
  636   HG22  THR  78          HG22      THR  78  80.331  -9.030   4.806
  637   HG23  THR  78          HG23      THR  78  80.142  -7.353   4.319
  638    H    LEU  79           HN       LEU  79  83.422  -7.479   3.351
  639    HA   LEU  79           HA       LEU  79  85.344  -6.278   1.532
  640    HB2  LEU  79           HB2      LEU  79  85.586  -7.935   4.042
  641    HB3  LEU  79           HB1      LEU  79  86.993  -7.329   3.193
  642    HG   LEU  79           HG       LEU  79  86.350  -5.042   3.612
  643   HD11  LEU  79          HD11      LEU  79  83.971  -5.102   3.314
  644   HD12  LEU  79          HD12      LEU  79  84.247  -4.613   4.984
  645   HD13  LEU  79          HD13      LEU  79  83.784  -6.273   4.620
  646   HD21  LEU  79          HD21      LEU  79  85.997  -6.839   6.033
  647   HD22  LEU  79          HD22      LEU  79  86.146  -5.084   6.147
  648   HD23  LEU  79          HD23      LEU  79  87.476  -6.042   5.493
  649    H    ASP  80           HN       ASP  80  84.867  -9.518   2.851
  650    HA   ASP  80           HA       ASP  80  86.646 -11.067   1.442
  651    HB2  ASP  80           HB2      ASP  80  84.933 -11.816   3.122
  652    HB3  ASP  80           HB1      ASP  80  83.737 -11.783   1.829
  653    H    LYS  81           HN       LYS  81  83.409 -10.122   0.284
  654    HA   LYS  81           HA       LYS  81  83.597 -11.463  -2.171
  655    HB2  LYS  81           HB2      LYS  81  81.448 -10.788  -2.171
  656    HB3  LYS  81           HB1      LYS  81  81.801  -9.626  -0.906
  657    HG2  LYS  81           HG2      LYS  81  82.477  -8.966  -3.772
  658    HG3  LYS  81           HG1      LYS  81  80.834  -8.797  -3.198
  659    HD2  LYS  81           HD2      LYS  81  81.641  -7.374  -1.368
  660    HD3  LYS  81           HD1      LYS  81  83.258  -7.475  -1.991
  661    HE2  LYS  81           HE2      LYS  81  82.203  -6.620  -4.223
  662    HE3  LYS  81           HE1      LYS  81  80.890  -6.090  -3.176
  663    HZ1  LYS  81           HZ1      LYS  81  83.650  -5.452  -2.425
  664    HZ2  LYS  81           HZ2      LYS  81  82.217  -4.603  -2.090
  665    HZ3  LYS  81           HZ3      LYS  81  82.903  -4.538  -3.643
  666    H    TYR  82           HN       TYR  82  84.964  -8.434  -1.161
  667    HA   TYR  82           HA       TYR  82  85.832  -7.805  -3.918
  668    HB2  TYR  82           HB2      TYR  82  85.195  -6.214  -1.779
  669    HB3  TYR  82           HB1      TYR  82  86.939  -6.259  -1.622
  670    HD1  TYR  82           HD1      TYR  82  84.836  -3.990  -2.530
  671    HD2  TYR  82           HD2      TYR  82  87.672  -6.499  -4.557
  672    HE1  TYR  82           HE1      TYR  82  85.025  -2.313  -4.347
  673    HE2  TYR  82           HE2      TYR  82  87.860  -4.824  -6.372
  674    HH   TYR  82           HH       TYR  82  85.952  -2.778  -7.186
  675    H    GLY  83           HN       GLY  83  87.287  -8.733  -0.792
  676    HA2  GLY  83           HA2      GLY  83  89.114 -10.416  -0.807
  677    HA3  GLY  83           HA1      GLY  83  89.714  -9.686  -2.298
  678    H    ILE  84           HN       ILE  84  88.496  -7.740   0.298
  679    HA   ILE  84           HA       ILE  84  91.063  -6.352   0.525
  680    HB   ILE  84           HB       ILE  84  88.381  -6.000   1.883
  681   HG12  ILE  84          HG12      ILE  84  89.664  -4.071  -0.050
  682   HG13  ILE  84          HG11      ILE  84  88.840  -5.498  -0.665
  683   HG21  ILE  84          HG21      ILE  84  90.028  -5.136   3.386
  684   HG22  ILE  84          HG22      ILE  84  89.351  -3.754   2.533
  685   HG23  ILE  84          HG23      ILE  84  90.932  -4.385   2.071
  686   HD11  ILE  84          HD11      ILE  84  87.522  -3.661   1.330
  687   HD12  ILE  84          HD12      ILE  84  86.762  -4.849   0.269
  688   HD13  ILE  84          HD13      ILE  84  87.429  -3.361  -0.406
  689    H    GLN  85           HN       GLN  85  92.067  -6.005   2.670
  690    HA   GLN  85           HA       GLN  85  91.417  -7.727   4.897
  691    HB2  GLN  85           HB2      GLN  85  92.720  -9.110   2.966
  692    HB3  GLN  85           HB1      GLN  85  94.113  -8.406   3.776
  693    HG2  GLN  85           HG2      GLN  85  93.882 -10.345   5.038
  694    HG3  GLN  85           HG1      GLN  85  92.846  -9.267   5.969
  695   HE21  GLN  85          HE21      GLN  85  90.568  -9.168   4.351
  696   HE22  GLN  85          HE22      GLN  85  89.869 -10.704   4.262
  697    H    ALA  86           HN       ALA  86  93.701  -7.742   6.297
  698    HA   ALA  86           HA       ALA  86  94.075  -5.021   7.079
  699    HB1  ALA  86           HB1      ALA  86  94.446  -6.749   8.695
  700    HB2  ALA  86           HB2      ALA  86  96.023  -6.019   8.388
  701    HB3  ALA  86           HB3      ALA  86  95.603  -7.562   7.640
  702    H    ASP  87           HN       ASP  87  95.644  -6.995   4.692
  703    HA   ASP  87           HA       ASP  87  98.061  -5.363   4.571
  704    HB2  ASP  87           HB2      ASP  87  98.382  -6.668   2.392
  705    HB3  ASP  87           HB1      ASP  87  98.301  -7.631   3.870
  706    H    ALA  88           HN       ALA  88  94.885  -4.972   3.573
  707    HA   ALA  88           HA       ALA  88  95.588  -3.258   1.236
  708    HB1  ALA  88           HB1      ALA  88  93.777  -4.499   0.539
  709    HB2  ALA  88           HB2      ALA  88  92.867  -3.229   1.357
  710    HB3  ALA  88           HB3      ALA  88  93.209  -4.751   2.184
  711    H    LYS  89           HN       LYS  89  96.027  -1.158   1.809
  712    HA   LYS  89           HA       LYS  89  94.704  -0.011   4.212
  713    HB2  LYS  89           HB2      LYS  89  96.685   1.481   2.506
  714    HB3  LYS  89           HB1      LYS  89  96.355   1.647   4.229
  715    HG2  LYS  89           HG2      LYS  89  97.629  -0.806   2.980
  716    HG3  LYS  89           HG1      LYS  89  98.525   0.517   3.701
  717    HD2  LYS  89           HD2      LYS  89  97.739   0.059   5.872
  718    HD3  LYS  89           HD1      LYS  89  96.395  -0.909   5.279
  719    HE2  LYS  89           HE2      LYS  89  98.172  -2.341   6.206
  720    HE3  LYS  89           HE1      LYS  89  97.939  -2.621   4.480
  721    HZ1  LYS  89           HZ1      LYS  89  99.839  -1.349   3.966
  722    HZ2  LYS  89           HZ2      LYS  89 100.303  -2.384   5.230
  723    HZ3  LYS  89           HZ3      LYS  89  99.972  -0.748   5.546
  724    H    LEU  90           HN       LEU  90  92.877   0.976   3.966
  725    HA   LEU  90           HA       LEU  90  92.105   2.121   1.336
  726    HB2  LEU  90           HB2      LEU  90  90.322   2.019   3.759
  727    HB3  LEU  90           HB1      LEU  90  89.875   1.999   2.054
  728    HG   LEU  90           HG       LEU  90  91.260  -0.211   3.579
  729   HD11  LEU  90          HD11      LEU  90  89.187  -1.468   3.021
  730   HD12  LEU  90          HD12      LEU  90  88.518  -0.002   2.306
  731   HD13  LEU  90          HD13      LEU  90  88.861  -0.063   4.035
  732   HD21  LEU  90          HD21      LEU  90  90.591   0.125   0.646
  733   HD22  LEU  90          HD22      LEU  90  90.889  -1.456   1.373
  734   HD23  LEU  90          HD23      LEU  90  92.162  -0.238   1.363
  735    H    GLN  91           HN       GLN  91  90.691   4.204   1.681
  736    HA   GLN  91           HA       GLN  91  92.044   6.065   3.594
  737    HB2  GLN  91           HB2      GLN  91  91.224   6.828   0.777
  738    HB3  GLN  91           HB1      GLN  91  92.177   7.775   1.912
  739    HG2  GLN  91           HG2      GLN  91  94.115   6.520   1.563
  740    HG3  GLN  91           HG1      GLN  91  93.235   5.095   1.046
  741   HE21  GLN  91          HE21      GLN  91  92.046   7.964  -0.342
  742   HE22  GLN  91          HE22      GLN  91  92.764   7.784  -1.860
  743    H    PHE  92           HN       PHE  92  90.681   8.101   3.819
  744    HA   PHE  92           HA       PHE  92  87.754   7.503   3.518
  745    HB2  PHE  92           HB2      PHE  92  88.314   7.310   5.847
  746    HB3  PHE  92           HB1      PHE  92  89.232   8.797   5.821
  747    HD1  PHE  92           HD1      PHE  92  85.870   7.300   5.770
  748    HD2  PHE  92           HD2      PHE  92  88.091  10.977   5.864
  749    HE1  PHE  92           HE1      PHE  92  83.812   8.528   6.404
  750    HE2  PHE  92           HE2      PHE  92  86.032  12.203   6.494
  751    HZ   PHE  92           HZ       PHE  92  83.893  10.980   6.766
  752    H    THR  93           HN       THR  93  87.644   8.662   1.592
  753    HA   THR  93           HA       THR  93  87.920  11.626   1.855
  754    HB   THR  93           HB       THR  93  89.647  11.708   0.362
  755    HG1  THR  93           HG1      THR  93  88.430   9.873  -1.375
  756   HG21  THR  93          HG21      THR  93  90.374   9.620   1.438
  757   HG22  THR  93          HG22      THR  93  90.813   9.637  -0.270
  758   HG23  THR  93          HG23      THR  93  89.428   8.690   0.276
  759    HA   PRO  94           HA       PRO  94  84.187  12.359  -0.409
  760    HB2  PRO  94           HB2      PRO  94  85.873  12.995  -2.821
  761    HB3  PRO  94           HB1      PRO  94  84.460  13.863  -2.179
  762    HG2  PRO  94           HG2      PRO  94  86.903  14.759  -1.702
  763    HG3  PRO  94           HG1      PRO  94  85.663  14.799  -0.433
  764    HD2  PRO  94           HD2      PRO  94  88.036  13.011  -0.678
  765    HD3  PRO  94           HD1      PRO  94  87.186  13.553   0.784
  766    H    TYR 541           HT1      TYR 541  47.580  29.360   1.008
  767    HA   TYR 541           HA       TYR 541  45.639  30.194   1.727
  768    HB2  TYR 541           HB2      TYR 541  45.694  27.615   2.066
  769    HB3  TYR 541           HB1      TYR 541  45.749  27.984   3.788
  770    HD1  TYR 541           HD1      TYR 541  43.799  28.709   4.961
  771    HD2  TYR 541           HD2      TYR 541  43.777  28.481   0.672
  772    HE1  TYR 541           HE1      TYR 541  41.346  29.071   4.955
  773    HE2  TYR 541           HE2      TYR 541  41.324  28.844   0.665
  774    HH   TYR 541           HH       TYR 541  39.489  29.007   1.919
  775    H    HIS 542           HN       HIS 542  46.791  29.000   4.887
  776    HA   HIS 542           HA       HIS 542  46.591  31.794   5.961
  777    HB2  HIS 542           HB2      HIS 542  44.641  30.215   6.560
  778    HB3  HIS 542           HB1      HIS 542  45.798  29.330   7.534
  779    HD1  HIS 542           HD1      HIS 542  45.540  33.104   7.108
  780    HD2  HIS 542           HD2      HIS 542  45.146  30.217  10.089
  781    HE1  HIS 542           HE1      HIS 542  45.234  34.360   9.285
  782    H    GLU 543           HN       GLU 543  47.157  30.086   8.562
  783    HA   GLU 543           HA       GLU 543  48.933  29.563   9.821
  784    HB2  GLU 543           HB2      GLU 543  49.300  27.917   7.876
  785    HB3  GLU 543           HB1      GLU 543  50.526  29.053   7.307
  786    HG2  GLU 543           HG2      GLU 543  51.933  28.675   9.117
  787    HG3  GLU 543           HG1      GLU 543  50.598  28.259  10.195
  788    H    ARG 544           HN       ARG 544  49.558  31.273  10.768
  789    HA   ARG 544           HA       ARG 544  50.399  33.742   9.827
  790    HB2  ARG 544           HB2      ARG 544  51.664  32.343  12.200
  791    HB3  ARG 544           HB1      ARG 544  51.528  34.083  11.947
  792    HG2  ARG 544           HG2      ARG 544  49.190  32.174  12.255
  793    HG3  ARG 544           HG1      ARG 544  49.791  33.256  13.504
  794    HD2  ARG 544           HD2      ARG 544  49.429  35.127  11.694
  795    HD3  ARG 544           HD1      ARG 544  48.360  33.936  10.950
  796    HE   ARG 544           HE       ARG 544  47.538  33.993  13.592
  797   HH11  ARG 544          HH11      ARG 544  45.939  35.407  14.340
  798   HH12  ARG 544          HH12      ARG 544  45.648  36.889  13.491
  799   HH21  ARG 544          HH21      ARG 544  48.081  36.305  11.093
  800   HH22  ARG 544          HH22      ARG 544  46.859  37.397  11.654
  801    H    ARG 545           HN       ARG 545  52.662  34.669   9.850
  802    HA   ARG 545           HA       ARG 545  54.380  34.408   8.010
  803    HB2  ARG 545           HB2      ARG 545  55.306  33.991  10.863
  804    HB3  ARG 545           HB1      ARG 545  56.361  34.405   9.526
  805    HG2  ARG 545           HG2      ARG 545  55.938  36.547  10.272
  806    HG3  ARG 545           HG1      ARG 545  54.561  36.369   9.197
  807    HD2  ARG 545           HD2      ARG 545  53.540  37.122  11.164
  808    HD3  ARG 545           HD1      ARG 545  53.375  35.376  11.329
  809    HE   ARG 545           HE       ARG 545  55.795  35.913  12.551
  810   HH11  ARG 545          HH11      ARG 545  55.964  36.398  14.752
  811   HH12  ARG 545          HH12      ARG 545  54.606  37.081  15.582
  812   HH21  ARG 545          HH21      ARG 545  52.566  37.101  12.778
  813   HH22  ARG 545          HH22      ARG 545  52.682  37.478  14.465
  814    H    GLY 546           HN       GLY 546  56.320  32.580   9.990
  815    HA2  GLY 546           HA2      GLY 546  56.248  30.304   8.057
  816    HA3  GLY 546           HA1      GLY 546  57.594  30.703   9.122
  817    H    SER 547           HN       SER 547  57.770  29.575  10.988
  818    HA   SER 547           HA       SER 547  55.570  28.627  12.567
  819    HB2  SER 547           HB2      SER 547  56.711  26.826  10.468
  820    HB3  SER 547           HB1      SER 547  56.323  26.109  12.030
  821    HG   SER 547           HG       SER 547  54.418  27.818  10.982
  822    H    LEU 548           HN       LEU 548  56.557  28.672  14.570
  823    HA   LEU 548           HA       LEU 548  59.343  28.870  14.892
  824    HB2  LEU 548           HB2      LEU 548  57.019  28.480  16.675
  825    HB3  LEU 548           HB1      LEU 548  58.535  27.881  17.338
  826    HG   LEU 548           HG       LEU 548  59.553  30.146  16.737
  827   HD11  LEU 548          HD11      LEU 548  56.651  30.689  16.136
  828   HD12  LEU 548          HD12      LEU 548  58.064  31.034  15.145
  829   HD13  LEU 548          HD13      LEU 548  57.756  31.984  16.591
  830   HD21  LEU 548          HD21      LEU 548  58.850  31.157  18.736
  831   HD22  LEU 548          HD22      LEU 548  58.637  29.432  19.033
  832   HD23  LEU 548          HD23      LEU 548  57.242  30.437  18.641
  833    H    CYS 549           HN       CYS 549  60.992  27.433  15.109
  834    HA   CYS 549           HA       CYS 549  60.378  24.603  14.562
  835    HB2  CYS 549           HB2      CYS 549  62.321  25.321  13.432
  836    HB3  CYS 549           HB1      CYS 549  62.864  26.293  14.788
  837    H    SER 550           HN       SER 550  59.520  23.685  16.329
  838    HA   SER 550           HA       SER 550  59.824  24.369  18.996
  839    HB2  SER 550           HB2      SER 550  58.152  22.813  18.582
  840    HB3  SER 550           HB1      SER 550  59.216  21.768  17.643
  841    HG   SER 550           HG       SER 550  58.634  21.605  20.209
  842    H    GLY 551           HN       GLY 551  61.417  24.356  20.348
  843    HA2  GLY 551           HA2      GLY 551  63.294  23.186  21.475
  844    HA3  GLY 551           HA1      GLY 551  63.782  22.569  19.890
  845    H    CYS 552           HN       CYS 552  63.183  24.965  18.492
  846    HA   CYS 552           HA       CYS 552  65.496  26.670  19.304
  847    HB2  CYS 552           HB2      CYS 552  64.100  26.005  16.722
  848    HB3  CYS 552           HB1      CYS 552  64.984  27.516  16.858
  849    H    GLN 553           HN       GLN 553  62.109  26.558  18.414
  850    HA   GLN 553           HA       GLN 553  60.424  28.096  18.539
  851    HB2  GLN 553           HB2      GLN 553  62.087  29.070  20.845
  852    HB3  GLN 553           HB1      GLN 553  60.442  29.613  20.503
  853    HG2  GLN 553           HG2      GLN 553  61.217  26.718  20.868
  854    HG3  GLN 553           HG1      GLN 553  60.553  27.713  22.147
  855   HE21  GLN 553          HE21      GLN 553  59.822  26.249  19.007
  856   HE22  GLN 553          HE22      GLN 553  58.132  26.313  19.164
  857    H    LYS 554           HN       LYS 554  61.747  28.597  16.544
  858    HA   LYS 554           HA       LYS 554  61.885  31.544  16.338
  859    HB2  LYS 554           HB2      LYS 554  63.964  29.655  15.200
  860    HB3  LYS 554           HB1      LYS 554  63.872  31.372  14.834
  861    HG2  LYS 554           HG2      LYS 554  64.218  30.243  17.623
  862    HG3  LYS 554           HG1      LYS 554  65.546  30.811  16.618
  863    HD2  LYS 554           HD2      LYS 554  64.119  33.021  16.456
  864    HD3  LYS 554           HD1      LYS 554  63.329  32.394  17.902
  865    HE2  LYS 554           HE2      LYS 554  66.242  33.095  17.531
  866    HE3  LYS 554           HE1      LYS 554  65.106  33.745  18.713
  867    HZ1  LYS 554           HZ1      LYS 554  66.589  31.248  18.743
  868    HZ2  LYS 554           HZ2      LYS 554  64.984  31.157  19.292
  869    HZ3  LYS 554           HZ3      LYS 554  66.079  32.224  20.033
  870    HA   PRO 555           HA       PRO 555  58.903  30.305  13.151
  871    HB2  PRO 555           HB2      PRO 555  59.942  32.682  11.711
  872    HB3  PRO 555           HB1      PRO 555  58.276  32.237  12.094
  873    HG2  PRO 555           HG2      PRO 555  59.671  34.172  13.456
  874    HG3  PRO 555           HG1      PRO 555  58.351  33.243  14.173
  875    HD2  PRO 555           HD2      PRO 555  61.234  33.109  14.785
  876    HD3  PRO 555           HD1      PRO 555  59.869  32.429  15.703
  877    H    ILE 556           HN       ILE 556  59.057  28.942  11.531
  878    HA   ILE 556           HA       ILE 556  61.645  28.530  10.147
  879    HB   ILE 556           HB       ILE 556  59.041  26.966  10.253
  880   HG12  ILE 556          HG12      ILE 556  61.741  25.989  11.179
  881   HG13  ILE 556          HG11      ILE 556  60.822  27.045  12.229
  882   HG21  ILE 556          HG21      ILE 556  59.949  26.573   8.088
  883   HG22  ILE 556          HG22      ILE 556  60.447  25.207   9.085
  884   HG23  ILE 556          HG23      ILE 556  61.596  26.488   8.715
  885   HD11  ILE 556          HD11      ILE 556  60.543  24.349  12.245
  886   HD12  ILE 556          HD12      ILE 556  59.310  24.752  11.056
  887   HD13  ILE 556          HD13      ILE 556  59.232  25.439  12.678
  888    H    THR 557           HN       THR 557  61.733  30.139   8.548
  889    HA   THR 557           HA       THR 557  59.327  30.556   6.834
  890    HB   THR 557           HB       THR 557  60.506  32.582   6.084
  891    HG1  THR 557           HG1      THR 557  62.546  31.338   7.499
  892   HG21  THR 557          HG21      THR 557  60.272  32.074   9.058
  893   HG22  THR 557          HG22      THR 557  59.090  32.832   7.992
  894   HG23  THR 557          HG23      THR 557  60.587  33.676   8.387
  895    H    GLY 558           HN       GLY 558  59.436  28.773   5.490
  896    HA2  GLY 558           HA2      GLY 558  60.521  28.853   3.011
  897    HA3  GLY 558           HA1      GLY 558  61.855  28.160   3.947
  898    H    ARG 559           HN       ARG 559  61.646  26.103   4.784
  899    HA   ARG 559           HA       ARG 559  59.216  24.538   4.005
  900    HB2  ARG 559           HB2      ARG 559  62.163  23.895   4.011
  901    HB3  ARG 559           HB1      ARG 559  61.001  22.591   4.250
  902    HG2  ARG 559           HG2      ARG 559  60.614  24.519   1.968
  903    HG3  ARG 559           HG1      ARG 559  61.792  23.221   1.808
  904    HD2  ARG 559           HD2      ARG 559  60.162  21.545   1.926
  905    HD3  ARG 559           HD1      ARG 559  59.009  22.583   2.766
  906    HE   ARG 559           HE       ARG 559  59.312  23.797   0.293
  907   HH11  ARG 559          HH11      ARG 559  58.000  23.292  -1.477
  908   HH12  ARG 559          HH12      ARG 559  57.237  21.739  -1.556
  909   HH21  ARG 559          HH21      ARG 559  58.564  20.637   1.452
  910   HH22  ARG 559          HH22      ARG 559  57.557  20.236   0.101
  911    H    CYS 560           HN       CYS 560  58.508  23.007   5.644
  912    HA   CYS 560           HA       CYS 560  59.860  23.218   8.273
  913    HB2  CYS 560           HB2      CYS 560  57.745  23.709   9.437
  914    HB3  CYS 560           HB1      CYS 560  58.225  25.019   8.353
  915    HG   CYS 560           HG       CYS 560  55.604  23.851   8.159
  916    H    ILE 561           HN       ILE 561  60.027  21.369   9.205
  917    HA   ILE 561           HA       ILE 561  58.444  19.075   8.238
  918    HB   ILE 561           HB       ILE 561  60.747  19.294  10.198
  919   HG12  ILE 561          HG12      ILE 561  60.514  18.408   7.328
  920   HG13  ILE 561          HG11      ILE 561  61.319  19.861   7.894
  921   HG21  ILE 561          HG21      ILE 561  59.606  16.805   8.906
  922   HG22  ILE 561          HG22      ILE 561  59.205  17.295  10.557
  923   HG23  ILE 561          HG23      ILE 561  60.868  16.888  10.133
  924   HD11  ILE 561          HD11      ILE 561  62.130  16.989   8.392
  925   HD12  ILE 561          HD12      ILE 561  62.817  18.354   9.280
  926   HD13  ILE 561          HD13      ILE 561  63.044  18.235   7.534
  927    H    THR 562           HN       THR 562  57.118  17.945   9.580
  928    HA   THR 562           HA       THR 562  56.430  19.202  12.213
  929    HB   THR 562           HB       THR 562  54.444  17.731  10.489
  930    HG1  THR 562           HG1      THR 562  54.519  19.426   9.262
  931   HG21  THR 562          HG21      THR 562  52.831  18.711  11.959
  932   HG22  THR 562          HG22      THR 562  54.037  19.790  12.661
  933   HG23  THR 562          HG23      THR 562  54.108  18.057  12.988
  934    H    ALA 563           HN       ALA 563  55.983  17.854  13.869
  935    HA   ALA 563           HA       ALA 563  56.582  14.953  13.462
  936    HB1  ALA 563           HB1      ALA 563  58.373  16.347  14.586
  937    HB2  ALA 563           HB2      ALA 563  57.777  14.977  15.538
  938    HB3  ALA 563           HB3      ALA 563  57.222  16.613  15.899
  939    H    MET 564           HN       MET 564  56.053  15.227  16.568
  940    HA   MET 564           HA       MET 564  53.418  14.108  16.532
  941    HB2  MET 564           HB2      MET 564  54.619  15.444  18.944
  942    HB3  MET 564           HB1      MET 564  53.669  13.959  18.855
  943    HG2  MET 564           HG2      MET 564  55.652  13.013  17.477
  944    HG3  MET 564           HG1      MET 564  56.551  14.396  18.096
  945    HE1  MET 564           HE1      MET 564  55.414  10.553  20.175
  946    HE2  MET 564           HE2      MET 564  55.909  10.866  18.514
  947    HE3  MET 564           HE3      MET 564  54.305  11.357  19.055
  948    H    ALA 565           HN       ALA 565  53.856  16.760  15.349
  949    HA   ALA 565           HA       ALA 565  52.094  18.383  14.933
  950    HB1  ALA 565           HB1      ALA 565  51.829  18.602  17.946
  951    HB2  ALA 565           HB2      ALA 565  50.751  17.606  16.959
  952    HB3  ALA 565           HB3      ALA 565  50.811  19.348  16.718
  953    H    LYS 566           HN       LYS 566  54.907  18.045  16.670
  954    HA   LYS 566           HA       LYS 566  55.408  20.895  17.151
  955    HB2  LYS 566           HB2      LYS 566  57.337  18.557  17.174
  956    HB3  LYS 566           HB1      LYS 566  57.591  20.134  17.899
  957    HG2  LYS 566           HG2      LYS 566  55.366  18.240  18.703
  958    HG3  LYS 566           HG1      LYS 566  56.907  18.354  19.536
  959    HD2  LYS 566           HD2      LYS 566  55.887  19.945  20.834
  960    HD3  LYS 566           HD1      LYS 566  56.134  21.022  19.463
  961    HE2  LYS 566           HE2      LYS 566  53.843  21.267  19.846
  962    HE3  LYS 566           HE1      LYS 566  53.844  19.994  18.627
  963    HZ1  LYS 566           HZ1      LYS 566  52.422  19.397  20.462
  964    HZ2  LYS 566           HZ2      LYS 566  53.696  19.606  21.567
  965    HZ3  LYS 566           HZ3      LYS 566  53.759  18.355  20.419
  966    H    LYS 567           HN       LYS 567  56.888  22.163  15.909
  967    HA   LYS 567           HA       LYS 567  57.212  21.215  13.109
  968    HB2  LYS 567           HB2      LYS 567  57.979  23.953  14.050
  969    HB3  LYS 567           HB1      LYS 567  57.339  23.465  12.493
  970    HG2  LYS 567           HG2      LYS 567  55.796  23.578  15.109
  971    HG3  LYS 567           HG1      LYS 567  55.630  24.692  13.761
  972    HD2  LYS 567           HD2      LYS 567  55.035  21.704  13.593
  973    HD3  LYS 567           HD1      LYS 567  53.825  22.967  13.815
  974    HE2  LYS 567           HE2      LYS 567  54.786  24.038  11.679
  975    HE3  LYS 567           HE1      LYS 567  55.586  22.491  11.414
  976    HZ1  LYS 567           HZ1      LYS 567  52.930  23.174  10.882
  977    HZ2  LYS 567           HZ2      LYS 567  52.924  21.994  12.105
  978    HZ3  LYS 567           HZ3      LYS 567  53.702  21.686  10.626
  979    H    PHE 568           HN       PHE 568  59.445  22.062  12.105
  980    HA   PHE 568           HA       PHE 568  61.655  21.981  14.043
  981    HB2  PHE 568           HB2      PHE 568  60.682  19.543  12.727
  982    HB3  PHE 568           HB1      PHE 568  62.374  19.812  12.364
  983    HD1  PHE 568           HD1      PHE 568  60.320  18.112  14.542
  984    HD2  PHE 568           HD2      PHE 568  63.658  20.818  14.630
  985    HE1  PHE 568           HE1      PHE 568  60.941  17.274  16.790
  986    HE2  PHE 568           HE2      PHE 568  64.277  19.978  16.880
  987    HZ   PHE 568           HZ       PHE 568  62.919  18.206  17.960
  988    H    HIS 569           HN       HIS 569  63.415  22.984  13.183
  989    HA   HIS 569           HA       HIS 569  63.320  24.314  10.683
  990    HB2  HIS 569           HB2      HIS 569  65.507  23.527  12.564
  991    HB3  HIS 569           HB1      HIS 569  65.966  24.122  10.981
  992    HD2  HIS 569           HD2      HIS 569  64.440  26.787  10.521
  993    HE1  HIS 569           HE1      HIS 569  65.117  27.759  14.569
  994    HA   PRO 570           HA       PRO 570  63.503  20.390   8.344
  995    HB2  PRO 570           HB2      PRO 570  64.541  22.203   6.204
  996    HB3  PRO 570           HB1      PRO 570  63.226  21.018   6.133
  997    HG2  PRO 570           HG2      PRO 570  62.769  23.705   6.270
  998    HG3  PRO 570           HG1      PRO 570  61.658  22.510   6.947
  999    HD2  PRO 570           HD2      PRO 570  63.448  24.392   8.372
 1000    HD3  PRO 570           HD1      PRO 570  62.011  23.529   8.971
 1001    H    GLU 571           HN       GLU 571  66.031  22.553   9.149
 1002    HA   GLU 571           HA       GLU 571  68.157  20.790   8.068
 1003    HB2  GLU 571           HB2      GLU 571  68.663  23.298   9.654
 1004    HB3  GLU 571           HB1      GLU 571  69.618  22.591   8.352
 1005    HG2  GLU 571           HG2      GLU 571  67.683  23.091   6.801
 1006    HG3  GLU 571           HG1      GLU 571  66.960  24.003   8.129
 1007    H    HIS 572           HN       HIS 572  67.291  22.348  11.158
 1008    HA   HIS 572           HA       HIS 572  69.173  20.929  12.734
 1009    HB2  HIS 572           HB2      HIS 572  66.433  21.821  13.688
 1010    HB3  HIS 572           HB1      HIS 572  67.881  21.602  14.670
 1011    HD2  HIS 572           HD2      HIS 572  69.726  23.120  12.131
 1012    HE1  HIS 572           HE1      HIS 572  67.719  26.542  13.547
 1013    H    PHE 573           HN       PHE 573  66.686  19.641  10.966
 1014    HA   PHE 573           HA       PHE 573  66.713  17.151  12.643
 1015    HB2  PHE 573           HB2      PHE 573  64.482  18.543  12.524
 1016    HB3  PHE 573           HB1      PHE 573  64.371  17.883  10.897
 1017    HD1  PHE 573           HD1      PHE 573  64.888  16.866  14.459
 1018    HD2  PHE 573           HD2      PHE 573  63.522  15.705  10.554
 1019    HE1  PHE 573           HE1      PHE 573  64.042  14.729  15.390
 1020    HE2  PHE 573           HE2      PHE 573  62.676  13.568  11.487
 1021    HZ   PHE 573           HZ       PHE 573  62.937  13.080  13.904
 1022    H    VAL 574           HN       VAL 574  68.635  17.421  10.842
 1023    HA   VAL 574           HA       VAL 574  67.779  16.371   8.231
 1024    HB   VAL 574           HB       VAL 574  70.238  16.481   7.712
 1025   HG11  VAL 574          HG11      VAL 574  69.762  18.534   6.906
 1026   HG12  VAL 574          HG12      VAL 574  69.869  19.248   8.493
 1027   HG13  VAL 574          HG13      VAL 574  68.336  18.588   7.923
 1028   HG21  VAL 574          HG21      VAL 574  70.989  16.240  10.073
 1029   HG22  VAL 574          HG22      VAL 574  70.345  17.852  10.425
 1030   HG23  VAL 574          HG23      VAL 574  71.692  17.660   9.295
 1031    H    CYS 575           HN       CYS 575  69.412  14.606   7.379
 1032    HA   CYS 575           HA       CYS 575  69.197  12.263   9.148
 1033    HB2  CYS 575           HB2      CYS 575  68.894  11.364   7.086
 1034    HB3  CYS 575           HB1      CYS 575  69.556  12.796   6.305
 1035    H    ALA 576           HN       ALA 576  70.999  11.215  10.171
 1036    HA   ALA 576           HA       ALA 576  73.463  12.912  10.153
 1037    HB1  ALA 576           HB1      ALA 576  72.266  11.722  12.220
 1038    HB2  ALA 576           HB2      ALA 576  74.026  11.841  12.154
 1039    HB3  ALA 576           HB3      ALA 576  73.228  10.335  11.703
 1040    H    PHE 577           HN       PHE 577  73.766  12.338   7.892
 1041    HA   PHE 577           HA       PHE 577  75.793  10.258   7.537
 1042    HB2  PHE 577           HB2      PHE 577  73.594   9.140   6.810
 1043    HB3  PHE 577           HB1      PHE 577  73.471  10.380   5.575
 1044    HD1  PHE 577           HD1      PHE 577  75.832   7.728   6.844
 1045    HD2  PHE 577           HD2      PHE 577  74.499  10.076   3.495
 1046    HE1  PHE 577           HE1      PHE 577  77.280   6.408   5.338
 1047    HE2  PHE 577           HE2      PHE 577  75.951   8.743   1.994
 1048    HZ   PHE 577           HZ       PHE 577  77.339   6.915   2.912
 1049    H    CYS 578           HN       CYS 578  73.563  12.263   5.830
 1050    HA   CYS 578           HA       CYS 578  75.686  14.102   4.816
 1051    HB2  CYS 578           HB2      CYS 578  74.127  14.513   2.904
 1052    HB3  CYS 578           HB1      CYS 578  74.645  12.839   2.944
 1053    H    LEU 579           HN       LEU 579  75.281  15.192   6.865
 1054    HA   LEU 579           HA       LEU 579  72.859  15.942   7.976
 1055    HB2  LEU 579           HB2      LEU 579  75.486  17.426   7.907
 1056    HB3  LEU 579           HB1      LEU 579  74.146  17.867   8.960
 1057    HG   LEU 579           HG       LEU 579  74.817  14.980   9.107
 1058   HD11  LEU 579          HD11      LEU 579  76.896  15.242  10.364
 1059   HD12  LEU 579          HD12      LEU 579  76.869  16.985  10.095
 1060   HD13  LEU 579          HD13      LEU 579  77.095  15.887   8.735
 1061   HD21  LEU 579          HD21      LEU 579  73.336  16.410  10.661
 1062   HD22  LEU 579          HD22      LEU 579  74.845  17.034  11.330
 1063   HD23  LEU 579          HD23      LEU 579  74.477  15.311  11.436
 1064    H    LYS 580           HN       LYS 580  73.175  16.703   4.813
 1065    HA   LYS 580           HA       LYS 580  72.598  19.591   5.102
 1066    HB2  LYS 580           HB2      LYS 580  72.959  19.776   2.837
 1067    HB3  LYS 580           HB1      LYS 580  73.846  18.292   3.135
 1068    HG2  LYS 580           HG2      LYS 580  70.953  18.347   2.168
 1069    HG3  LYS 580           HG1      LYS 580  72.346  18.239   1.108
 1070    HD2  LYS 580           HD2      LYS 580  72.910  16.101   1.805
 1071    HD3  LYS 580           HD1      LYS 580  72.122  16.282   3.370
 1072    HE2  LYS 580           HE2      LYS 580  70.982  14.788   1.560
 1073    HE3  LYS 580           HE1      LYS 580  69.993  15.914   2.487
 1074    HZ1  LYS 580           HZ1      LYS 580  71.056  16.285  -0.253
 1075    HZ2  LYS 580           HZ2      LYS 580  70.362  17.543   0.653
 1076    HZ3  LYS 580           HZ3      LYS 580  69.430  16.189   0.220
 1077    H    GLN 581           HN       GLN 581  70.609  16.664   4.284
 1078    HA   GLN 581           HA       GLN 581  68.319  18.193   5.199
 1079    HB2  GLN 581           HB2      GLN 581  68.658  19.027   2.877
 1080    HB3  GLN 581           HB1      GLN 581  68.234  17.420   2.295
 1081    HG2  GLN 581           HG2      GLN 581  66.205  18.658   2.258
 1082    HG3  GLN 581           HG1      GLN 581  66.092  17.669   3.700
 1083   HE21  GLN 581          HE21      GLN 581  66.746  18.795   5.797
 1084   HE22  GLN 581          HE22      GLN 581  66.453  20.453   5.917
 1085    H    LEU 582           HN       LEU 582  66.572  17.060   5.759
 1086    HA   LEU 582           HA       LEU 582  66.365  14.201   4.959
 1087    HB2  LEU 582           HB2      LEU 582  67.373  14.497   7.253
 1088    HB3  LEU 582           HB1      LEU 582  65.855  15.212   7.764
 1089    HG   LEU 582           HG       LEU 582  64.691  13.110   7.238
 1090   HD11  LEU 582          HD11      LEU 582  65.685  11.887   5.575
 1091   HD12  LEU 582          HD12      LEU 582  66.572  11.138   6.900
 1092   HD13  LEU 582          HD13      LEU 582  67.297  12.453   5.982
 1093   HD21  LEU 582          HD21      LEU 582  67.077  13.085   9.077
 1094   HD22  LEU 582          HD22      LEU 582  66.068  11.650   8.926
 1095   HD23  LEU 582          HD23      LEU 582  65.363  13.169   9.472
 1096    H    ASN 583           HN       ASN 583  64.065  13.395   5.592
 1097    HA   ASN 583           HA       ASN 583  62.034  15.570   5.594
 1098    HB2  ASN 583           HB2      ASN 583  62.497  13.594   3.356
 1099    HB3  ASN 583           HB1      ASN 583  60.885  14.233   3.652
 1100   HD21  ASN 583          HD21      ASN 583  62.052  14.856   1.241
 1101   HD22  ASN 583          HD22      ASN 583  62.523  16.482   1.217
 1102    H    LYS 584           HN       LYS 584  60.402  15.002   6.900
 1103    HA   LYS 584           HA       LYS 584  60.287  12.700   8.472
 1104    HB2  LYS 584           HB2      LYS 584  57.819  13.294   8.669
 1105    HB3  LYS 584           HB1      LYS 584  58.949  14.602   9.022
 1106    HG2  LYS 584           HG2      LYS 584  58.524  15.720   7.006
 1107    HG3  LYS 584           HG1      LYS 584  57.969  14.262   6.183
 1108    HD2  LYS 584           HD2      LYS 584  55.998  15.497   6.541
 1109    HD3  LYS 584           HD1      LYS 584  55.988  14.315   7.840
 1110    HE2  LYS 584           HE2      LYS 584  55.508  16.288   8.996
 1111    HE3  LYS 584           HE1      LYS 584  57.258  16.197   9.182
 1112    HZ1  LYS 584           HZ1      LYS 584  55.881  17.684   7.015
 1113    HZ2  LYS 584           HZ2      LYS 584  57.546  17.687   7.355
 1114    HZ3  LYS 584           HZ3      LYS 584  56.451  18.394   8.445
 1115    H    GLY 585           HN       GLY 585  59.437  13.081   5.152
 1116    HA2  GLY 585           HA2      GLY 585  57.682  10.729   5.074
 1117    HA3  GLY 585           HA1      GLY 585  58.170  11.715   3.697
 1118    H    THR 586           HN       THR 586  60.988  11.504   4.738
 1119    HA   THR 586           HA       THR 586  61.591   8.670   3.996
 1120    HB   THR 586           HB       THR 586  63.095   9.294   2.330
 1121    HG1  THR 586           HG1      THR 586  63.283  11.645   3.851
 1122   HG21  THR 586          HG21      THR 586  61.201  11.662   2.296
 1123   HG22  THR 586          HG22      THR 586  60.753  10.041   1.764
 1124   HG23  THR 586          HG23      THR 586  62.014  10.931   0.909
 1125    H    PHE 587           HN       PHE 587  61.501  10.201   6.555
 1126    HA   PHE 587           HA       PHE 587  64.373  10.417   7.250
 1127    HB2  PHE 587           HB2      PHE 587  63.754  11.493   9.215
 1128    HB3  PHE 587           HB1      PHE 587  62.515  12.012   8.094
 1129    HD1  PHE 587           HD1      PHE 587  60.592   9.874   7.959
 1130    HD2  PHE 587           HD2      PHE 587  62.852  11.220  11.355
 1131    HE1  PHE 587           HE1      PHE 587  58.851   8.976   9.471
 1132    HE2  PHE 587           HE2      PHE 587  61.110  10.315  12.867
 1133    HZ   PHE 587           HZ       PHE 587  59.110   9.194  11.926
 1134    H    LYS 588           HN       LYS 588  65.347   8.585   7.524
 1135    HA   LYS 588           HA       LYS 588  64.077   6.327   8.981
 1136    HB2  LYS 588           HB2      LYS 588  65.635   6.491   6.632
 1137    HB3  LYS 588           HB1      LYS 588  66.752   5.908   7.826
 1138    HG2  LYS 588           HG2      LYS 588  65.579   4.099   6.542
 1139    HG3  LYS 588           HG1      LYS 588  65.443   3.967   8.281
 1140    HD2  LYS 588           HD2      LYS 588  63.342   3.562   6.755
 1141    HD3  LYS 588           HD1      LYS 588  63.163   4.416   8.266
 1142    HE2  LYS 588           HE2      LYS 588  62.791   6.465   7.200
 1143    HE3  LYS 588           HE1      LYS 588  63.707   6.002   5.786
 1144    HZ1  LYS 588           HZ1      LYS 588  61.036   5.984   5.948
 1145    HZ2  LYS 588           HZ2      LYS 588  61.408   4.359   6.277
 1146    HZ3  LYS 588           HZ3      LYS 588  61.941   5.079   4.834
 1147    H    GLU 589           HN       GLU 589  65.682   5.186  10.530
 1148    HA   GLU 589           HA       GLU 589  67.683   7.022  11.704
 1149    HB2  GLU 589           HB2      GLU 589  65.889   7.881  12.920
 1150    HB3  GLU 589           HB1      GLU 589  65.064   6.331  13.016
 1151    HG2  GLU 589           HG2      GLU 589  66.595   5.532  14.679
 1152    HG3  GLU 589           HG1      GLU 589  67.702   6.883  14.413
 1153    H    GLN 590           HN       GLN 590  68.958   6.059  13.284
 1154    HA   GLN 590           HA       GLN 590  68.761   3.194  13.835
 1155    HB2  GLN 590           HB2      GLN 590  70.016   3.575  11.554
 1156    HB3  GLN 590           HB1      GLN 590  71.324   4.176  12.563
 1157    HG2  GLN 590           HG2      GLN 590  71.942   1.953  12.586
 1158    HG3  GLN 590           HG1      GLN 590  70.773   1.875  13.902
 1159   HE21  GLN 590          HE21      GLN 590  71.512   0.704  10.742
 1160   HE22  GLN 590          HE22      GLN 590  70.068  -0.146  10.481
 1161    H    ASN 591           HN       ASN 591  69.992   2.726  15.729
 1162    HA   ASN 591           HA       ASN 591  70.810   3.341  17.828
 1163    HB2  ASN 591           HB2      ASN 591  72.976   4.952  17.381
 1164    HB3  ASN 591           HB1      ASN 591  73.006   3.212  17.186
 1165   HD21  ASN 591          HD21      ASN 591  72.113   2.547  14.890
 1166   HD22  ASN 591          HD22      ASN 591  72.727   3.440  13.591
 1167    H    ASP 592           HN       ASP 592  68.762   5.177  16.558
 1168    HA   ASP 592           HA       ASP 592  67.579   7.018  17.446
 1169    HB2  ASP 592           HB2      ASP 592  69.975   7.886  19.042
 1170    HB3  ASP 592           HB1      ASP 592  68.264   8.105  19.398
 1171    H    LYS 593           HN       LYS 593  70.398   7.033  15.714
 1172    HA   LYS 593           HA       LYS 593  70.657   9.932  15.408
 1173    HB2  LYS 593           HB2      LYS 593  71.975   7.719  13.858
 1174    HB3  LYS 593           HB1      LYS 593  72.498   9.393  13.981
 1175    HG2  LYS 593           HG2      LYS 593  72.576   8.911  16.556
 1176    HG3  LYS 593           HG1      LYS 593  72.607   7.220  16.060
 1177    HD2  LYS 593           HD2      LYS 593  74.609   7.600  14.721
 1178    HD3  LYS 593           HD1      LYS 593  74.554   9.329  15.073
 1179    HE2  LYS 593           HE2      LYS 593  74.737   7.244  17.256
 1180    HE3  LYS 593           HE1      LYS 593  76.168   7.935  16.493
 1181    HZ1  LYS 593           HZ1      LYS 593  75.010   9.002  18.618
 1182    HZ2  LYS 593           HZ2      LYS 593  74.143   9.817  17.404
 1183    HZ3  LYS 593           HZ3      LYS 593  75.838   9.928  17.464
 1184    HA   PRO 594           HA       PRO 594  67.396   9.821  12.193
 1185    HB2  PRO 594           HB2      PRO 594  68.869  12.254  11.294
 1186    HB3  PRO 594           HB1      PRO 594  67.141  12.041  11.576
 1187    HG2  PRO 594           HG2      PRO 594  68.735  13.411  13.279
 1188    HG3  PRO 594           HG1      PRO 594  67.348  12.468  13.848
 1189    HD2  PRO 594           HD2      PRO 594  70.254  11.869  14.128
 1190    HD3  PRO 594           HD1      PRO 594  68.883  11.302  15.110
 1191    H    TYR 595           HN       TYR 595  67.419   9.657   9.755
 1192    HA   TYR 595           HA       TYR 595  69.956   9.476   8.339
 1193    HB2  TYR 595           HB2      TYR 595  68.729   7.034   9.557
 1194    HB3  TYR 595           HB1      TYR 595  69.402   6.869   7.947
 1195    HD1  TYR 595           HD1      TYR 595  71.795   8.101   7.708
 1196    HD2  TYR 595           HD2      TYR 595  70.164   6.465  11.317
 1197    HE1  TYR 595           HE1      TYR 595  74.093   7.822   8.622
 1198    HE2  TYR 595           HE2      TYR 595  72.455   6.191  12.228
 1199    HH   TYR 595           HH       TYR 595  74.616   6.565  11.908
 1200    H    CYS 596           HN       CYS 596  69.566   9.367   6.086
 1201    HA   CYS 596           HA       CYS 596  66.743   9.414   5.218
 1202    HB2  CYS 596           HB2      CYS 596  69.150   9.159   3.392
 1203    HB3  CYS 596           HB1      CYS 596  67.557   9.784   3.005
 1204    H    GLN 597           HN       GLN 597  65.908   7.644   3.821
 1205    HA   GLN 597           HA       GLN 597  66.728   5.098   4.805
 1206    HB2  GLN 597           HB2      GLN 597  64.550   5.063   3.935
 1207    HB3  GLN 597           HB1      GLN 597  64.981   6.041   2.561
 1208    HG2  GLN 597           HG2      GLN 597  64.693   3.970   1.541
 1209    HG3  GLN 597           HG1      GLN 597  66.408   3.919   1.889
 1210   HE21  GLN 597          HE21      GLN 597  66.062   3.534   4.784
 1211   HE22  GLN 597          HE22      GLN 597  65.503   1.967   4.996
 1212    H    ASN 598           HN       ASN 598  67.209   6.575   1.607
 1213    HA   ASN 598           HA       ASN 598  68.995   4.775   0.489
 1214    HB2  ASN 598           HB2      ASN 598  69.570   7.715   0.244
 1215    HB3  ASN 598           HB1      ASN 598  69.569   6.474  -1.003
 1216   HD21  ASN 598          HD21      ASN 598  67.132   5.305  -0.776
 1217   HD22  ASN 598          HD22      ASN 598  65.894   6.432  -1.021
 1218    H    CYS 599           HN       CYS 599  69.548   6.982   3.128
 1219    HA   CYS 599           HA       CYS 599  72.460   6.624   3.055
 1220    HB2  CYS 599           HB2      CYS 599  70.554   8.050   4.917
 1221    HB3  CYS 599           HB1      CYS 599  72.264   7.872   5.293
 1222    H    PHE 600           HN       PHE 600  69.981   5.975   5.578
 1223    HA   PHE 600           HA       PHE 600  71.541   4.260   7.154
 1224    HB2  PHE 600           HB2      PHE 600  69.600   4.624   8.302
 1225    HB3  PHE 600           HB1      PHE 600  68.687   4.901   6.830
 1226    HD1  PHE 600           HD1      PHE 600  67.708   2.975   5.588
 1227    HD2  PHE 600           HD2      PHE 600  69.615   2.483   9.401
 1228    HE1  PHE 600           HE1      PHE 600  66.636   0.752   5.834
 1229    HE2  PHE 600           HE2      PHE 600  68.542   0.260   9.649
 1230    HZ   PHE 600           HZ       PHE 600  67.055  -0.605   7.866
 1231    H    LEU 601           HN       LEU 601  69.246   3.300   4.567
 1232    HA   LEU 601           HA       LEU 601  69.726   0.550   4.639
 1233    HB2  LEU 601           HB2      LEU 601  68.348   0.583   2.828
 1234    HB3  LEU 601           HB1      LEU 601  68.354   2.329   2.980
 1235    HG   LEU 601           HG       LEU 601  70.370   2.368   1.432
 1236   HD11  LEU 601          HD11      LEU 601  69.995  -0.554   1.658
 1237   HD12  LEU 601          HD12      LEU 601  71.406   0.350   1.123
 1238   HD13  LEU 601          HD13      LEU 601  70.112  -0.002  -0.007
 1239   HD21  LEU 601          HD21      LEU 601  67.965   2.722   0.728
 1240   HD22  LEU 601          HD22      LEU 601  67.926   1.030   0.252
 1241   HD23  LEU 601          HD23      LEU 601  69.023   2.149  -0.555
 1242    H    LYS 602           HN       LYS 602  71.618   3.077   3.029
 1243    HA   LYS 602           HA       LYS 602  73.501   1.450   1.722
 1244    HB2  LYS 602           HB2      LYS 602  73.262   4.147   2.085
 1245    HB3  LYS 602           HB1      LYS 602  74.644   3.839   3.106
 1246    HG2  LYS 602           HG2      LYS 602  74.367   3.164   0.170
 1247    HG3  LYS 602           HG1      LYS 602  75.400   4.400   0.872
 1248    HD2  LYS 602           HD2      LYS 602  76.511   2.487   2.181
 1249    HD3  LYS 602           HD1      LYS 602  75.675   1.399   1.080
 1250    HE2  LYS 602           HE2      LYS 602  77.740   1.734   0.005
 1251    HE3  LYS 602           HE1      LYS 602  76.675   2.880  -0.806
 1252    HZ1  LYS 602           HZ1      LYS 602  77.493   4.436   1.109
 1253    HZ2  LYS 602           HZ2      LYS 602  78.425   4.220  -0.295
 1254    HZ3  LYS 602           HZ3      LYS 602  78.819   3.379   1.128
 1255    H    LEU 603           HN       LEU 603  73.089   2.045   5.123
 1256    HA   LEU 603           HA       LEU 603  75.752   0.953   5.804
 1257    HB2  LEU 603           HB2      LEU 603  73.676   1.650   7.857
 1258    HB3  LEU 603           HB1      LEU 603  75.428   1.840   7.929
 1259    HG   LEU 603           HG       LEU 603  73.523   3.474   6.227
 1260   HD11  LEU 603          HD11      LEU 603  73.902   5.252   7.717
 1261   HD12  LEU 603          HD12      LEU 603  75.296   4.458   8.445
 1262   HD13  LEU 603          HD13      LEU 603  73.670   3.860   8.774
 1263   HD21  LEU 603          HD21      LEU 603  75.568   4.818   5.723
 1264   HD22  LEU 603          HD22      LEU 603  75.669   3.182   5.083
 1265   HD23  LEU 603          HD23      LEU 603  76.536   3.604   6.556
 1266    H    PHE 604           HN       PHE 604  72.385   0.186   6.791
 1267    HA   PHE 604           HA       PHE 604  73.289  -2.468   7.703
 1268    HB2  PHE 604           HB2      PHE 604  70.834  -0.792   7.989
 1269    HB3  PHE 604           HB1      PHE 604  70.589  -2.534   8.055
 1270    HD1  PHE 604           HD1      PHE 604  73.113  -0.041   9.367
 1271    HD2  PHE 604           HD2      PHE 604  70.634  -3.463  10.195
 1272    HE1  PHE 604           HE1      PHE 604  73.934  -0.080  11.703
 1273    HE2  PHE 604           HE2      PHE 604  71.460  -3.491  12.530
 1274    HZ   PHE 604           HZ       PHE 604  73.109  -1.802  13.284
 1275    H    CYS 605           HN       CYS 605  73.416  -1.871   4.812
 1276    HA   CYS 605           HA       CYS 605  71.833  -4.224   3.898
 1277    HB2  CYS 605           HB2      CYS 605  70.694  -1.902   3.403
 1278    HB3  CYS 605           HB1      CYS 605  71.918  -1.783   2.137
 1279    HG   CYS 605           HG       CYS 605  70.770  -3.575   0.836
  Start of MODEL   14
    1    H    MET   1           HT1      MET   1  93.445 -23.002  10.700
    2    HA   MET   1           HA       MET   1  92.148 -25.312   9.471
    3    HB2  MET   1           HB2      MET   1  92.433 -23.055   8.382
    4    HB3  MET   1           HB1      MET   1  94.174 -23.312   8.424
    5    HG2  MET   1           HG2      MET   1  93.631 -25.565   7.213
    6    HG3  MET   1           HG1      MET   1  92.082 -24.808   6.855
    7    HE1  MET   1           HE1      MET   1  95.525 -24.628   4.251
    8    HE2  MET   1           HE2      MET   1  94.518 -25.879   4.977
    9    HE3  MET   1           HE3      MET   1  95.794 -25.122   5.928
   10    H    ALA   2           HN       ALA   2  95.271 -24.692   8.316
   11    HA   ALA   2           HA       ALA   2  96.605 -26.684  10.049
   12    HB1  ALA   2           HB1      ALA   2  97.156 -28.165   8.211
   13    HB2  ALA   2           HB2      ALA   2  96.337 -27.106   7.064
   14    HB3  ALA   2           HB3      ALA   2  95.402 -27.988   8.273
   15    H    LEU   3           HN       LEU   3  96.613 -24.179   7.688
   16    HA   LEU   3           HA       LEU   3  99.111 -23.959   6.605
   17    HB2  LEU   3           HB2      LEU   3  97.442 -21.898   8.047
   18    HB3  LEU   3           HB1      LEU   3  98.938 -21.449   7.233
   19    HG   LEU   3           HG       LEU   3  96.661 -22.932   5.886
   20   HD11  LEU   3          HD11      LEU   3  95.889 -20.720   6.567
   21   HD12  LEU   3          HD12      LEU   3  96.144 -20.739   4.822
   22   HD13  LEU   3          HD13      LEU   3  97.331 -19.974   5.879
   23   HD21  LEU   3          HD21      LEU   3  98.013 -21.746   3.876
   24   HD22  LEU   3          HD22      LEU   3  98.455 -23.332   4.493
   25   HD23  LEU   3          HD23      LEU   3  99.343 -21.907   5.024
   26    H    ASP   4           HN       ASP   4  98.465 -22.334   9.621
   27    HA   ASP   4           HA       ASP   4  99.894 -21.768  11.384
   28    HB2  ASP   4           HB2      ASP   4  99.253 -24.022  12.023
   29    HB3  ASP   4           HB1      ASP   4 100.476 -24.698  10.950
   30    H    GLY   5           HN       GLY   5 100.972 -21.738   8.529
   31    HA2  GLY   5           HA2      GLY   5 103.781 -22.364   8.617
   32    HA3  GLY   5           HA1      GLY   5 102.995 -21.273   7.470
   33    H    ILE   6           HN       ILE   6 101.890 -20.067  10.074
   34    HA   ILE   6           HA       ILE   6 104.141 -18.145  10.469
   35    HB   ILE   6           HB       ILE   6 101.852 -16.909  11.459
   36   HG12  ILE   6          HG12      ILE   6 100.597 -18.941  10.467
   37   HG13  ILE   6          HG11      ILE   6  99.999 -17.341  10.071
   38   HG21  ILE   6          HG21      ILE   6 103.108 -16.829   8.728
   39   HG22  ILE   6          HG22      ILE   6 103.376 -15.730  10.082
   40   HG23  ILE   6          HG23      ILE   6 101.834 -15.716   9.227
   41   HD11  ILE   6          HD11      ILE   6 100.473 -19.258   8.211
   42   HD12  ILE   6          HD12      ILE   6 102.030 -18.434   8.189
   43   HD13  ILE   6          HD13      ILE   6 100.551 -17.534   7.863
   44    H    ARG   7           HN       ARG   7 101.547 -17.993  12.781
   45    HA   ARG   7           HA       ARG   7 102.828 -19.841  14.632
   46    HB2  ARG   7           HB2      ARG   7 103.211 -17.991  16.324
   47    HB3  ARG   7           HB1      ARG   7 104.326 -18.074  14.977
   48    HG2  ARG   7           HG2      ARG   7 101.962 -16.334  14.517
   49    HG3  ARG   7           HG1      ARG   7 103.083 -15.776  15.761
   50    HD2  ARG   7           HD2      ARG   7 104.947 -15.974  14.139
   51    HD3  ARG   7           HD1      ARG   7 103.791 -16.466  12.906
   52    HE   ARG   7           HE       ARG   7 103.178 -14.206  12.673
   53   HH11  ARG   7          HH11      ARG   7 103.202 -12.030  13.277
   54   HH12  ARG   7          HH12      ARG   7 103.901 -11.574  14.795
   55   HH21  ARG   7          HH21      ARG   7 104.751 -14.816  15.680
   56   HH22  ARG   7          HH22      ARG   7 104.777 -13.151  16.154
   57    H    MET   8           HN       MET   8 101.174 -17.007  15.913
   58    HA   MET   8           HA       MET   8  98.668 -18.628  16.100
   59    HB2  MET   8           HB2      MET   8  99.135 -17.129  18.576
   60    HB3  MET   8           HB1      MET   8  98.731 -18.819  18.345
   61    HG2  MET   8           HG2      MET   8 101.116 -19.272  17.740
   62    HG3  MET   8           HG1      MET   8 101.510 -17.613  18.163
   63    HE1  MET   8           HE1      MET   8 102.940 -19.873  21.020
   64    HE2  MET   8           HE2      MET   8 103.298 -18.432  20.072
   65    HE3  MET   8           HE3      MET   8 102.932 -19.947  19.251
   66    HA   PRO   9           HA       PRO   9  97.327 -14.005  16.777
   67    HB2  PRO   9           HB2      PRO   9  99.724 -12.668  15.555
   68    HB3  PRO   9           HB1      PRO   9  98.670 -12.100  16.871
   69    HG2  PRO   9           HG2      PRO   9 101.033 -13.035  17.463
   70    HG3  PRO   9           HG1      PRO   9  99.624 -13.563  18.410
   71    HD2  PRO   9           HD2      PRO   9 101.019 -15.033  16.190
   72    HD3  PRO   9           HD1      PRO   9 100.531 -15.631  17.777
   73    H    ASP  10           HN       ASP  10  99.448 -14.960  14.175
   74    HA   ASP  10           HA       ASP  10  97.424 -14.112  12.139
   75    HB2  ASP  10           HB2      ASP  10  99.836 -13.183  12.050
   76    HB3  ASP  10           HB1      ASP  10 100.310 -14.812  11.576
   77    H    GLY  11           HN       GLY  11  99.258 -16.708  13.520
   78    HA2  GLY  11           HA2      GLY  11  98.528 -18.619  11.414
   79    HA3  GLY  11           HA1      GLY  11  99.422 -18.981  12.884
   80    H    CYS  12           HN       CYS  12  96.857 -17.260  13.968
   81    HA   CYS  12           HA       CYS  12  94.835 -19.388  13.858
   82    HB2  CYS  12           HB2      CYS  12  95.030 -20.181  16.025
   83    HB3  CYS  12           HB1      CYS  12  96.710 -19.777  15.697
   84    HG   CYS  12           HG       CYS  12  95.247 -17.422  16.940
   85    H    TYR  13           HN       TYR  13  95.867 -16.237  14.969
   86    HA   TYR  13           HA       TYR  13  94.703 -14.300  15.465
   87    HB2  TYR  13           HB2      TYR  13  92.594 -15.749  13.840
   88    HB3  TYR  13           HB1      TYR  13  92.414 -14.106  14.427
   89    HD1  TYR  13           HD1      TYR  13  93.938 -16.247  11.931
   90    HD2  TYR  13           HD2      TYR  13  94.050 -12.333  13.698
   91    HE1  TYR  13           HE1      TYR  13  95.220 -15.404   9.982
   92    HE2  TYR  13           HE2      TYR  13  95.333 -11.490  11.750
   93    HH   TYR  13           HH       TYR  13  95.509 -12.322   9.166
   94    H    ALA  14           HN       ALA  14  91.694 -16.086  15.521
   95    HA   ALA  14           HA       ALA  14  91.570 -17.157  18.062
   96    HB1  ALA  14           HB1      ALA  14  91.600 -14.177  18.111
   97    HB2  ALA  14           HB2      ALA  14  92.152 -15.316  19.336
   98    HB3  ALA  14           HB3      ALA  14  90.432 -14.960  19.179
   99    H    ASP  15           HN       ASP  15  89.922 -14.941  15.865
  100    HA   ASP  15           HA       ASP  15  87.575 -16.743  15.923
  101    HB2  ASP  15           HB2      ASP  15  87.316 -14.860  17.665
  102    HB3  ASP  15           HB1      ASP  15  87.177 -13.770  16.286
  103    H    GLY  16           HN       GLY  16  89.777 -15.014  14.198
  104    HA2  GLY  16           HA2      GLY  16  89.850 -14.903  11.808
  105    HA3  GLY  16           HA1      GLY  16  88.100 -15.121  11.761
  106    H    THR  17           HN       THR  17  89.151 -12.812  14.063
  107    HA   THR  17           HA       THR  17  87.938 -10.664  12.464
  108    HB   THR  17           HB       THR  17  87.356 -10.392  14.725
  109    HG1  THR  17           HG1      THR  17  88.209  -8.477  14.008
  110   HG21  THR  17          HG21      THR  17  90.198 -11.226  15.295
  111   HG22  THR  17          HG22      THR  17  88.719 -12.083  15.729
  112   HG23  THR  17          HG23      THR  17  89.129 -10.570  16.534
  113    H    TRP  18           HN       TRP  18  89.062  -9.371  11.233
  114    HA   TRP  18           HA       TRP  18  91.958  -8.874  11.770
  115    HB2  TRP  18           HB2      TRP  18  91.784  -8.578   9.051
  116    HB3  TRP  18           HB1      TRP  18  92.330 -10.048   9.838
  117    HD1  TRP  18           HD1      TRP  18  89.048  -8.497   8.509
  118    HE1  TRP  18           HE1      TRP  18  87.538 -10.422   7.687
  119    HE3  TRP  18           HE3      TRP  18  91.916 -12.503   9.848
  120    HZ2  TRP  18           HZ2      TRP  18  87.548 -13.281   7.610
  121    HZ3  TRP  18           HZ3      TRP  18  91.144 -14.813   9.391
  122    HH2  TRP  18           HH2      TRP  18  88.964 -15.207   8.275
  123    H    GLU  19           HN       GLU  19  92.169  -6.748  12.203
  124    HA   GLU  19           HA       GLU  19  90.016  -4.906  11.576
  125    HB2  GLU  19           HB2      GLU  19  92.185  -3.283  12.279
  126    HB3  GLU  19           HB1      GLU  19  90.963  -3.895  13.385
  127    HG2  GLU  19           HG2      GLU  19  93.277  -4.378  14.131
  128    HG3  GLU  19           HG1      GLU  19  92.309  -5.829  13.881
  129    H    LEU  20           HN       LEU  20  89.777  -3.756   9.750
  130    HA   LEU  20           HA       LEU  20  91.822  -4.022   7.664
  131    HB2  LEU  20           HB2      LEU  20  89.003  -3.619   7.724
  132    HB3  LEU  20           HB1      LEU  20  89.663  -2.152   7.017
  133    HG   LEU  20           HG       LEU  20  89.194  -3.719   5.241
  134   HD11  LEU  20          HD11      LEU  20  91.141  -3.455   4.086
  135   HD12  LEU  20          HD12      LEU  20  92.157  -4.055   5.393
  136   HD13  LEU  20          HD13      LEU  20  91.528  -2.407   5.450
  137   HD21  LEU  20          HD21      LEU  20  91.154  -5.734   6.320
  138   HD22  LEU  20          HD22      LEU  20  89.812  -5.970   5.211
  139   HD23  LEU  20          HD23      LEU  20  89.497  -5.741   6.925
  140    H    SER  21           HN       SER  21  93.275  -2.442   7.146
  141    HA   SER  21           HA       SER  21  93.538  -0.207   9.001
  142    HB2  SER  21           HB2      SER  21  95.379  -1.573   7.629
  143    HB3  SER  21           HB1      SER  21  95.078  -0.311   6.437
  144    HG   SER  21           HG       SER  21  95.361   0.506   9.075
  145    H    VAL  22           HN       VAL  22  93.205   1.963   8.531
  146    HA   VAL  22           HA       VAL  22  91.978   2.600   5.901
  147    HB   VAL  22           HB       VAL  22  90.728   2.975   8.622
  148   HG11  VAL  22          HG11      VAL  22  90.646   5.208   7.650
  149   HG12  VAL  22          HG12      VAL  22  89.066   4.451   7.515
  150   HG13  VAL  22          HG13      VAL  22  90.121   4.541   6.097
  151   HG21  VAL  22          HG21      VAL  22  89.700   2.077   5.913
  152   HG22  VAL  22          HG22      VAL  22  88.777   2.071   7.422
  153   HG23  VAL  22          HG23      VAL  22  90.167   1.000   7.234
  154    H    HIS  23           HN       HIS  23  93.437   3.962   5.113
  155    HA   HIS  23           HA       HIS  23  94.807   5.924   6.814
  156    HB2  HIS  23           HB2      HIS  23  94.883   5.108   3.925
  157    HB3  HIS  23           HB1      HIS  23  95.574   6.664   4.386
  158    HD1  HIS  23           HD1      HIS  23  95.868   2.980   5.320
  159    HD2  HIS  23           HD2      HIS  23  98.136   6.475   5.437
  160    HE1  HIS  23           HE1      HIS  23  98.180   2.308   6.106
  161    H    VAL  24           HN       VAL  24  93.374   7.527   7.523
  162    HA   VAL  24           HA       VAL  24  91.251   8.470   5.754
  163    HB   VAL  24           HB       VAL  24  92.293   9.990   8.132
  164   HG11  VAL  24          HG11      VAL  24  89.520   9.544   7.025
  165   HG12  VAL  24          HG12      VAL  24  90.502  10.976   6.731
  166   HG13  VAL  24          HG13      VAL  24  89.937  10.611   8.362
  167   HG21  VAL  24          HG21      VAL  24  90.851   8.603   9.573
  168   HG22  VAL  24          HG22      VAL  24  92.090   7.611   8.809
  169   HG23  VAL  24          HG23      VAL  24  90.441   7.591   8.189
  170    H    THR  25           HN       THR  25  91.628   9.806   4.062
  171    HA   THR  25           HA       THR  25  94.250  11.050   3.788
  172    HB   THR  25           HB       THR  25  93.638  11.440   1.565
  173    HG1  THR  25           HG1      THR  25  91.712  12.134   1.000
  174   HG21  THR  25          HG21      THR  25  93.458   9.001   2.224
  175   HG22  THR  25          HG22      THR  25  92.522   9.440   0.796
  176   HG23  THR  25          HG23      THR  25  91.714   9.232   2.349
  177    H    ASP  26           HN       ASP  26  90.943  12.488   3.683
  178    HA   ASP  26           HA       ASP  26  91.734  15.169   3.775
  179    HB2  ASP  26           HB2      ASP  26  89.400  14.562   3.496
  180    HB3  ASP  26           HB1      ASP  26  89.345  13.879   5.122
  181    H    LEU  27           HN       LEU  27  92.316  12.805   6.127
  182    HA   LEU  27           HA       LEU  27  92.886  14.900   8.209
  183    HB2  LEU  27           HB2      LEU  27  91.643  12.205   8.343
  184    HB3  LEU  27           HB1      LEU  27  92.777  12.566   9.635
  185    HG   LEU  27           HG       LEU  27  90.661  14.592   8.909
  186   HD11  LEU  27          HD11      LEU  27  89.321  13.449  10.836
  187   HD12  LEU  27          HD12      LEU  27  90.273  12.019  10.433
  188   HD13  LEU  27          HD13      LEU  27  89.228  12.756   9.217
  189   HD21  LEU  27          HD21      LEU  27  91.771  13.841  11.621
  190   HD22  LEU  27          HD22      LEU  27  91.013  15.357  11.131
  191   HD23  LEU  27          HD23      LEU  27  92.626  14.949  10.547
  192    H    ASN  28           HN       ASN  28  93.956  11.950   6.621
  193    HA   ASN  28           HA       ASN  28  96.152  11.341   6.040
  194    HB2  ASN  28           HB2      ASN  28  96.701  13.850   6.485
  195    HB3  ASN  28           HB1      ASN  28  97.328  13.279   8.028
  196   HD21  ASN  28          HD21      ASN  28  97.953  10.633   6.553
  197   HD22  ASN  28          HD22      ASN  28  99.430  10.952   5.785
  198    H    ARG  29           HN       ARG  29  94.555  10.780   8.820
  199    HA   ARG  29           HA       ARG  29  96.799   9.583  10.257
  200    HB2  ARG  29           HB2      ARG  29  95.166   9.076  11.956
  201    HB3  ARG  29           HB1      ARG  29  95.136  10.781  11.565
  202    HG2  ARG  29           HG2      ARG  29  93.284  10.358  10.056
  203    HG3  ARG  29           HG1      ARG  29  93.276   8.669  10.507
  204    HD2  ARG  29           HD2      ARG  29  92.699   9.188  12.770
  205    HD3  ARG  29           HD1      ARG  29  92.972  10.903  12.491
  206    HE   ARG  29           HE       ARG  29  90.988  10.344  10.691
  207   HH11  ARG  29          HH11      ARG  29  88.779  10.350  11.174
  208   HH12  ARG  29          HH12      ARG  29  88.262  10.050  12.800
  209   HH21  ARG  29          HH21      ARG  29  91.479   9.661  14.034
  210   HH22  ARG  29          HH22      ARG  29  89.791   9.662  14.420
  211    H    ASP  30           HN       ASP  30  95.906   7.355  11.250
  212    HA   ASP  30           HA       ASP  30  94.883   5.665   9.036
  213    HB2  ASP  30           HB2      ASP  30  97.287   5.108  10.787
  214    HB3  ASP  30           HB1      ASP  30  96.504   3.896   9.773
  215    H    VAL  31           HN       VAL  31  93.069   4.812   9.715
  216    HA   VAL  31           HA       VAL  31  92.740   4.153  12.620
  217    HB   VAL  31           HB       VAL  31  90.615   4.495  10.490
  218   HG11  VAL  31          HG11      VAL  31  89.872   3.132  12.327
  219   HG12  VAL  31          HG12      VAL  31  89.168   4.736  12.527
  220   HG13  VAL  31          HG13      VAL  31  90.556   4.254  13.501
  221   HG21  VAL  31          HG21      VAL  31  90.221   6.714  11.475
  222   HG22  VAL  31          HG22      VAL  31  91.891   6.610  10.918
  223   HG23  VAL  31          HG23      VAL  31  91.524   6.453  12.635
  224    H    THR  32           HN       THR  32  91.655   2.167  13.107
  225    HA   THR  32           HA       THR  32  91.667   0.115  10.939
  226    HB   THR  32           HB       THR  32  92.435  -1.192  13.363
  227    HG1  THR  32           HG1      THR  32  94.534   0.388  13.130
  228   HG21  THR  32          HG21      THR  32  94.359  -0.420  11.166
  229   HG22  THR  32          HG22      THR  32  93.117  -1.647  10.913
  230   HG23  THR  32          HG23      THR  32  94.349  -1.884  12.150
  231    H    LEU  33           HN       LEU  33  89.835  -1.078  10.960
  232    HA   LEU  33           HA       LEU  33  87.970  -0.784  13.284
  233    HB2  LEU  33           HB2      LEU  33  87.581  -1.018  10.306
  234    HB3  LEU  33           HB1      LEU  33  86.292  -1.482  11.395
  235    HG   LEU  33           HG       LEU  33  86.281   0.928  10.472
  236   HD11  LEU  33          HD11      LEU  33  86.173   0.629  13.479
  237   HD12  LEU  33          HD12      LEU  33  84.900   0.100  12.383
  238   HD13  LEU  33          HD13      LEU  33  85.328   1.811  12.486
  239   HD21  LEU  33          HD21      LEU  33  87.637   2.552  11.514
  240   HD22  LEU  33          HD22      LEU  33  88.748   1.268  11.050
  241   HD23  LEU  33          HD23      LEU  33  88.223   1.424  12.731
  242    H    ARG  34           HN       ARG  34  88.023  -2.616  14.462
  243    HA   ARG  34           HA       ARG  34  88.948  -5.167  13.603
  244    HB2  ARG  34           HB2      ARG  34  88.615  -4.386  16.006
  245    HB3  ARG  34           HB1      ARG  34  86.892  -4.643  15.769
  246    HG2  ARG  34           HG2      ARG  34  87.566  -6.685  16.707
  247    HG3  ARG  34           HG1      ARG  34  87.576  -7.035  14.982
  248    HD2  ARG  34           HD2      ARG  34  89.929  -6.950  14.857
  249    HD3  ARG  34           HD1      ARG  34  90.069  -6.065  16.360
  250    HE   ARG  34           HE       ARG  34  88.894  -8.674  16.776
  251   HH11  ARG  34          HH11      ARG  34  90.178 -10.139  17.931
  252   HH12  ARG  34          HH12      ARG  34  91.876  -9.838  18.092
  253   HH21  ARG  34          HH21      ARG  34  91.794  -6.876  16.294
  254   HH22  ARG  34          HH22      ARG  34  92.791  -7.991  17.168
  255    H    VAL  35           HN       VAL  35  87.983  -6.023  11.794
  256    HA   VAL  35           HA       VAL  35  85.011  -6.432  11.870
  257    HB   VAL  35           HB       VAL  35  85.050  -6.116   9.392
  258   HG11  VAL  35          HG11      VAL  35  85.426  -3.586   9.538
  259   HG12  VAL  35          HG12      VAL  35  85.902  -3.858  11.216
  260   HG13  VAL  35          HG13      VAL  35  84.268  -4.265  10.683
  261   HG21  VAL  35          HG21      VAL  35  87.880  -5.199   9.974
  262   HG22  VAL  35          HG22      VAL  35  87.032  -4.893   8.460
  263   HG23  VAL  35          HG23      VAL  35  87.395  -6.547   8.948
  264    H    THR  36           HN       THR  36  84.656  -7.864   9.665
  265    HA   THR  36           HA       THR  36  86.600 -10.095   9.593
  266    HB   THR  36           HB       THR  36  84.515 -11.657   9.739
  267    HG1  THR  36           HG1      THR  36  83.600  -9.373  11.143
  268   HG21  THR  36          HG21      THR  36  85.693 -10.224  12.114
  269   HG22  THR  36          HG22      THR  36  86.196 -11.769  11.422
  270   HG23  THR  36          HG23      THR  36  84.650 -11.637  12.260
  271    H    GLY  37           HN       GLY  37  85.763 -11.645   7.758
  272    HA2  GLY  37           HA2      GLY  37  85.198  -9.953   5.467
  273    HA3  GLY  37           HA1      GLY  37  85.457 -11.692   5.414
  274    H    GLU  38           HN       GLU  38  83.128  -9.810   7.300
  275    HA   GLU  38           HA       GLU  38  80.897 -10.939   5.701
  276    HB2  GLU  38           HB2      GLU  38  79.797 -11.881   7.556
  277    HB3  GLU  38           HB1      GLU  38  81.466 -12.393   7.746
  278    HG2  GLU  38           HG2      GLU  38  81.095 -11.606   9.899
  279    HG3  GLU  38           HG1      GLU  38  81.616 -10.102   9.142
  280    H    VAL  39           HN       VAL  39  82.380  -8.291   6.935
  281    HA   VAL  39           HA       VAL  39  79.941  -6.899   7.833
  282    HB   VAL  39           HB       VAL  39  81.356  -5.151   8.526
  283   HG11  VAL  39          HG11      VAL  39  83.141  -7.550   8.821
  284   HG12  VAL  39          HG12      VAL  39  81.588  -7.453   9.648
  285   HG13  VAL  39          HG13      VAL  39  82.838  -6.259   9.985
  286   HG21  VAL  39          HG21      VAL  39  83.786  -5.073   7.834
  287   HG22  VAL  39          HG22      VAL  39  82.658  -4.741   6.532
  288   HG23  VAL  39          HG23      VAL  39  83.425  -6.328   6.652
  289    H    HIS  40           HN       HIS  40  78.784  -5.516   6.552
  290    HA   HIS  40           HA       HIS  40  79.445  -5.393   3.708
  291    HB2  HIS  40           HB2      HIS  40  77.361  -3.623   4.974
  292    HB3  HIS  40           HB1      HIS  40  77.333  -4.443   3.411
  293    HD1  HIS  40           HD1      HIS  40  77.146  -7.161   3.569
  294    HD2  HIS  40           HD2      HIS  40  76.077  -5.031   6.988
  295    HE1  HIS  40           HE1      HIS  40  75.809  -8.753   5.015
  296    H    ILE  41           HN       ILE  41  80.227  -3.546   2.579
  297    HA   ILE  41           HA       ILE  41  82.086  -1.859   3.819
  298    HB   ILE  41           HB       ILE  41  80.324  -1.151   1.459
  299   HG12  ILE  41          HG12      ILE  41  83.126  -2.303   1.424
  300   HG13  ILE  41          HG11      ILE  41  81.676  -3.306   1.323
  301   HG21  ILE  41          HG21      ILE  41  82.894   0.001   2.552
  302   HG22  ILE  41          HG22      ILE  41  81.386   0.845   2.194
  303   HG23  ILE  41          HG23      ILE  41  82.397   0.240   0.876
  304   HD11  ILE  41          HD11      ILE  41  82.006  -0.949  -0.524
  305   HD12  ILE  41          HD12      ILE  41  81.029  -2.402  -0.735
  306   HD13  ILE  41          HD13      ILE  41  82.785  -2.488  -0.896
  307    H    GLY  42           HN       GLY  42  78.702  -1.094   3.029
  308    HA2  GLY  42           HA2      GLY  42  78.594   1.474   4.154
  309    HA3  GLY  42           HA1      GLY  42  77.212   0.392   4.068
  310    H    GLY  43           HN       GLY  43  79.054  -1.536   5.604
  311    HA2  GLY  43           HA2      GLY  43  78.084  -0.744   8.272
  312    HA3  GLY  43           HA1      GLY  43  78.875  -2.265   7.852
  313    H    VAL  44           HN       VAL  44  81.035  -0.760   6.431
  314    HA   VAL  44           HA       VAL  44  82.780  -0.389   8.760
  315    HB   VAL  44           HB       VAL  44  83.208  -0.292   5.761
  316   HG11  VAL  44          HG11      VAL  44  85.679  -0.136   6.394
  317   HG12  VAL  44          HG12      VAL  44  85.144   0.359   8.000
  318   HG13  VAL  44          HG13      VAL  44  84.749   1.349   6.595
  319   HG21  VAL  44          HG21      VAL  44  82.936  -2.476   7.044
  320   HG22  VAL  44          HG22      VAL  44  84.443  -2.077   7.868
  321   HG23  VAL  44          HG23      VAL  44  84.430  -2.317   6.121
  322    H    MET  45           HN       MET  45  81.664   1.713   6.032
  323    HA   MET  45           HA       MET  45  82.929   4.067   6.978
  324    HB2  MET  45           HB2      MET  45  80.850   5.224   5.882
  325    HB3  MET  45           HB1      MET  45  81.986   4.372   4.861
  326    HG2  MET  45           HG2      MET  45  80.368   2.956   4.156
  327    HG3  MET  45           HG1      MET  45  79.952   2.505   5.794
  328    HE1  MET  45           HE1      MET  45  78.798   3.413   2.783
  329    HE2  MET  45           HE2      MET  45  77.645   4.738   2.842
  330    HE3  MET  45           HE3      MET  45  77.167   3.146   3.415
  331    H    LEU  46           HN       LEU  46  79.803   2.615   7.840
  332    HA   LEU  46           HA       LEU  46  78.758   4.638   9.481
  333    HB2  LEU  46           HB2      LEU  46  77.572   2.525   9.018
  334    HB3  LEU  46           HB1      LEU  46  78.736   1.644   9.999
  335    HG   LEU  46           HG       LEU  46  77.483   3.957  11.404
  336   HD11  LEU  46          HD11      LEU  46  75.424   2.376  11.890
  337   HD12  LEU  46          HD12      LEU  46  75.806   1.718  10.298
  338   HD13  LEU  46          HD13      LEU  46  75.421   3.429  10.480
  339   HD21  LEU  46          HD21      LEU  46  77.798   1.021  12.134
  340   HD22  LEU  46          HD22      LEU  46  77.343   2.318  13.238
  341   HD23  LEU  46          HD23      LEU  46  78.954   2.293  12.526
  342    H    LYS  47           HN       LYS  47  80.816   1.934  10.587
  343    HA   LYS  47           HA       LYS  47  81.213   2.822  13.208
  344    HB2  LYS  47           HB2      LYS  47  83.269   1.442  11.474
  345    HB3  LYS  47           HB1      LYS  47  83.203   1.438  13.241
  346    HG2  LYS  47           HG2      LYS  47  81.085   0.263  13.214
  347    HG3  LYS  47           HG1      LYS  47  81.012   0.383  11.462
  348    HD2  LYS  47           HD2      LYS  47  83.112  -0.961  11.316
  349    HD3  LYS  47           HD1      LYS  47  83.056  -1.166  13.068
  350    HE2  LYS  47           HE2      LYS  47  80.789  -1.970  11.229
  351    HE3  LYS  47           HE1      LYS  47  82.056  -3.081  11.748
  352    HZ1  LYS  47           HZ1      LYS  47  80.982  -3.382  13.641
  353    HZ2  LYS  47           HZ2      LYS  47  79.747  -2.335  13.129
  354    HZ3  LYS  47           HZ3      LYS  47  81.075  -1.727  13.996
  355    H    LEU  48           HN       LEU  48  83.423   3.539  10.424
  356    HA   LEU  48           HA       LEU  48  85.228   5.206  11.736
  357    HB2  LEU  48           HB2      LEU  48  84.093   5.229   8.964
  358    HB3  LEU  48           HB1      LEU  48  84.975   6.659   9.463
  359    HG   LEU  48           HG       LEU  48  86.458   5.101   8.307
  360   HD11  LEU  48          HD11      LEU  48  88.263   5.262   9.719
  361   HD12  LEU  48          HD12      LEU  48  87.339   4.806  11.144
  362   HD13  LEU  48          HD13      LEU  48  87.169   6.424  10.472
  363   HD21  LEU  48          HD21      LEU  48  86.924   2.889   9.303
  364   HD22  LEU  48          HD22      LEU  48  85.254   3.060   8.750
  365   HD23  LEU  48          HD23      LEU  48  85.629   3.174  10.470
  366    H    VAL  49           HN       VAL  49  82.311   6.421  10.106
  367    HA   VAL  49           HA       VAL  49  82.373   9.024  11.144
  368    HB   VAL  49           HB       VAL  49  79.981   7.286  10.489
  369   HG11  VAL  49          HG11      VAL  49  79.423   9.353  11.839
  370   HG12  VAL  49          HG12      VAL  49  78.728   9.343  10.221
  371   HG13  VAL  49          HG13      VAL  49  80.161  10.306  10.556
  372   HG21  VAL  49          HG21      VAL  49  80.154   8.318   8.288
  373   HG22  VAL  49          HG22      VAL  49  81.713   7.592   8.706
  374   HG23  VAL  49          HG23      VAL  49  81.480   9.346   8.844
  375    H    GLU  50           HN       GLU  50  80.700   6.158  12.563
  376    HA   GLU  50           HA       GLU  50  79.592   7.362  14.815
  377    HB2  GLU  50           HB2      GLU  50  80.963   4.681  14.573
  378    HB3  GLU  50           HB1      GLU  50  80.124   5.186  16.031
  379    HG2  GLU  50           HG2      GLU  50  78.823   5.180  13.298
  380    HG3  GLU  50           HG1      GLU  50  78.724   3.821  14.417
  381    H    LYS  51           HN       LYS  51  82.989   6.417  14.355
  382    HA   LYS  51           HA       LYS  51  83.834   7.147  17.007
  383    HB2  LYS  51           HB2      LYS  51  85.386   6.943  14.408
  384    HB3  LYS  51           HB1      LYS  51  86.107   7.059  16.011
  385    HG2  LYS  51           HG2      LYS  51  85.188   4.953  16.680
  386    HG3  LYS  51           HG1      LYS  51  84.148   4.874  15.264
  387    HD2  LYS  51           HD2      LYS  51  86.049   4.621  13.800
  388    HD3  LYS  51           HD1      LYS  51  87.159   4.848  15.143
  389    HE2  LYS  51           HE2      LYS  51  86.920   2.463  14.711
  390    HE3  LYS  51           HE1      LYS  51  86.169   2.873  16.246
  391    HZ1  LYS  51           HZ1      LYS  51  84.861   1.416  14.645
  392    HZ2  LYS  51           HZ2      LYS  51  84.589   2.847  13.770
  393    HZ3  LYS  51           HZ3      LYS  51  84.055   2.715  15.377
  394    H    LEU  52           HN       LEU  52  84.352   8.843  13.884
  395    HA   LEU  52           HA       LEU  52  84.717  11.403  15.369
  396    HB2  LEU  52           HB2      LEU  52  86.483  10.350  13.781
  397    HB3  LEU  52           HB1      LEU  52  85.351  10.829  12.516
  398    HG   LEU  52           HG       LEU  52  85.432  13.159  13.376
  399   HD11  LEU  52          HD11      LEU  52  87.176  11.860  15.414
  400   HD12  LEU  52          HD12      LEU  52  86.094  13.242  15.570
  401   HD13  LEU  52          HD13      LEU  52  87.687  13.455  14.855
  402   HD21  LEU  52          HD21      LEU  52  87.399  13.721  12.221
  403   HD22  LEU  52          HD22      LEU  52  87.059  12.114  11.584
  404   HD23  LEU  52          HD23      LEU  52  88.277  12.325  12.840
  405    H    ASP  53           HN       ASP  53  82.184  10.444  14.879
  406    HA   ASP  53           HA       ASP  53  80.812  11.162  12.590
  407    HB2  ASP  53           HB2      ASP  53  79.714   9.965  14.410
  408    HB3  ASP  53           HB1      ASP  53  79.878  11.363  15.452
  409    H    VAL  54           HN       VAL  54  80.246  13.004  15.369
  410    HA   VAL  54           HA       VAL  54  79.769  15.268  15.592
  411    HB   VAL  54           HB       VAL  54  82.185  15.059  15.968
  412   HG11  VAL  54          HG11      VAL  54  83.065  14.318  13.903
  413   HG12  VAL  54          HG12      VAL  54  83.682  15.953  14.102
  414   HG13  VAL  54          HG13      VAL  54  82.335  15.652  13.018
  415   HG21  VAL  54          HG21      VAL  54  82.598  17.372  16.027
  416   HG22  VAL  54          HG22      VAL  54  80.838  17.305  15.976
  417   HG23  VAL  54          HG23      VAL  54  81.751  17.664  14.510
  418    H    LYS  55           HN       LYS  55  79.952  17.521  14.294
  419    HA   LYS  55           HA       LYS  55  78.267  17.067  11.964
  420    HB2  LYS  55           HB2      LYS  55  78.914  19.281  13.737
  421    HB3  LYS  55           HB1      LYS  55  79.036  19.818  12.071
  422    HG2  LYS  55           HG2      LYS  55  76.588  18.221  12.755
  423    HG3  LYS  55           HG1      LYS  55  76.694  19.817  13.452
  424    HD2  LYS  55           HD2      LYS  55  77.067  20.796  11.217
  425    HD3  LYS  55           HD1      LYS  55  76.943  19.194  10.499
  426    HE2  LYS  55           HE2      LYS  55  74.765  20.028  10.241
  427    HE3  LYS  55           HE1      LYS  55  74.631  19.101  11.733
  428    HZ1  LYS  55           HZ1      LYS  55  74.013  21.735  11.419
  429    HZ2  LYS  55           HZ2      LYS  55  75.525  21.774  12.193
  430    HZ3  LYS  55           HZ3      LYS  55  74.229  20.931  12.896
  431    H    LYS  56           HN       LYS  56  81.028  16.041  11.869
  432    HA   LYS  56           HA       LYS  56  82.434  17.825   9.996
  433    HB2  LYS  56           HB2      LYS  56  83.802  16.439  11.400
  434    HB3  LYS  56           HB1      LYS  56  82.975  14.974  10.870
  435    HG2  LYS  56           HG2      LYS  56  83.993  15.009   8.759
  436    HG3  LYS  56           HG1      LYS  56  84.325  16.739   8.831
  437    HD2  LYS  56           HD2      LYS  56  86.052  16.387  10.513
  438    HD3  LYS  56           HD1      LYS  56  85.677  14.668  10.590
  439    HE2  LYS  56           HE2      LYS  56  86.802  16.170   8.208
  440    HE3  LYS  56           HE1      LYS  56  87.644  14.979   9.195
  441    HZ1  LYS  56           HZ1      LYS  56  86.832  13.385   7.922
  442    HZ2  LYS  56           HZ2      LYS  56  86.044  14.535   6.952
  443    HZ3  LYS  56           HZ3      LYS  56  85.245  13.853   8.287
  444    H    ASP  57           HN       ASP  57  82.415  17.699   7.804
  445    HA   ASP  57           HA       ASP  57  80.218  16.671   6.411
  446    HB2  ASP  57           HB2      ASP  57  82.033  18.280   5.588
  447    HB3  ASP  57           HB1      ASP  57  82.961  16.851   5.159
  448    H    TRP  58           HN       TRP  58  79.591  14.579   6.358
  449    HA   TRP  58           HA       TRP  58  81.636  12.505   5.808
  450    HB2  TRP  58           HB2      TRP  58  79.254  12.437   7.642
  451    HB3  TRP  58           HB1      TRP  58  80.080  10.991   7.121
  452    HD1  TRP  58           HD1      TRP  58  79.890  12.843  10.017
  453    HE1  TRP  58           HE1      TRP  58  82.064  12.944  11.381
  454    HE3  TRP  58           HE3      TRP  58  83.317  11.364   6.461
  455    HZ2  TRP  58           HZ2      TRP  58  84.844  12.529  11.025
  456    HZ3  TRP  58           HZ3      TRP  58  85.705  11.252   7.029
  457    HH2  TRP  58           HH2      TRP  58  86.480  11.822   9.308
  458    H    SER  59           HN       SER  59  78.574  13.852   5.103
  459    HA   SER  59           HA       SER  59  77.012  11.948   3.922
  460    HB2  SER  59           HB2      SER  59  76.614  14.438   3.893
  461    HB3  SER  59           HB1      SER  59  77.721  14.546   2.533
  462    HG   SER  59           HG       SER  59  75.805  12.603   2.263
  463    H    ASP  60           HN       ASP  60  79.676  13.562   2.198
  464    HA   ASP  60           HA       ASP  60  79.476  11.729  -0.074
  465    HB2  ASP  60           HB2      ASP  60  80.034  14.057  -0.421
  466    HB3  ASP  60           HB1      ASP  60  81.383  13.922   0.708
  467    H    HIS  61           HN       HIS  61  80.538  11.020   2.844
  468    HA   HIS  61           HA       HIS  61  83.249  10.187   2.396
  469    HB2  HIS  61           HB2      HIS  61  83.183   9.235   4.539
  470    HB3  HIS  61           HB1      HIS  61  82.103  10.604   4.638
  471    HD1  HIS  61           HD1      HIS  61  79.910  10.082   5.683
  472    HD2  HIS  61           HD2      HIS  61  81.526   6.712   3.852
  473    HE1  HIS  61           HE1      HIS  61  78.313   8.187   6.143
  474    H    ALA  62           HN       ALA  62  84.109   8.167   2.084
  475    HA   ALA  62           HA       ALA  62  82.545   5.773   1.751
  476    HB1  ALA  62           HB1      ALA  62  83.218   5.649  -0.800
  477    HB2  ALA  62           HB2      ALA  62  83.242   7.409  -0.677
  478    HB3  ALA  62           HB3      ALA  62  81.759   6.521  -0.327
  479    H    LEU  63           HN       LEU  63  83.988   3.930   1.275
  480    HA   LEU  63           HA       LEU  63  86.825   4.563   1.926
  481    HB2  LEU  63           HB2      LEU  63  85.334   1.916   1.762
  482    HB3  LEU  63           HB1      LEU  63  87.042   2.058   2.123
  483    HG   LEU  63           HG       LEU  63  85.591   1.765   4.120
  484   HD11  LEU  63          HD11      LEU  63  86.852   4.485   4.248
  485   HD12  LEU  63          HD12      LEU  63  87.839   3.039   4.069
  486   HD13  LEU  63          HD13      LEU  63  86.805   3.234   5.482
  487   HD21  LEU  63          HD21      LEU  63  84.063   3.397   4.830
  488   HD22  LEU  63          HD22      LEU  63  83.735   3.240   3.105
  489   HD23  LEU  63          HD23      LEU  63  84.680   4.602   3.706
  490    H    TRP  64           HN       TRP  64  88.515   3.902   0.507
  491    HA   TRP  64           HA       TRP  64  87.650   3.066  -2.257
  492    HB2  TRP  64           HB2      TRP  64  88.384   5.067  -3.047
  493    HB3  TRP  64           HB1      TRP  64  88.754   5.568  -1.420
  494    HD1  TRP  64           HD1      TRP  64  91.335   4.122  -0.685
  495    HE1  TRP  64           HE1      TRP  64  93.516   4.445  -2.010
  496    HE3  TRP  64           HE3      TRP  64  89.437   5.884  -5.085
  497    HZ2  TRP  64           HZ2      TRP  64  94.354   5.372  -4.580
  498    HZ3  TRP  64           HZ3      TRP  64  90.952   6.501  -6.945
  499    HH2  TRP  64           HH2      TRP  64  93.406   6.250  -6.698
  500    H    TRP  65           HN       TRP  65  89.179   1.764  -3.404
  501    HA   TRP  65           HA       TRP  65  91.195   0.437  -1.620
  502    HB2  TRP  65           HB2      TRP  65  89.214  -0.914  -2.558
  503    HB3  TRP  65           HB1      TRP  65  89.996  -0.754  -4.126
  504    HD1  TRP  65           HD1      TRP  65  92.888  -0.913  -2.095
  505    HE1  TRP  65           HE1      TRP  65  93.761  -3.299  -1.754
  506    HE3  TRP  65           HE3      TRP  65  88.760  -3.581  -3.513
  507    HZ2  TRP  65           HZ2      TRP  65  92.849  -5.990  -2.041
  508    HZ3  TRP  65           HZ3      TRP  65  88.801  -6.058  -3.469
  509    HH2  TRP  65           HH2      TRP  65  90.838  -7.265  -2.736
  510    H    GLU  66           HN       GLU  66  92.989   1.769  -2.154
  511    HA   GLU  66           HA       GLU  66  93.649   2.733  -4.719
  512    HB2  GLU  66           HB2      GLU  66  96.022   2.764  -3.865
  513    HB3  GLU  66           HB1      GLU  66  94.839   3.563  -2.838
  514    HG2  GLU  66           HG2      GLU  66  94.665   1.509  -1.462
  515    HG3  GLU  66           HG1      GLU  66  95.887   0.753  -2.476
  516    H    LYS  67           HN       LYS  67  93.973  -0.528  -3.481
  517    HA   LYS  67           HA       LYS  67  95.953  -1.349  -5.435
  518    HB2  LYS  67           HB2      LYS  67  93.801  -3.110  -4.230
  519    HB3  LYS  67           HB1      LYS  67  95.356  -3.619  -4.876
  520    HG2  LYS  67           HG2      LYS  67  94.947  -1.898  -2.416
  521    HG3  LYS  67           HG1      LYS  67  95.397  -3.601  -2.418
  522    HD2  LYS  67           HD2      LYS  67  97.399  -2.864  -3.883
  523    HD3  LYS  67           HD1      LYS  67  97.010  -1.230  -3.343
  524    HE2  LYS  67           HE2      LYS  67  98.504  -1.853  -1.674
  525    HE3  LYS  67           HE1      LYS  67  96.993  -2.399  -0.942
  526    HZ1  LYS  67           HZ1      LYS  67  99.028  -3.995  -1.146
  527    HZ2  LYS  67           HZ2      LYS  67  98.445  -4.223  -2.726
  528    HZ3  LYS  67           HZ3      LYS  67  97.453  -4.575  -1.392
  529    H    LYS  68           HN       LYS  68  92.820  -0.290  -5.559
  530    HA   LYS  68           HA       LYS  68  92.388  -1.364  -8.304
  531    HB2  LYS  68           HB2      LYS  68  90.054  -0.859  -6.465
  532    HB3  LYS  68           HB1      LYS  68  90.168  -1.947  -7.845
  533    HG2  LYS  68           HG2      LYS  68  91.742  -2.437  -5.294
  534    HG3  LYS  68           HG1      LYS  68  90.108  -3.023  -5.518
  535    HD2  LYS  68           HD2      LYS  68  90.710  -4.396  -7.350
  536    HD3  LYS  68           HD1      LYS  68  92.257  -3.575  -7.554
  537    HE2  LYS  68           HE2      LYS  68  93.246  -4.715  -5.801
  538    HE3  LYS  68           HE1      LYS  68  91.735  -4.909  -4.916
  539    HZ1  LYS  68           HZ1      LYS  68  91.030  -6.540  -6.546
  540    HZ2  LYS  68           HZ2      LYS  68  92.504  -7.004  -5.840
  541    HZ3  LYS  68           HZ3      LYS  68  92.478  -6.348  -7.407
  542    H    ARG  69           HN       ARG  69  92.550   1.299  -6.168
  543    HA   ARG  69           HA       ARG  69  92.000   3.567  -6.429
  544    HB2  ARG  69           HB2      ARG  69  92.383   2.695  -9.314
  545    HB3  ARG  69           HB1      ARG  69  92.017   4.358  -8.878
  546    HG2  ARG  69           HG2      ARG  69  94.347   4.427  -8.941
  547    HG3  ARG  69           HG1      ARG  69  94.078   4.083  -7.236
  548    HD2  ARG  69           HD2      ARG  69  95.727   2.521  -7.915
  549    HD3  ARG  69           HD1      ARG  69  94.222   1.608  -7.890
  550    HE   ARG  69           HE       ARG  69  94.847   2.780 -10.496
  551   HH11  ARG  69          HH11      ARG  69  95.255   1.283 -12.139
  552   HH12  ARG  69          HH12      ARG  69  95.540  -0.376 -11.730
  553   HH21  ARG  69          HH21      ARG  69  95.187   0.128  -8.319
  554   HH22  ARG  69          HH22      ARG  69  95.502  -1.030  -9.568
  555    H    THR  70           HN       THR  70  89.888   1.910  -5.896
  556    HA   THR  70           HA       THR  70  87.703   2.828  -7.745
  557    HB   THR  70           HB       THR  70  88.188   0.333  -7.348
  558    HG1  THR  70           HG1      THR  70  86.277   0.871  -8.259
  559   HG21  THR  70          HG21      THR  70  86.610   0.691  -4.825
  560   HG22  THR  70          HG22      THR  70  88.370   0.791  -4.789
  561   HG23  THR  70          HG23      THR  70  87.582  -0.688  -5.339
  562    H    TRP  71           HN       TRP  71  85.556   2.580  -6.286
  563    HA   TRP  71           HA       TRP  71  85.944   4.131  -3.770
  564    HB2  TRP  71           HB2      TRP  71  83.499   4.981  -4.559
  565    HB3  TRP  71           HB1      TRP  71  84.969   5.833  -5.000
  566    HD1  TRP  71           HD1      TRP  71  82.943   2.863  -6.485
  567    HE1  TRP  71           HE1      TRP  71  82.916   3.110  -9.004
  568    HE3  TRP  71           HE3      TRP  71  85.745   7.102  -6.967
  569    HZ2  TRP  71           HZ2      TRP  71  83.935   4.877 -11.025
  570    HZ3  TRP  71           HZ3      TRP  71  86.200   8.046  -9.214
  571    HH2  TRP  71           HH2      TRP  71  85.299   6.939 -11.242
  572    H    LEU  72           HN       LEU  72  85.629   2.448  -2.393
  573    HA   LEU  72           HA       LEU  72  84.012   0.213  -2.973
  574    HB2  LEU  72           HB2      LEU  72  84.833   1.314  -0.302
  575    HB3  LEU  72           HB1      LEU  72  84.241  -0.316  -0.577
  576    HG   LEU  72           HG       LEU  72  86.608   0.832  -2.056
  577   HD11  LEU  72          HD11      LEU  72  87.936  -0.650  -0.410
  578   HD12  LEU  72          HD12      LEU  72  86.507  -0.525   0.620
  579   HD13  LEU  72          HD13      LEU  72  87.383   0.930   0.138
  580   HD21  LEU  72          HD21      LEU  72  85.359  -1.887  -1.797
  581   HD22  LEU  72          HD22      LEU  72  87.092  -1.768  -2.085
  582   HD23  LEU  72          HD23      LEU  72  85.961  -1.058  -3.233
  583    H    LEU  73           HN       LEU  73  82.102   1.014  -3.773
  584    HA   LEU  73           HA       LEU  73  80.123   1.927  -1.717
  585    HB2  LEU  73           HB2      LEU  73  78.826   2.923  -3.635
  586    HB3  LEU  73           HB1      LEU  73  80.363   3.720  -3.323
  587    HG   LEU  73           HG       LEU  73  81.212   1.936  -5.177
  588   HD11  LEU  73          HD11      LEU  73  78.426   2.604  -6.154
  589   HD12  LEU  73          HD12      LEU  73  78.799   1.068  -5.395
  590   HD13  LEU  73          HD13      LEU  73  79.606   1.524  -6.894
  591   HD21  LEU  73          HD21      LEU  73  79.801   4.569  -5.708
  592   HD22  LEU  73          HD22      LEU  73  80.818   3.740  -6.886
  593   HD23  LEU  73          HD23      LEU  73  81.513   4.337  -5.385
  594    H    LYS  74           HN       LYS  74  81.246  -0.658  -3.149
  595    HA   LYS  74           HA       LYS  74  78.907  -1.869  -4.352
  596    HB2  LYS  74           HB2      LYS  74  81.268  -3.364  -3.207
  597    HB3  LYS  74           HB1      LYS  74  80.231  -3.841  -4.537
  598    HG2  LYS  74           HG2      LYS  74  81.964  -1.362  -4.706
  599    HG3  LYS  74           HG1      LYS  74  82.607  -2.947  -5.075
  600    HD2  LYS  74           HD2      LYS  74  81.921  -2.406  -7.204
  601    HD3  LYS  74           HD1      LYS  74  80.391  -3.052  -6.640
  602    HE2  LYS  74           HE2      LYS  74  79.524  -0.875  -6.276
  603    HE3  LYS  74           HE1      LYS  74  81.114  -0.129  -6.396
  604    HZ1  LYS  74           HZ1      LYS  74  80.679   0.162  -8.532
  605    HZ2  LYS  74           HZ2      LYS  74  79.267  -0.780  -8.453
  606    HZ3  LYS  74           HZ3      LYS  74  80.771  -1.519  -8.735
  607    H    THR  75           HN       THR  75  77.777  -1.013  -2.121
  608    HA   THR  75           HA       THR  75  78.027  -2.636   0.211
  609    HB   THR  75           HB       THR  75  75.323  -1.607  -0.638
  610    HG1  THR  75           HG1      THR  75  77.665  -0.136  -0.360
  611   HG21  THR  75          HG21      THR  75  76.677  -0.962   1.955
  612   HG22  THR  75          HG22      THR  75  76.143  -2.626   1.703
  613   HG23  THR  75          HG23      THR  75  74.977  -1.305   1.635
  614    H    HIS  76           HN       HIS  76  77.183  -3.457  -2.884
  615    HA   HIS  76           HA       HIS  76  75.070  -5.129  -3.033
  616    HB2  HIS  76           HB2      HIS  76  77.859  -5.885  -3.928
  617    HB3  HIS  76           HB1      HIS  76  76.357  -6.576  -4.542
  618    HD1  HIS  76           HD1      HIS  76  76.393  -2.935  -3.787
  619    HD2  HIS  76           HD2      HIS  76  76.915  -5.385  -7.119
  620    HE1  HIS  76           HE1      HIS  76  76.275  -1.422  -5.813
  621    H    TRP  77           HN       TRP  77  78.210  -6.494  -1.916
  622    HA   TRP  77           HA       TRP  77  76.623  -8.297  -0.128
  623    HB2  TRP  77           HB2      TRP  77  77.676  -9.172  -2.461
  624    HB3  TRP  77           HB1      TRP  77  79.051  -9.449  -1.419
  625    HD1  TRP  77           HD1      TRP  77  77.475 -10.249   1.224
  626    HE1  TRP  77           HE1      TRP  77  76.268 -12.524   1.337
  627    HE3  TRP  77           HE3      TRP  77  76.993 -11.240  -3.763
  628    HZ2  TRP  77           HZ2      TRP  77  75.230 -14.500  -0.451
  629    HZ3  TRP  77           HZ3      TRP  77  75.889 -13.322  -4.529
  630    HH2  TRP  77           HH2      TRP  77  75.008 -14.951  -2.881
  631    H    THR  78           HN       THR  78  80.142  -8.757  -0.306
  632    HA   THR  78           HA       THR  78  80.510  -7.010   2.054
  633    HB   THR  78           HB       THR  78  81.549  -9.668   2.688
  634    HG1  THR  78           HG1      THR  78  79.335 -10.538   2.901
  635   HG21  THR  78          HG21      THR  78  81.145  -8.358   4.560
  636   HG22  THR  78          HG22      THR  78  79.708  -9.382   4.531
  637   HG23  THR  78          HG23      THR  78  79.611  -7.731   3.943
  638    H    LEU  79           HN       LEU  79  82.862  -8.055   2.975
  639    HA   LEU  79           HA       LEU  79  84.824  -7.044   1.102
  640    HB2  LEU  79           HB2      LEU  79  85.030  -8.641   3.657
  641    HB3  LEU  79           HB1      LEU  79  86.449  -8.115   2.771
  642    HG   LEU  79           HG       LEU  79  85.863  -5.783   3.110
  643   HD11  LEU  79          HD11      LEU  79  83.476  -5.794   2.954
  644   HD12  LEU  79          HD12      LEU  79  83.846  -5.292   4.602
  645   HD13  LEU  79          HD13      LEU  79  83.341  -6.949   4.282
  646   HD21  LEU  79          HD21      LEU  79  85.688  -7.545   5.575
  647   HD22  LEU  79          HD22      LEU  79  85.747  -5.783   5.688
  648   HD23  LEU  79          HD23      LEU  79  87.090  -6.666   4.960
  649    H    ASP  80           HN       ASP  80  84.270 -10.226   2.532
  650    HA   ASP  80           HA       ASP  80  85.968 -11.870   1.139
  651    HB2  ASP  80           HB2      ASP  80  84.268 -12.521   2.859
  652    HB3  ASP  80           HB1      ASP  80  83.043 -12.467   1.595
  653    H    LYS  81           HN       LYS  81  82.773 -10.806  -0.019
  654    HA   LYS  81           HA       LYS  81  82.934 -12.233  -2.454
  655    HB2  LYS  81           HB2      LYS  81  80.766 -11.611  -2.371
  656    HB3  LYS  81           HB1      LYS  81  81.136 -10.380  -1.181
  657    HG2  LYS  81           HG2      LYS  81  81.730  -9.855  -4.088
  658    HG3  LYS  81           HG1      LYS  81  80.090  -9.701  -3.502
  659    HD2  LYS  81           HD2      LYS  81  80.998  -8.190  -1.703
  660    HD3  LYS  81           HD1      LYS  81  82.517  -8.189  -2.558
  661    HE2  LYS  81           HE2      LYS  81  81.158  -7.476  -4.623
  662    HE3  LYS  81           HE1      LYS  81  79.855  -7.140  -3.483
  663    HZ1  LYS  81           HZ1      LYS  81  80.874  -5.141  -3.426
  664    HZ2  LYS  81           HZ2      LYS  81  82.393  -5.763  -3.866
  665    HZ3  LYS  81           HZ3      LYS  81  81.843  -5.908  -2.265
  666    H    TYR  82           HN       TYR  82  84.263  -9.213  -1.439
  667    HA   TYR  82           HA       TYR  82  85.065  -8.455  -4.165
  668    HB2  TYR  82           HB2      TYR  82  84.502  -6.993  -1.956
  669    HB3  TYR  82           HB1      TYR  82  86.237  -7.136  -1.746
  670    HD1  TYR  82           HD1      TYR  82  86.948  -7.208  -4.759
  671    HD2  TYR  82           HD2      TYR  82  84.389  -4.659  -2.437
  672    HE1  TYR  82           HE1      TYR  82  87.272  -5.388  -6.404
  673    HE2  TYR  82           HE2      TYR  82  84.715  -2.839  -4.084
  674    HH   TYR  82           HH       TYR  82  85.355  -2.523  -6.370
  675    H    GLY  83           HN       GLY  83  86.630  -9.511  -1.135
  676    HA2  GLY  83           HA2      GLY  83  88.416 -11.246  -1.280
  677    HA3  GLY  83           HA1      GLY  83  88.993 -10.449  -2.747
  678    H    ILE  84           HN       ILE  84  87.831  -8.491  -0.180
  679    HA   ILE  84           HA       ILE  84  90.454  -7.237   0.141
  680    HB   ILE  84           HB       ILE  84  87.760  -6.723   1.426
  681   HG12  ILE  84          HG12      ILE  84  89.158  -4.907  -0.538
  682   HG13  ILE  84          HG11      ILE  84  88.285  -6.313  -1.137
  683   HG21  ILE  84          HG21      ILE  84  89.416  -5.892   2.931
  684   HG22  ILE  84          HG22      ILE  84  88.853  -4.500   2.013
  685   HG23  ILE  84          HG23      ILE  84  90.398  -5.253   1.614
  686   HD11  ILE  84          HD11      ILE  84  86.236  -5.564  -0.038
  687   HD12  ILE  84          HD12      ILE  84  86.859  -4.269  -1.061
  688   HD13  ILE  84          HD13      ILE  84  87.095  -4.204   0.685
  689    H    GLN  85           HN       GLN  85  91.376  -6.893   2.316
  690    HA   GLN  85           HA       GLN  85  90.564  -8.534   4.546
  691    HB2  GLN  85           HB2      GLN  85  91.822 -10.047   2.701
  692    HB3  GLN  85           HB1      GLN  85  93.246  -9.393   3.501
  693    HG2  GLN  85           HG2      GLN  85  92.891 -11.270   4.828
  694    HG3  GLN  85           HG1      GLN  85  91.909 -10.101   5.708
  695   HE21  GLN  85          HE21      GLN  85  89.681  -9.944   3.970
  696   HE22  GLN  85          HE22      GLN  85  88.885 -11.435   3.968
  697    H    ALA  86           HN       ALA  86  93.059  -8.733   5.819
  698    HA   ALA  86           HA       ALA  86  93.479  -5.995   6.662
  699    HB1  ALA  86           HB1      ALA  86  94.862  -8.616   7.228
  700    HB2  ALA  86           HB2      ALA  86  93.789  -7.708   8.300
  701    HB3  ALA  86           HB3      ALA  86  95.406  -7.100   7.946
  702    H    ASP  87           HN       ASP  87  94.997  -8.154   4.406
  703    HA   ASP  87           HA       ASP  87  97.498  -6.737   4.169
  704    HB2  ASP  87           HB2      ASP  87  97.470  -8.979   3.430
  705    HB3  ASP  87           HB1      ASP  87  95.996  -8.752   2.509
  706    H    ALA  88           HN       ALA  88  94.325  -6.146   3.197
  707    HA   ALA  88           HA       ALA  88  95.110  -4.319   0.975
  708    HB1  ALA  88           HB1      ALA  88  92.404  -4.187   1.053
  709    HB2  ALA  88           HB2      ALA  88  92.650  -5.750   1.838
  710    HB3  ALA  88           HB3      ALA  88  93.263  -5.480   0.211
  711    H    LYS  89           HN       LYS  89  95.618  -2.271   1.679
  712    HA   LYS  89           HA       LYS  89  94.331  -1.239   4.153
  713    HB2  LYS  89           HB2      LYS  89  96.383   0.273   2.547
  714    HB3  LYS  89           HB1      LYS  89  96.035   0.371   4.270
  715    HG2  LYS  89           HG2      LYS  89  97.201  -2.094   2.949
  716    HG3  LYS  89           HG1      LYS  89  98.172  -0.826   3.667
  717    HD2  LYS  89           HD2      LYS  89  97.488  -1.314   5.846
  718    HD3  LYS  89           HD1      LYS  89  96.005  -2.094   5.313
  719    HE2  LYS  89           HE2      LYS  89  97.614  -3.768   6.104
  720    HE3  LYS  89           HE1      LYS  89  97.298  -3.953   4.379
  721    HZ1  LYS  89           HZ1      LYS  89  99.570  -2.364   5.412
  722    HZ2  LYS  89           HZ2      LYS  89  99.327  -2.942   3.834
  723    HZ3  LYS  89           HZ3      LYS  89  99.701  -4.023   5.090
  724    H    LEU  90           HN       LEU  90  92.562  -0.121   3.994
  725    HA   LEU  90           HA       LEU  90  91.826   1.193   1.436
  726    HB2  LEU  90           HB2      LEU  90  90.064   1.045   3.870
  727    HB3  LEU  90           HB1      LEU  90  89.599   1.152   2.173
  728    HG   LEU  90           HG       LEU  90  90.878  -1.212   3.548
  729   HD11  LEU  90          HD11      LEU  90  88.142  -0.777   2.320
  730   HD12  LEU  90          HD12      LEU  90  88.497  -0.984   4.034
  731   HD13  LEU  90          HD13      LEU  90  88.736  -2.327   2.916
  732   HD21  LEU  90          HD21      LEU  90  90.268  -0.635   0.645
  733   HD22  LEU  90          HD22      LEU  90  90.391  -2.289   1.250
  734   HD23  LEU  90          HD23      LEU  90  91.780  -1.208   1.352
  735    H    GLN  91           HN       GLN  91  90.510   3.296   1.889
  736    HA   GLN  91           HA       GLN  91  91.925   5.032   3.861
  737    HB2  GLN  91           HB2      GLN  91  91.126   5.841   1.048
  738    HB3  GLN  91           HB1      GLN  91  92.017   6.818   2.211
  739    HG2  GLN  91           HG2      GLN  91  93.978   5.552   1.964
  740    HG3  GLN  91           HG1      GLN  91  93.127   4.165   1.311
  741   HE21  GLN  91          HE21      GLN  91  92.005   7.093   0.045
  742   HE22  GLN  91          HE22      GLN  91  92.823   7.031  -1.434
  743    H    PHE  92           HN       PHE  92  90.559   7.039   4.271
  744    HA   PHE  92           HA       PHE  92  87.655   6.565   3.757
  745    HB2  PHE  92           HB2      PHE  92  88.134   5.733   5.969
  746    HB3  PHE  92           HB1      PHE  92  88.965   7.213   6.408
  747    HD1  PHE  92           HD1      PHE  92  85.643   6.406   4.798
  748    HD2  PHE  92           HD2      PHE  92  87.724   8.423   7.968
  749    HE1  PHE  92           HE1      PHE  92  83.497   7.265   5.661
  750    HE2  PHE  92           HE2      PHE  92  85.575   9.289   8.822
  751    HZ   PHE  92           HZ       PHE  92  83.459   8.723   7.664
  752    H    THR  93           HN       THR  93  87.703   8.149   2.205
  753    HA   THR  93           HA       THR  93  88.486  10.908   3.069
  754    HB   THR  93           HB       THR  93  89.576  10.600   1.046
  755    HG1  THR  93           HG1      THR  93  87.114  11.098  -0.179
  756   HG21  THR  93          HG21      THR  93  87.268   8.787   0.305
  757   HG22  THR  93          HG22      THR  93  88.935   8.321   0.642
  758   HG23  THR  93          HG23      THR  93  88.551   9.226  -0.823
  759    HA   PRO  94           HA       PRO  94  84.220  12.119   3.171
  760    HB2  PRO  94           HB2      PRO  94  84.378  14.771   2.520
  761    HB3  PRO  94           HB1      PRO  94  84.979  14.130   4.061
  762    HG2  PRO  94           HG2      PRO  94  86.504  14.763   1.565
  763    HG3  PRO  94           HG1      PRO  94  86.895  15.159   3.250
  764    HD2  PRO  94           HD2      PRO  94  88.036  13.046   1.977
  765    HD3  PRO  94           HD1      PRO  94  87.676  13.011   3.718
  766    H    TYR 541           HT1      TYR 541  52.371  39.380   6.887
  767    HA   TYR 541           HA       TYR 541  49.674  40.601   6.665
  768    HB2  TYR 541           HB2      TYR 541  52.167  41.379   5.148
  769    HB3  TYR 541           HB1      TYR 541  50.692  42.314   5.403
  770    HD1  TYR 541           HD1      TYR 541  53.986  41.560   6.654
  771    HD2  TYR 541           HD2      TYR 541  50.125  43.064   7.786
  772    HE1  TYR 541           HE1      TYR 541  54.980  42.585   8.682
  773    HE2  TYR 541           HE2      TYR 541  51.120  44.089   9.814
  774    HH   TYR 541           HH       TYR 541  54.400  43.419  10.789
  775    H    HIS 542           HN       HIS 542  52.361  39.541   4.541
  776    HA   HIS 542           HA       HIS 542  50.351  38.335   2.708
  777    HB2  HIS 542           HB2      HIS 542  53.233  39.198   2.441
  778    HB3  HIS 542           HB1      HIS 542  52.486  38.151   1.243
  779    HD1  HIS 542           HD1      HIS 542  49.900  40.274   2.515
  780    HD2  HIS 542           HD2      HIS 542  52.955  40.771  -0.277
  781    HE1  HIS 542           HE1      HIS 542  49.264  42.280   1.106
  782    H    GLU 543           HN       GLU 543  53.649  37.458   3.821
  783    HA   GLU 543           HA       GLU 543  52.971  34.596   3.504
  784    HB2  GLU 543           HB2      GLU 543  55.416  34.327   4.202
  785    HB3  GLU 543           HB1      GLU 543  55.137  35.189   2.687
  786    HG2  GLU 543           HG2      GLU 543  55.523  37.308   3.696
  787    HG3  GLU 543           HG1      GLU 543  55.394  36.643   5.325
  788    H    ARG 544           HN       ARG 544  52.527  36.819   5.909
  789    HA   ARG 544           HA       ARG 544  52.373  36.715   8.247
  790    HB2  ARG 544           HB2      ARG 544  51.383  34.071   7.219
  791    HB3  ARG 544           HB1      ARG 544  51.264  34.497   8.922
  792    HG2  ARG 544           HG2      ARG 544  49.183  35.115   7.849
  793    HG3  ARG 544           HG1      ARG 544  50.052  36.586   8.255
  794    HD2  ARG 544           HD2      ARG 544  50.552  37.077   6.052
  795    HD3  ARG 544           HD1      ARG 544  50.552  35.396   5.545
  796    HE   ARG 544           HE       ARG 544  48.351  37.259   5.408
  797   HH11  ARG 544          HH11      ARG 544  46.229  36.589   5.141
  798   HH12  ARG 544          HH12      ARG 544  45.816  34.929   5.412
  799   HH21  ARG 544          HH21      ARG 544  49.045  33.977   6.228
  800   HH22  ARG 544          HH22      ARG 544  47.407  33.454   6.026
  801    H    ARG 545           HN       ARG 545  52.768  34.746  10.100
  802    HA   ARG 545           HA       ARG 545  55.630  34.587  10.245
  803    HB2  ARG 545           HB2      ARG 545  53.424  33.265  11.851
  804    HB3  ARG 545           HB1      ARG 545  55.131  33.150  12.252
  805    HG2  ARG 545           HG2      ARG 545  54.262  34.955  13.557
  806    HG3  ARG 545           HG1      ARG 545  55.221  35.661  12.273
  807    HD2  ARG 545           HD2      ARG 545  53.368  36.475  11.129
  808    HD3  ARG 545           HD1      ARG 545  52.277  35.261  11.782
  809    HE   ARG 545           HE       ARG 545  52.780  37.902  12.830
  810   HH11  ARG 545          HH11      ARG 545  52.266  38.487  14.929
  811   HH12  ARG 545          HH12      ARG 545  51.906  37.260  16.096
  812   HH21  ARG 545          HH21      ARG 545  52.343  34.638  13.875
  813   HH22  ARG 545          HH22      ARG 545  51.949  35.086  15.501
  814    H    GLY 546           HN       GLY 546  54.819  31.647  11.372
  815    HA2  GLY 546           HA2      GLY 546  54.666  30.090   8.933
  816    HA3  GLY 546           HA1      GLY 546  56.309  30.126   9.572
  817    H    SER 547           HN       SER 547  56.759  29.044  11.535
  818    HA   SER 547           HA       SER 547  54.684  27.871  13.182
  819    HB2  SER 547           HB2      SER 547  55.924  26.281  10.969
  820    HB3  SER 547           HB1      SER 547  55.649  25.463  12.505
  821    HG   SER 547           HG       SER 547  53.802  25.252  11.290
  822    H    LEU 548           HN       LEU 548  55.709  27.931  15.156
  823    HA   LEU 548           HA       LEU 548  58.499  28.317  15.411
  824    HB2  LEU 548           HB2      LEU 548  56.226  27.813  17.233
  825    HB3  LEU 548           HB1      LEU 548  57.778  27.290  17.874
  826    HG   LEU 548           HG       LEU 548  58.674  29.600  17.266
  827   HD11  LEU 548          HD11      LEU 548  55.745  29.997  16.685
  828   HD12  LEU 548          HD12      LEU 548  57.135  30.430  15.697
  829   HD13  LEU 548          HD13      LEU 548  56.778  31.347  17.152
  830   HD21  LEU 548          HD21      LEU 548  57.911  30.588  19.270
  831   HD22  LEU 548          HD22      LEU 548  57.848  28.852  19.571
  832   HD23  LEU 548          HD23      LEU 548  56.369  29.736  19.198
  833    H    CYS 549           HN       CYS 549  60.221  26.937  15.591
  834    HA   CYS 549           HA       CYS 549  59.710  24.082  15.067
  835    HB2  CYS 549           HB2      CYS 549  61.607  24.869  13.904
  836    HB3  CYS 549           HB1      CYS 549  62.132  25.873  15.242
  837    H    SER 550           HN       SER 550  58.912  23.144  16.875
  838    HA   SER 550           HA       SER 550  59.286  23.902  19.523
  839    HB2  SER 550           HB2      SER 550  57.606  22.316  19.083
  840    HB3  SER 550           HB1      SER 550  58.734  21.172  18.366
  841    HG   SER 550           HG       SER 550  58.923  22.074  21.045
  842    H    GLY 551           HN       GLY 551  60.891  23.905  20.847
  843    HA2  GLY 551           HA2      GLY 551  62.838  22.784  21.914
  844    HA3  GLY 551           HA1      GLY 551  63.300  22.201  20.309
  845    H    CYS 552           HN       CYS 552  62.555  24.583  18.952
  846    HA   CYS 552           HA       CYS 552  64.813  26.385  19.718
  847    HB2  CYS 552           HB2      CYS 552  63.395  25.666  17.163
  848    HB3  CYS 552           HB1      CYS 552  64.215  27.214  17.289
  849    H    GLN 553           HN       GLN 553  61.416  26.127  18.897
  850    HA   GLN 553           HA       GLN 553  59.668  27.588  19.061
  851    HB2  GLN 553           HB2      GLN 553  61.329  28.624  21.341
  852    HB3  GLN 553           HB1      GLN 553  59.659  29.104  21.029
  853    HG2  GLN 553           HG2      GLN 553  60.546  26.238  21.363
  854    HG3  GLN 553           HG1      GLN 553  59.878  27.204  22.664
  855   HE21  GLN 553          HE21      GLN 553  59.125  25.739  19.530
  856   HE22  GLN 553          HE22      GLN 553  57.438  25.749  19.726
  857    H    LYS 554           HN       LYS 554  60.935  28.163  17.044
  858    HA   LYS 554           HA       LYS 554  60.932  31.117  16.866
  859    HB2  LYS 554           HB2      LYS 554  63.079  29.330  15.694
  860    HB3  LYS 554           HB1      LYS 554  62.897  31.038  15.319
  861    HG2  LYS 554           HG2      LYS 554  63.350  29.936  18.104
  862    HG3  LYS 554           HG1      LYS 554  64.622  30.587  17.077
  863    HD2  LYS 554           HD2      LYS 554  63.028  32.698  16.947
  864    HD3  LYS 554           HD1      LYS 554  62.350  32.025  18.427
  865    HE2  LYS 554           HE2      LYS 554  64.051  33.492  19.173
  866    HE3  LYS 554           HE1      LYS 554  64.780  31.889  19.272
  867    HZ1  LYS 554           HZ1      LYS 554  65.151  32.947  16.685
  868    HZ2  LYS 554           HZ2      LYS 554  66.324  32.503  17.832
  869    HZ3  LYS 554           HZ3      LYS 554  65.689  34.079  17.828
  870    HA   PRO 555           HA       PRO 555  57.979  29.776  13.691
  871    HB2  PRO 555           HB2      PRO 555  58.861  32.228  12.275
  872    HB3  PRO 555           HB1      PRO 555  57.230  31.693  12.688
  873    HG2  PRO 555           HG2      PRO 555  58.565  33.678  14.048
  874    HG3  PRO 555           HG1      PRO 555  57.296  32.686  14.773
  875    HD2  PRO 555           HD2      PRO 555  60.190  32.671  15.343
  876    HD3  PRO 555           HD1      PRO 555  58.869  31.917  16.270
  877    H    ILE 556           HN       ILE 556  58.178  28.472  12.031
  878    HA   ILE 556           HA       ILE 556  60.776  28.200  10.632
  879    HB   ILE 556           HB       ILE 556  58.243  26.526  10.727
  880   HG12  ILE 556          HG12      ILE 556  60.977  25.648  11.651
  881   HG13  ILE 556          HG11      ILE 556  60.021  26.666  12.706
  882   HG21  ILE 556          HG21      ILE 556  59.172  26.186   8.562
  883   HG22  ILE 556          HG22      ILE 556  59.726  24.836   9.550
  884   HG23  ILE 556          HG23      ILE 556  60.819  26.168   9.192
  885   HD11  ILE 556          HD11      ILE 556  58.505  24.996  13.163
  886   HD12  ILE 556          HD12      ILE 556  59.839  23.953  12.694
  887   HD13  ILE 556          HD13      ILE 556  58.576  24.335  11.529
  888    H    THR 557           HN       THR 557  60.755  29.873   9.087
  889    HA   THR 557           HA       THR 557  58.331  30.202   7.390
  890    HB   THR 557           HB       THR 557  59.149  32.339   6.870
  891    HG1  THR 557           HG1      THR 557  61.176  32.448   6.383
  892   HG21  THR 557          HG21      THR 557  60.304  31.841   9.618
  893   HG22  THR 557          HG22      THR 557  58.567  31.893   9.317
  894   HG23  THR 557          HG23      THR 557  59.560  33.321   9.011
  895    H    GLY 558           HN       GLY 558  58.522  28.411   6.054
  896    HA2  GLY 558           HA2      GLY 558  59.548  28.583   3.547
  897    HA3  GLY 558           HA1      GLY 558  60.932  27.946   4.449
  898    H    ARG 559           HN       ARG 559  60.853  25.863   5.231
  899    HA   ARG 559           HA       ARG 559  58.491  24.191   4.464
  900    HB2  ARG 559           HB2      ARG 559  61.467  23.705   4.433
  901    HB3  ARG 559           HB1      ARG 559  60.387  22.336   4.684
  902    HG2  ARG 559           HG2      ARG 559  59.857  24.244   2.415
  903    HG3  ARG 559           HG1      ARG 559  61.105  23.016   2.235
  904    HD2  ARG 559           HD2      ARG 559  59.576  21.245   2.402
  905    HD3  ARG 559           HD1      ARG 559  58.367  22.234   3.221
  906    HE   ARG 559           HE       ARG 559  58.613  23.417   0.727
  907   HH11  ARG 559          HH11      ARG 559  57.338  22.810  -1.034
  908   HH12  ARG 559          HH12      ARG 559  56.654  21.220  -1.086
  909   HH21  ARG 559          HH21      ARG 559  58.017  20.248   1.951
  910   HH22  ARG 559          HH22      ARG 559  57.038  19.769   0.605
  911    H    CYS 560           HN       CYS 560  57.852  22.618   6.084
  912    HA   CYS 560           HA       CYS 560  59.213  22.838   8.707
  913    HB2  CYS 560           HB2      CYS 560  57.080  23.219   9.888
  914    HB3  CYS 560           HB1      CYS 560  57.509  24.568   8.832
  915    HG   CYS 560           HG       CYS 560  55.357  22.420   8.072
  916    H    ILE 561           HN       ILE 561  59.473  20.980   9.590
  917    HA   ILE 561           HA       ILE 561  57.964  18.641   8.609
  918    HB   ILE 561           HB       ILE 561  60.304  18.928  10.511
  919   HG12  ILE 561          HG12      ILE 561  60.018  18.042   7.644
  920   HG13  ILE 561          HG11      ILE 561  60.796  19.514   8.193
  921   HG21  ILE 561          HG21      ILE 561  59.041  16.444   9.316
  922   HG22  ILE 561          HG22      ILE 561  58.940  16.910  11.018
  923   HG23  ILE 561          HG23      ILE 561  60.493  16.471  10.313
  924   HD11  ILE 561          HD11      ILE 561  61.702  16.669   8.686
  925   HD12  ILE 561          HD12      ILE 561  62.394  18.073   9.504
  926   HD13  ILE 561          HD13      ILE 561  62.541  17.914   7.753
  927    H    THR 562           HN       THR 562  56.730  17.413   9.967
  928    HA   THR 562           HA       THR 562  55.987  18.640  12.590
  929    HB   THR 562           HB       THR 562  54.131  16.930  10.952
  930    HG1  THR 562           HG1      THR 562  53.558  19.562  10.953
  931   HG21  THR 562          HG21      THR 562  53.776  17.319  13.432
  932   HG22  THR 562          HG22      THR 562  52.446  17.851  12.398
  933   HG23  THR 562          HG23      THR 562  53.580  19.033  13.052
  934    H    ALA 563           HN       ALA 563  55.656  17.297  14.298
  935    HA   ALA 563           HA       ALA 563  56.555  14.465  13.964
  936    HB1  ALA 563           HB1      ALA 563  57.048  16.301  16.310
  937    HB2  ALA 563           HB2      ALA 563  58.221  16.005  15.022
  938    HB3  ALA 563           HB3      ALA 563  57.707  14.679  16.077
  939    H    MET 564           HN       MET 564  56.028  14.749  17.058
  940    HA   MET 564           HA       MET 564  53.533  13.344  17.090
  941    HB2  MET 564           HB2      MET 564  54.610  14.865  19.452
  942    HB3  MET 564           HB1      MET 564  53.829  13.284  19.413
  943    HG2  MET 564           HG2      MET 564  55.875  12.508  18.044
  944    HG3  MET 564           HG1      MET 564  56.632  14.009  18.572
  945    HE1  MET 564           HE1      MET 564  58.562  12.119  21.095
  946    HE2  MET 564           HE2      MET 564  58.440  13.509  20.020
  947    HE3  MET 564           HE3      MET 564  58.361  11.882  19.353
  948    H    ALA 565           HN       ALA 565  53.653  16.000  15.844
  949    HA   ALA 565           HA       ALA 565  51.719  17.406  15.426
  950    HB1  ALA 565           HB1      ALA 565  50.358  18.260  17.205
  951    HB2  ALA 565           HB2      ALA 565  51.468  17.665  18.434
  952    HB3  ALA 565           HB3      ALA 565  50.499  16.528  17.487
  953    H    LYS 566           HN       LYS 566  54.576  17.412  17.123
  954    HA   LYS 566           HA       LYS 566  54.764  20.320  17.526
  955    HB2  LYS 566           HB2      LYS 566  56.495  17.923  17.961
  956    HB3  LYS 566           HB1      LYS 566  57.335  19.447  17.705
  957    HG2  LYS 566           HG2      LYS 566  56.319  20.456  19.590
  958    HG3  LYS 566           HG1      LYS 566  55.091  19.199  19.709
  959    HD2  LYS 566           HD2      LYS 566  57.987  18.403  19.924
  960    HD3  LYS 566           HD1      LYS 566  57.221  19.174  21.306
  961    HE2  LYS 566           HE2      LYS 566  55.690  17.421  21.604
  962    HE3  LYS 566           HE1      LYS 566  55.826  16.881  19.926
  963    HZ1  LYS 566           HZ1      LYS 566  58.360  16.688  21.013
  964    HZ2  LYS 566           HZ2      LYS 566  57.308  15.411  20.626
  965    HZ3  LYS 566           HZ3      LYS 566  57.317  16.062  22.195
  966    H    LYS 567           HN       LYS 567  56.513  21.539  16.364
  967    HA   LYS 567           HA       LYS 567  56.678  20.675  13.503
  968    HB2  LYS 567           HB2      LYS 567  57.307  23.445  14.460
  969    HB3  LYS 567           HB1      LYS 567  56.680  22.937  12.905
  970    HG2  LYS 567           HG2      LYS 567  55.144  22.900  15.529
  971    HG3  LYS 567           HG1      LYS 567  54.938  24.067  14.235
  972    HD2  LYS 567           HD2      LYS 567  54.459  21.072  13.945
  973    HD3  LYS 567           HD1      LYS 567  53.202  22.292  14.159
  974    HE2  LYS 567           HE2      LYS 567  54.291  23.434  12.073
  975    HE3  LYS 567           HE1      LYS 567  55.007  21.846  11.802
  976    HZ1  LYS 567           HZ1      LYS 567  52.656  20.972  12.082
  977    HZ2  LYS 567           HZ2      LYS 567  53.006  21.802  10.641
  978    HZ3  LYS 567           HZ3      LYS 567  52.148  22.578  11.886
  979    H    PHE 568           HN       PHE 568  58.871  21.611  12.495
  980    HA   PHE 568           HA       PHE 568  61.069  21.684  14.443
  981    HB2  PHE 568           HB2      PHE 568  60.221  19.152  13.391
  982    HB3  PHE 568           HB1      PHE 568  61.763  19.508  12.633
  983    HD1  PHE 568           HD1      PHE 568  60.511  17.699  15.210
  984    HD2  PHE 568           HD2      PHE 568  63.330  20.881  14.585
  985    HE1  PHE 568           HE1      PHE 568  61.696  17.059  17.292
  986    HE2  PHE 568           HE2      PHE 568  64.514  20.240  16.667
  987    HZ   PHE 568           HZ       PHE 568  63.698  18.330  18.021
  988    H    HIS 569           HN       HIS 569  62.832  22.685  13.576
  989    HA   HIS 569           HA       HIS 569  62.650  24.040  11.089
  990    HB2  HIS 569           HB2      HIS 569  64.884  23.318  12.937
  991    HB3  HIS 569           HB1      HIS 569  65.300  23.953  11.358
  992    HD2  HIS 569           HD2      HIS 569  63.669  26.557  10.946
  993    HE1  HIS 569           HE1      HIS 569  64.282  27.494  15.010
  994    HA   PRO 570           HA       PRO 570  62.950  20.170   8.667
  995    HB2  PRO 570           HB2      PRO 570  63.952  22.082   6.594
  996    HB3  PRO 570           HB1      PRO 570  62.691  20.844   6.466
  997    HG2  PRO 570           HG2      PRO 570  62.100  23.489   6.674
  998    HG3  PRO 570           HG1      PRO 570  61.052  22.230   7.335
  999    HD2  PRO 570           HD2      PRO 570  62.773  24.163   8.783
 1000    HD3  PRO 570           HD1      PRO 570  61.367  23.240   9.369
 1001    H    GLU 571           HN       GLU 571  65.431  22.346   9.567
 1002    HA   GLU 571           HA       GLU 571  67.599  20.652   8.454
 1003    HB2  GLU 571           HB2      GLU 571  68.021  23.161  10.065
 1004    HB3  GLU 571           HB1      GLU 571  69.027  22.477   8.790
 1005    HG2  GLU 571           HG2      GLU 571  67.083  22.909   7.205
 1006    HG3  GLU 571           HG1      GLU 571  66.360  23.853   8.513
 1007    H    HIS 572           HN       HIS 572  66.669  22.153  11.556
 1008    HA   HIS 572           HA       HIS 572  68.568  20.762  13.155
 1009    HB2  HIS 572           HB2      HIS 572  65.803  21.612  14.067
 1010    HB3  HIS 572           HB1      HIS 572  67.236  21.401  15.072
 1011    HD2  HIS 572           HD2      HIS 572  69.103  22.956  12.569
 1012    HE1  HIS 572           HE1      HIS 572  67.039  26.343  13.989
 1013    H    PHE 573           HN       PHE 573  66.122  19.445  11.354
 1014    HA   PHE 573           HA       PHE 573  66.112  16.960  13.044
 1015    HB2  PHE 573           HB2      PHE 573  63.892  18.305  12.865
 1016    HB3  PHE 573           HB1      PHE 573  63.863  17.742  11.201
 1017    HD1  PHE 573           HD1      PHE 573  63.152  15.541  10.663
 1018    HD2  PHE 573           HD2      PHE 573  64.071  16.567  14.733
 1019    HE1  PHE 573           HE1      PHE 573  62.248  13.358  11.418
 1020    HE2  PHE 573           HE2      PHE 573  63.166  14.384  15.486
 1021    HZ   PHE 573           HZ       PHE 573  62.255  12.780  13.829
 1022    H    VAL 574           HN       VAL 574  68.106  17.236  11.342
 1023    HA   VAL 574           HA       VAL 574  67.405  16.185   8.686
 1024    HB   VAL 574           HB       VAL 574  69.872  16.366   8.288
 1025   HG11  VAL 574          HG11      VAL 574  69.598  19.085   8.982
 1026   HG12  VAL 574          HG12      VAL 574  67.947  18.514   8.727
 1027   HG13  VAL 574          HG13      VAL 574  69.144  18.344   7.462
 1028   HG21  VAL 574          HG21      VAL 574  69.826  17.641  11.050
 1029   HG22  VAL 574          HG22      VAL 574  71.222  17.548   9.976
 1030   HG23  VAL 574          HG23      VAL 574  70.545  16.072  10.663
 1031    H    CYS 575           HN       CYS 575  69.109  14.474   7.907
 1032    HA   CYS 575           HA       CYS 575  68.837  12.099   9.614
 1033    HB2  CYS 575           HB2      CYS 575  68.713  11.183   7.535
 1034    HB3  CYS 575           HB1      CYS 575  69.245  12.699   6.816
 1035    H    ALA 576           HN       ALA 576  70.632  11.003  10.668
 1036    HA   ALA 576           HA       ALA 576  73.046  12.785  10.848
 1037    HB1  ALA 576           HB1      ALA 576  71.824  11.707  12.875
 1038    HB2  ALA 576           HB2      ALA 576  73.586  11.613  12.829
 1039    HB3  ALA 576           HB3      ALA 576  72.617  10.210  12.378
 1040    H    PHE 577           HN       PHE 577  73.495  12.140   8.597
 1041    HA   PHE 577           HA       PHE 577  75.657  10.215   8.540
 1042    HB2  PHE 577           HB2      PHE 577  74.266   8.534   7.697
 1043    HB3  PHE 577           HB1      PHE 577  73.124   9.667   7.018
 1044    HD1  PHE 577           HD1      PHE 577  76.070   7.644   6.368
 1045    HD2  PHE 577           HD2      PHE 577  73.697  10.903   4.925
 1046    HE1  PHE 577           HE1      PHE 577  77.125   7.421   4.139
 1047    HE2  PHE 577           HE2      PHE 577  74.751  10.691   2.689
 1048    HZ   PHE 577           HZ       PHE 577  76.467   8.944   2.296
 1049    H    CYS 578           HN       CYS 578  73.402  12.223   6.865
 1050    HA   CYS 578           HA       CYS 578  75.525  14.061   5.902
 1051    HB2  CYS 578           HB2      CYS 578  74.299  14.402   3.799
 1052    HB3  CYS 578           HB1      CYS 578  74.712  12.701   3.945
 1053    H    LEU 579           HN       LEU 579  74.915  15.114   7.860
 1054    HA   LEU 579           HA       LEU 579  72.390  15.772   8.790
 1055    HB2  LEU 579           HB2      LEU 579  74.956  17.355   8.906
 1056    HB3  LEU 579           HB1      LEU 579  73.538  17.731   9.876
 1057    HG   LEU 579           HG       LEU 579  74.289  14.870  10.051
 1058   HD11  LEU 579          HD11      LEU 579  76.259  15.440  11.616
 1059   HD12  LEU 579          HD12      LEU 579  76.295  16.995  10.789
 1060   HD13  LEU 579          HD13      LEU 579  76.558  15.511   9.879
 1061   HD21  LEU 579          HD21      LEU 579  72.714  16.300  11.542
 1062   HD22  LEU 579          HD22      LEU 579  74.192  16.892  12.300
 1063   HD23  LEU 579          HD23      LEU 579  73.804  15.173  12.349
 1064    H    LYS 580           HN       LYS 580  72.909  16.563   5.660
 1065    HA   LYS 580           HA       LYS 580  72.226  19.429   5.917
 1066    HB2  LYS 580           HB2      LYS 580  72.733  19.639   3.680
 1067    HB3  LYS 580           HB1      LYS 580  73.662  18.200   4.054
 1068    HG2  LYS 580           HG2      LYS 580  70.861  18.122   2.853
 1069    HG3  LYS 580           HG1      LYS 580  72.344  18.060   1.917
 1070    HD2  LYS 580           HD2      LYS 580  72.959  15.967   2.745
 1071    HD3  LYS 580           HD1      LYS 580  71.941  16.120   4.171
 1072    HE2  LYS 580           HE2      LYS 580  71.123  14.546   2.298
 1073    HE3  LYS 580           HE1      LYS 580  69.968  15.702   2.962
 1074    HZ1  LYS 580           HZ1      LYS 580  71.320  15.710   0.361
 1075    HZ2  LYS 580           HZ2      LYS 580  70.919  17.201   1.070
 1076    HZ3  LYS 580           HZ3      LYS 580  69.704  16.062   0.738
 1077    H    GLN 581           HN       GLN 581  70.363  16.459   4.966
 1078    HA   GLN 581           HA       GLN 581  67.981  17.958   5.676
 1079    HB2  GLN 581           HB2      GLN 581  68.475  18.756   3.377
 1080    HB3  GLN 581           HB1      GLN 581  68.119  17.130   2.798
 1081    HG2  GLN 581           HG2      GLN 581  66.070  18.330   2.606
 1082    HG3  GLN 581           HG1      GLN 581  65.882  17.369   4.059
 1083   HE21  GLN 581          HE21      GLN 581  66.367  18.544   6.173
 1084   HE22  GLN 581          HE22      GLN 581  66.046  20.201   6.237
 1085    H    LEU 582           HN       LEU 582  66.254  16.819   6.174
 1086    HA   LEU 582           HA       LEU 582  66.071  13.967   5.374
 1087    HB2  LEU 582           HB2      LEU 582  67.081  14.266   7.678
 1088    HB3  LEU 582           HB1      LEU 582  65.540  14.932   8.185
 1089    HG   LEU 582           HG       LEU 582  64.435  12.809   7.586
 1090   HD11  LEU 582          HD11      LEU 582  66.405  10.900   7.297
 1091   HD12  LEU 582          HD12      LEU 582  67.073  12.239   6.376
 1092   HD13  LEU 582          HD13      LEU 582  65.493  11.601   5.963
 1093   HD21  LEU 582          HD21      LEU 582  66.711  12.901   9.535
 1094   HD22  LEU 582          HD22      LEU 582  65.880  11.369   9.294
 1095   HD23  LEU 582          HD23      LEU 582  64.982  12.787   9.830
 1096    H    ASN 583           HN       ASN 583  63.787  13.146   5.956
 1097    HA   ASN 583           HA       ASN 583  61.742  15.306   6.029
 1098    HB2  ASN 583           HB2      ASN 583  62.219  13.403   3.732
 1099    HB3  ASN 583           HB1      ASN 583  60.597  14.006   4.054
 1100   HD21  ASN 583          HD21      ASN 583  61.663  14.749   1.656
 1101   HD22  ASN 583          HD22      ASN 583  62.145  16.372   1.684
 1102    H    LYS 584           HN       LYS 584  60.005  14.678   7.188
 1103    HA   LYS 584           HA       LYS 584  59.941  12.330   8.747
 1104    HB2  LYS 584           HB2      LYS 584  57.465  12.897   8.945
 1105    HB3  LYS 584           HB1      LYS 584  58.576  14.207   9.340
 1106    HG2  LYS 584           HG2      LYS 584  58.073  15.427   7.424
 1107    HG3  LYS 584           HG1      LYS 584  57.715  13.991   6.464
 1108    HD2  LYS 584           HD2      LYS 584  55.630  15.081   6.781
 1109    HD3  LYS 584           HD1      LYS 584  55.618  13.727   7.902
 1110    HE2  LYS 584           HE2      LYS 584  54.882  15.476   9.269
 1111    HE3  LYS 584           HE1      LYS 584  56.615  15.486   9.594
 1112    HZ1  LYS 584           HZ1      LYS 584  55.304  17.161   7.525
 1113    HZ2  LYS 584           HZ2      LYS 584  56.921  17.248   8.041
 1114    HZ3  LYS 584           HZ3      LYS 584  55.665  17.702   9.092
 1115    H    GLY 585           HN       GLY 585  59.284  12.765   5.443
 1116    HA2  GLY 585           HA2      GLY 585  57.521  10.400   5.237
 1117    HA3  GLY 585           HA1      GLY 585  57.964  11.491   3.924
 1118    H    THR 586           HN       THR 586  60.792  11.253   5.090
 1119    HA   THR 586           HA       THR 586  61.479   8.526   4.087
 1120    HB   THR 586           HB       THR 586  63.021   9.322   2.521
 1121    HG1  THR 586           HG1      THR 586  64.193  11.022   2.905
 1122   HG21  THR 586          HG21      THR 586  60.976  11.556   2.560
 1123   HG22  THR 586          HG22      THR 586  60.646   9.939   1.939
 1124   HG23  THR 586          HG23      THR 586  61.864  10.952   1.160
 1125    H    PHE 587           HN       PHE 587  61.356   9.841   6.787
 1126    HA   PHE 587           HA       PHE 587  64.241  10.054   7.468
 1127    HB2  PHE 587           HB2      PHE 587  63.611  10.934   9.526
 1128    HB3  PHE 587           HB1      PHE 587  62.324  11.496   8.481
 1129    HD1  PHE 587           HD1      PHE 587  60.264   9.797   8.264
 1130    HD2  PHE 587           HD2      PHE 587  63.031   9.909  11.547
 1131    HE1  PHE 587           HE1      PHE 587  58.599   8.655   9.708
 1132    HE2  PHE 587           HE2      PHE 587  61.370   8.767  12.989
 1133    HZ   PHE 587           HZ       PHE 587  59.153   8.141  12.070
 1134    H    LYS 588           HN       LYS 588  65.313   8.248   7.688
 1135    HA   LYS 588           HA       LYS 588  64.024   5.826   8.848
 1136    HB2  LYS 588           HB2      LYS 588  65.639   6.239   6.574
 1137    HB3  LYS 588           HB1      LYS 588  66.729   5.550   7.732
 1138    HG2  LYS 588           HG2      LYS 588  65.609   3.871   6.240
 1139    HG3  LYS 588           HG1      LYS 588  65.442   3.559   7.953
 1140    HD2  LYS 588           HD2      LYS 588  63.379   3.275   6.362
 1141    HD3  LYS 588           HD1      LYS 588  63.152   3.993   7.938
 1142    HE2  LYS 588           HE2      LYS 588  62.747   6.107   7.046
 1143    HE3  LYS 588           HE1      LYS 588  63.740   5.811   5.637
 1144    HZ1  LYS 588           HZ1      LYS 588  61.082   5.726   5.630
 1145    HZ2  LYS 588           HZ2      LYS 588  61.446   4.086   5.890
 1146    HZ3  LYS 588           HZ3      LYS 588  62.059   4.889   4.524
 1147    H    GLU 589           HN       GLU 589  65.559   4.555  10.345
 1148    HA   GLU 589           HA       GLU 589  67.534   6.253  11.739
 1149    HB2  GLU 589           HB2      GLU 589  65.704   7.029  12.966
 1150    HB3  GLU 589           HB1      GLU 589  64.878   5.477  12.928
 1151    HG2  GLU 589           HG2      GLU 589  66.374   4.551  14.557
 1152    HG3  GLU 589           HG1      GLU 589  67.491   5.913  14.415
 1153    H    GLN 590           HN       GLN 590  68.731   5.145  13.286
 1154    HA   GLN 590           HA       GLN 590  68.479   2.287  13.698
 1155    HB2  GLN 590           HB2      GLN 590  69.707   2.715  11.385
 1156    HB3  GLN 590           HB1      GLN 590  71.069   3.141  12.404
 1157    HG2  GLN 590           HG2      GLN 590  71.511   0.888  12.307
 1158    HG3  GLN 590           HG1      GLN 590  70.328   0.816  13.610
 1159   HE21  GLN 590          HE21      GLN 590  71.081  -0.524  10.626
 1160   HE22  GLN 590          HE22      GLN 590  69.543  -1.096  10.190
 1161    H    ASN 591           HN       ASN 591  69.770   1.722  15.533
 1162    HA   ASN 591           HA       ASN 591  70.690   2.251  17.615
 1163    HB2  ASN 591           HB2      ASN 591  72.775   4.032  16.998
 1164    HB3  ASN 591           HB1      ASN 591  72.898   2.287  17.051
 1165   HD21  ASN 591          HD21      ASN 591  71.670   1.427  14.800
 1166   HD22  ASN 591          HD22      ASN 591  72.359   2.105  13.408
 1167    H    ASP 592           HN       ASP 592  68.580   4.107  16.450
 1168    HA   ASP 592           HA       ASP 592  67.375   5.880  17.429
 1169    HB2  ASP 592           HB2      ASP 592  69.754   6.682  19.086
 1170    HB3  ASP 592           HB1      ASP 592  68.039   6.845  19.451
 1171    H    LYS 593           HN       LYS 593  70.226   6.074  15.720
 1172    HA   LYS 593           HA       LYS 593  70.349   9.005  15.604
 1173    HB2  LYS 593           HB2      LYS 593  71.840   6.960  13.989
 1174    HB3  LYS 593           HB1      LYS 593  72.256   8.651  14.202
 1175    HG2  LYS 593           HG2      LYS 593  72.300   8.049  16.751
 1176    HG3  LYS 593           HG1      LYS 593  72.449   6.390  16.175
 1177    HD2  LYS 593           HD2      LYS 593  74.427   7.007  14.846
 1178    HD3  LYS 593           HD1      LYS 593  74.278   8.680  15.386
 1179    HE2  LYS 593           HE2      LYS 593  74.494   6.458  17.414
 1180    HE3  LYS 593           HE1      LYS 593  75.942   7.084  16.630
 1181    HZ1  LYS 593           HZ1      LYS 593  74.721   9.349  17.300
 1182    HZ2  LYS 593           HZ2      LYS 593  75.855   8.566  18.294
 1183    HZ3  LYS 593           HZ3      LYS 593  74.192   8.349  18.565
 1184    HA   PRO 594           HA       PRO 594  67.185   8.803  12.282
 1185    HB2  PRO 594           HB2      PRO 594  68.336  11.484  11.674
 1186    HB3  PRO 594           HB1      PRO 594  66.649  11.021  11.902
 1187    HG2  PRO 594           HG2      PRO 594  68.056  12.406  13.769
 1188    HG3  PRO 594           HG1      PRO 594  66.771  11.266  14.201
 1189    HD2  PRO 594           HD2      PRO 594  69.716  10.971  14.522
 1190    HD3  PRO 594           HD1      PRO 594  68.397  10.154  15.396
 1191    H    TYR 595           HN       TYR 595  67.287   8.955   9.845
 1192    HA   TYR 595           HA       TYR 595  69.860   9.213   8.500
 1193    HB2  TYR 595           HB2      TYR 595  68.734   6.458   9.060
 1194    HB3  TYR 595           HB1      TYR 595  69.810   6.752   7.708
 1195    HD1  TYR 595           HD1      TYR 595  69.682   5.701  11.051
 1196    HD2  TYR 595           HD2      TYR 595  72.065   8.060   8.366
 1197    HE1  TYR 595           HE1      TYR 595  71.662   5.330  12.478
 1198    HE2  TYR 595           HE2      TYR 595  74.047   7.680   9.818
 1199    HH   TYR 595           HH       TYR 595  73.996   5.415  12.452
 1200    H    CYS 596           HN       CYS 596  69.459   9.479   6.264
 1201    HA   CYS 596           HA       CYS 596  66.679   9.384   5.348
 1202    HB2  CYS 596           HB2      CYS 596  69.090   9.356   3.514
 1203    HB3  CYS 596           HB1      CYS 596  67.486   9.989   3.191
 1204    H    GLN 597           HN       GLN 597  65.895   7.689   3.860
 1205    HA   GLN 597           HA       GLN 597  66.740   5.096   4.628
 1206    HB2  GLN 597           HB2      GLN 597  64.604   5.087   3.690
 1207    HB3  GLN 597           HB1      GLN 597  65.041   6.227   2.449
 1208    HG2  GLN 597           HG2      GLN 597  64.794   4.275   1.201
 1209    HG3  GLN 597           HG1      GLN 597  66.507   4.231   1.547
 1210   HE21  GLN 597          HE21      GLN 597  65.847   3.609   4.463
 1211   HE22  GLN 597          HE22      GLN 597  65.462   1.972   4.461
 1212    H    ASN 598           HN       ASN 598  67.371   6.837   1.580
 1213    HA   ASN 598           HA       ASN 598  69.175   5.105   0.384
 1214    HB2  ASN 598           HB2      ASN 598  69.831   8.039   0.421
 1215    HB3  ASN 598           HB1      ASN 598  69.841   6.913  -0.928
 1216   HD21  ASN 598          HD21      ASN 598  67.400   5.818  -0.981
 1217   HD22  ASN 598          HD22      ASN 598  66.186   6.988  -1.123
 1218    H    CYS 599           HN       CYS 599  69.717   7.160   3.183
 1219    HA   CYS 599           HA       CYS 599  72.602   6.685   3.200
 1220    HB2  CYS 599           HB2      CYS 599  70.735   7.850   5.291
 1221    HB3  CYS 599           HB1      CYS 599  72.488   7.807   5.421
 1222    H    PHE 600           HN       PHE 600  69.961   5.868   5.465
 1223    HA   PHE 600           HA       PHE 600  71.393   3.968   6.985
 1224    HB2  PHE 600           HB2      PHE 600  69.431   4.466   8.066
 1225    HB3  PHE 600           HB1      PHE 600  68.574   4.756   6.562
 1226    HD1  PHE 600           HD1      PHE 600  67.538   2.903   5.322
 1227    HD2  PHE 600           HD2      PHE 600  69.433   2.264   9.115
 1228    HE1  PHE 600           HE1      PHE 600  66.414   0.701   5.506
 1229    HE2  PHE 600           HE2      PHE 600  68.309   0.060   9.303
 1230    HZ   PHE 600           HZ       PHE 600  66.802  -0.722   7.499
 1231    H    LEU 601           HN       LEU 601  69.120   3.339   4.270
 1232    HA   LEU 601           HA       LEU 601  69.401   0.566   4.207
 1233    HB2  LEU 601           HB2      LEU 601  68.080   0.778   2.369
 1234    HB3  LEU 601           HB1      LEU 601  68.218   2.512   2.586
 1235    HG   LEU 601           HG       LEU 601  70.264   2.457   1.105
 1236   HD11  LEU 601          HD11      LEU 601  69.713   0.002  -0.294
 1237   HD12  LEU 601          HD12      LEU 601  69.935  -0.390   1.408
 1238   HD13  LEU 601          HD13      LEU 601  71.191   0.482   0.534
 1239   HD21  LEU 601          HD21      LEU 601  67.690   1.386  -0.081
 1240   HD22  LEU 601          HD22      LEU 601  68.960   2.223  -0.972
 1241   HD23  LEU 601          HD23      LEU 601  68.036   3.080   0.258
 1242    H    LYS 602           HN       LYS 602  71.551   2.990   2.719
 1243    HA   LYS 602           HA       LYS 602  73.274   1.185   1.412
 1244    HB2  LYS 602           HB2      LYS 602  73.310   3.785   1.425
 1245    HB3  LYS 602           HB1      LYS 602  74.333   3.618   2.845
 1246    HG2  LYS 602           HG2      LYS 602  75.947   2.317   1.594
 1247    HG3  LYS 602           HG1      LYS 602  74.898   2.288   0.179
 1248    HD2  LYS 602           HD2      LYS 602  75.156   4.612  -0.210
 1249    HD3  LYS 602           HD1      LYS 602  75.831   4.888   1.394
 1250    HE2  LYS 602           HE2      LYS 602  77.780   3.367   0.673
 1251    HE3  LYS 602           HE1      LYS 602  77.135   3.506  -0.963
 1252    HZ1  LYS 602           HZ1      LYS 602  77.203   6.003  -0.530
 1253    HZ2  LYS 602           HZ2      LYS 602  78.681   5.212  -0.811
 1254    HZ3  LYS 602           HZ3      LYS 602  78.225   5.631   0.771
 1255    H    LEU 603           HN       LEU 603  72.814   1.740   4.790
 1256    HA   LEU 603           HA       LEU 603  75.393   0.482   5.516
 1257    HB2  LEU 603           HB2      LEU 603  73.238   1.185   7.492
 1258    HB3  LEU 603           HB1      LEU 603  74.990   1.224   7.695
 1259    HG   LEU 603           HG       LEU 603  73.319   3.103   6.022
 1260   HD11  LEU 603          HD11      LEU 603  75.130   3.916   8.264
 1261   HD12  LEU 603          HD12      LEU 603  73.517   3.304   8.632
 1262   HD13  LEU 603          HD13      LEU 603  73.710   4.737   7.624
 1263   HD21  LEU 603          HD21      LEU 603  75.342   2.859   4.815
 1264   HD22  LEU 603          HD22      LEU 603  76.302   2.742   6.285
 1265   HD23  LEU 603          HD23      LEU 603  75.606   4.290   5.805
 1266    H    PHE 604           HN       PHE 604  71.934  -0.149   6.264
 1267    HA   PHE 604           HA       PHE 604  72.648  -2.999   6.802
 1268    HB2  PHE 604           HB2      PHE 604  70.385  -1.183   7.588
 1269    HB3  PHE 604           HB1      PHE 604  70.055  -2.911   7.493
 1270    HD1  PHE 604           HD1      PHE 604  72.847  -0.715   8.741
 1271    HD2  PHE 604           HD2      PHE 604  70.261  -4.056   9.519
 1272    HE1  PHE 604           HE1      PHE 604  73.913  -1.023  10.952
 1273    HE2  PHE 604           HE2      PHE 604  71.332  -4.365  11.732
 1274    HZ   PHE 604           HZ       PHE 604  73.158  -2.848  12.450
 1275    H    CYS 605           HN       CYS 605  72.513  -1.854   4.051
 1276    HA   CYS 605           HA       CYS 605  70.164  -2.441   2.652
 1277    HB2  CYS 605           HB2      CYS 605  71.971  -1.536   1.395
 1278    HB3  CYS 605           HB1      CYS 605  73.067  -2.824   1.893
 1279    HG   CYS 605           HG       CYS 605  72.067  -4.373   0.177
  Start of MODEL   15
    1    H    MET   1           HT1      MET   1  92.132 -24.953   3.395
    2    HA   MET   1           HA       MET   1  91.074 -27.151   4.227
    3    HB2  MET   1           HB2      MET   1  93.099 -26.860   2.767
    4    HB3  MET   1           HB1      MET   1  94.085 -26.800   4.225
    5    HG2  MET   1           HG2      MET   1  93.053 -29.038   4.867
    6    HG3  MET   1           HG1      MET   1  92.377 -29.094   3.245
    7    HE1  MET   1           HE1      MET   1  95.140 -29.727   0.876
    8    HE2  MET   1           HE2      MET   1  93.944 -28.459   1.133
    9    HE3  MET   1           HE3      MET   1  93.487 -30.147   1.348
   10    H    ALA   2           HN       ALA   2  94.072 -27.368   5.881
   11    HA   ALA   2           HA       ALA   2  92.791 -27.070   8.555
   12    HB1  ALA   2           HB1      ALA   2  93.717 -29.304   9.219
   13    HB2  ALA   2           HB2      ALA   2  94.125 -29.594   7.528
   14    HB3  ALA   2           HB3      ALA   2  92.437 -29.418   8.011
   15    H    LEU   3           HN       LEU   3  95.667 -27.583   6.592
   16    HA   LEU   3           HA       LEU   3  97.667 -27.292   8.566
   17    HB2  LEU   3           HB2      LEU   3  97.595 -26.358   5.711
   18    HB3  LEU   3           HB1      LEU   3  99.049 -26.506   6.694
   19    HG   LEU   3           HG       LEU   3  98.333 -28.967   7.071
   20   HD11  LEU   3          HD11      LEU   3  96.179 -29.254   6.278
   21   HD12  LEU   3          HD12      LEU   3  97.075 -29.724   4.840
   22   HD13  LEU   3          HD13      LEU   3  96.385 -28.108   4.954
   23   HD21  LEU   3          HD21      LEU   3  99.400 -29.634   4.947
   24   HD22  LEU   3          HD22      LEU   3 100.231 -28.280   5.713
   25   HD23  LEU   3          HD23      LEU   3  99.164 -27.997   4.339
   26    H    ASP   4           HN       ASP   4  96.578 -24.913   6.240
   27    HA   ASP   4           HA       ASP   4  97.487 -22.707   7.959
   28    HB2  ASP   4           HB2      ASP   4  97.912 -22.713   5.504
   29    HB3  ASP   4           HB1      ASP   4  96.164 -22.715   5.265
   30    H    GLY   5           HN       GLY   5  95.181 -24.474   8.571
   31    HA2  GLY   5           HA2      GLY   5  92.911 -22.498   8.548
   32    HA3  GLY   5           HA1      GLY   5  92.740 -24.237   8.510
   33    H    ILE   6           HN       ILE   6  95.142 -24.113  10.284
   34    HA   ILE   6           HA       ILE   6  94.883 -25.054  12.593
   35    HB   ILE   6           HB       ILE   6  95.875 -22.829  13.627
   36   HG12  ILE   6          HG12      ILE   6  94.827 -21.711  11.347
   37   HG13  ILE   6          HG11      ILE   6  96.199 -21.074  12.176
   38   HG21  ILE   6          HG21      ILE   6  97.267 -24.686  13.158
   39   HG22  ILE   6          HG22      ILE   6  97.995 -23.314  12.325
   40   HG23  ILE   6          HG23      ILE   6  97.044 -24.497  11.417
   41   HD11  ILE   6          HD11      ILE   6  97.735 -22.054  10.668
   42   HD12  ILE   6          HD12      ILE   6  96.449 -21.365   9.675
   43   HD13  ILE   6          HD13      ILE   6  96.482 -23.087  10.007
   44    H    ARG   7           HN       ARG   7  94.206 -21.695  13.067
   45    HA   ARG   7           HA       ARG   7  91.462 -22.069  13.914
   46    HB2  ARG   7           HB2      ARG   7  91.914 -21.524  16.309
   47    HB3  ARG   7           HB1      ARG   7  92.463 -23.109  15.803
   48    HG2  ARG   7           HG2      ARG   7  94.535 -21.038  15.429
   49    HG3  ARG   7           HG1      ARG   7  94.028 -21.201  17.105
   50    HD2  ARG   7           HD2      ARG   7  94.713 -23.447  17.220
   51    HD3  ARG   7           HD1      ARG   7  94.691 -23.633  15.467
   52    HE   ARG   7           HE       ARG   7  96.640 -21.774  15.753
   53   HH11  ARG   7          HH11      ARG   7  98.803 -22.185  16.238
   54   HH12  ARG   7          HH12      ARG   7  99.224 -23.610  17.128
   55   HH21  ARG   7          HH21      ARG   7  95.952 -24.722  17.413
   56   HH22  ARG   7          HH22      ARG   7  97.609 -25.044  17.794
   57    H    MET   8           HN       MET   8  93.069 -19.942  15.982
   58    HA   MET   8           HA       MET   8  92.964 -17.640  14.168
   59    HB2  MET   8           HB2      MET   8  91.279 -16.803  16.307
   60    HB3  MET   8           HB1      MET   8  90.831 -17.062  14.633
   61    HG2  MET   8           HG2      MET   8  90.163 -19.304  15.012
   62    HG3  MET   8           HG1      MET   8  90.953 -19.402  16.567
   63    HE1  MET   8           HE1      MET   8  86.807 -17.962  15.539
   64    HE2  MET   8           HE2      MET   8  87.817 -19.215  14.824
   65    HE3  MET   8           HE3      MET   8  88.181 -17.519  14.517
   66    HA   PRO   9           HA       PRO   9  94.466 -15.970  18.610
   67    HB2  PRO   9           HB2      PRO   9  95.183 -18.742  19.551
   68    HB3  PRO   9           HB1      PRO   9  94.840 -17.288  20.518
   69    HG2  PRO   9           HG2      PRO   9  92.984 -19.114  20.225
   70    HG3  PRO   9           HG1      PRO   9  92.570 -17.393  20.083
   71    HD2  PRO   9           HD2      PRO   9  92.811 -19.439  17.917
   72    HD3  PRO   9           HD1      PRO   9  91.755 -18.035  18.043
   73    H    ASP  10           HN       ASP  10  95.727 -18.951  17.288
   74    HA   ASP  10           HA       ASP  10  98.450 -17.725  16.994
   75    HB2  ASP  10           HB2      ASP  10  98.033 -20.019  18.152
   76    HB3  ASP  10           HB1      ASP  10  97.770 -20.630  16.521
   77    H    GLY  11           HN       GLY  11  95.659 -18.800  15.317
   78    HA2  GLY  11           HA2      GLY  11  97.000 -19.046  12.721
   79    HA3  GLY  11           HA1      GLY  11  95.266 -19.178  13.022
   80    H    CYS  12           HN       CYS  12  95.988 -16.513  14.635
   81    HA   CYS  12           HA       CYS  12  96.401 -14.572  12.530
   82    HB2  CYS  12           HB2      CYS  12  94.168 -15.115  11.862
   83    HB3  CYS  12           HB1      CYS  12  93.605 -15.101  13.534
   84    HG   CYS  12           HG       CYS  12  93.104 -12.702  13.164
   85    H    TYR  13           HN       TYR  13  94.256 -14.486  15.387
   86    HA   TYR  13           HA       TYR  13  96.248 -13.133  17.022
   87    HB2  TYR  13           HB2      TYR  13  95.346 -11.403  15.298
   88    HB3  TYR  13           HB1      TYR  13  93.865 -11.441  16.249
   89    HD1  TYR  13           HD1      TYR  13  94.060 -11.024  18.790
   90    HD2  TYR  13           HD2      TYR  13  97.182 -10.085  15.992
   91    HE1  TYR  13           HE1      TYR  13  95.078  -9.480  20.442
   92    HE2  TYR  13           HE2      TYR  13  98.199  -8.541  17.644
   93    HH   TYR  13           HH       TYR  13  98.225  -8.100  19.972
   94    H    ALA  14           HN       ALA  14  92.744 -13.528  16.508
   95    HA   ALA  14           HA       ALA  14  92.460 -14.858  19.087
   96    HB1  ALA  14           HB1      ALA  14  92.490 -12.531  19.853
   97    HB2  ALA  14           HB2      ALA  14  90.864 -13.193  20.020
   98    HB3  ALA  14           HB3      ALA  14  91.243 -12.113  18.679
   99    H    ASP  15           HN       ASP  15  90.730 -13.167  16.481
  100    HA   ASP  15           HA       ASP  15  89.067 -15.585  16.113
  101    HB2  ASP  15           HB2      ASP  15  87.931 -14.022  17.786
  102    HB3  ASP  15           HB1      ASP  15  87.759 -12.884  16.449
  103    H    GLY  16           HN       GLY  16  90.945 -13.303  14.788
  104    HA2  GLY  16           HA2      GLY  16  91.290 -13.285  12.353
  105    HA3  GLY  16           HA1      GLY  16  89.548 -13.441  12.141
  106    H    THR  17           HN       THR  17  90.748 -11.320  14.608
  107    HA   THR  17           HA       THR  17  89.446  -9.062  13.316
  108    HB   THR  17           HB       THR  17  90.249  -7.842  15.361
  109    HG1  THR  17           HG1      THR  17  91.734  -8.728  16.525
  110   HG21  THR  17          HG21      THR  17  88.810  -9.065  16.918
  111   HG22  THR  17          HG22      THR  17  88.896 -10.499  15.894
  112   HG23  THR  17          HG23      THR  17  88.083  -9.046  15.311
  113    H    TRP  18           HN       TRP  18  90.434  -7.587  12.097
  114    HA   TRP  18           HA       TRP  18  93.325  -7.076  12.288
  115    HB2  TRP  18           HB2      TRP  18  93.110  -7.206   9.572
  116    HB3  TRP  18           HB1      TRP  18  93.702  -8.527  10.559
  117    HD1  TRP  18           HD1      TRP  18  90.218  -7.289   9.366
  118    HE1  TRP  18           HE1      TRP  18  88.845  -9.365   8.682
  119    HE3  TRP  18           HE3      TRP  18  93.589 -10.972  10.440
  120    HZ2  TRP  18           HZ2      TRP  18  89.141 -12.205   8.601
  121    HZ3  TRP  18           HZ3      TRP  18  93.019 -13.351  10.048
  122    HH2  TRP  18           HH2      TRP  18  90.801 -13.972   9.130
  123    H    GLU  19           HN       GLU  19  93.593  -4.892  12.191
  124    HA   GLU  19           HA       GLU  19  91.309  -3.232  11.418
  125    HB2  GLU  19           HB2      GLU  19  93.400  -1.449  11.860
  126    HB3  GLU  19           HB1      GLU  19  92.247  -1.979  13.079
  127    HG2  GLU  19           HG2      GLU  19  94.597  -2.266  13.805
  128    HG3  GLU  19           HG1      GLU  19  93.709  -3.786  13.737
  129    H    LEU  20           HN       LEU  20  90.970  -2.276   9.587
  130    HA   LEU  20           HA       LEU  20  92.854  -2.718   7.389
  131    HB2  LEU  20           HB2      LEU  20  90.066  -2.533   7.615
  132    HB3  LEU  20           HB1      LEU  20  90.492  -1.003   6.861
  133    HG   LEU  20           HG       LEU  20  90.109  -2.484   5.065
  134   HD11  LEU  20          HD11      LEU  20  92.517  -1.279   5.287
  135   HD12  LEU  20          HD12      LEU  20  92.021  -2.229   3.895
  136   HD13  LEU  20          HD13      LEU  20  93.044  -2.958   5.121
  137   HD21  LEU  20          HD21      LEU  20  91.508  -4.499   6.810
  138   HD22  LEU  20          HD22      LEU  20  91.510  -4.735   5.065
  139   HD23  LEU  20          HD23      LEU  20  89.983  -4.638   5.939
  140    H    SER  21           HN       SER  21  94.234  -1.123   6.622
  141    HA   SER  21           HA       SER  21  94.453   1.327   8.195
  142    HB2  SER  21           HB2      SER  21  96.257  -0.154   6.760
  143    HB3  SER  21           HB1      SER  21  95.946   1.168   5.637
  144    HG   SER  21           HG       SER  21  96.624   1.447   8.386
  145    H    VAL  22           HN       VAL  22  93.905   3.395   7.544
  146    HA   VAL  22           HA       VAL  22  92.612   3.684   4.885
  147    HB   VAL  22           HB       VAL  22  91.374   4.305   7.561
  148   HG11  VAL  22          HG11      VAL  22  91.106   6.367   6.283
  149   HG12  VAL  22          HG12      VAL  22  89.584   5.485   6.269
  150   HG13  VAL  22          HG13      VAL  22  90.630   5.451   4.847
  151   HG21  VAL  22          HG21      VAL  22  89.469   3.124   6.502
  152   HG22  VAL  22          HG22      VAL  22  90.922   2.123   6.530
  153   HG23  VAL  22          HG23      VAL  22  90.427   2.923   5.028
  154    H    HIS  23           HN       HIS  23  93.830   5.090   3.892
  155    HA   HIS  23           HA       HIS  23  95.194   7.268   5.320
  156    HB2  HIS  23           HB2      HIS  23  95.111   6.239   2.493
  157    HB3  HIS  23           HB1      HIS  23  95.879   7.781   2.863
  158    HD1  HIS  23           HD1      HIS  23  98.343   7.268   2.796
  159    HD2  HIS  23           HD2      HIS  23  96.213   4.392   4.935
  160    HE1  HIS  23           HE1      HIS  23 100.062   5.699   3.798
  161    H    VAL  24           HN       VAL  24  93.709   8.876   5.925
  162    HA   VAL  24           HA       VAL  24  91.469   9.531   4.189
  163    HB   VAL  24           HB       VAL  24  92.519  11.444   6.274
  164   HG11  VAL  24          HG11      VAL  24  89.749  10.445   5.560
  165   HG12  VAL  24          HG12      VAL  24  90.459  11.939   4.961
  166   HG13  VAL  24          HG13      VAL  24  90.118  11.749   6.684
  167   HG21  VAL  24          HG21      VAL  24  91.231  10.020   7.958
  168   HG22  VAL  24          HG22      VAL  24  92.776   9.357   7.426
  169   HG23  VAL  24          HG23      VAL  24  91.268   8.728   6.758
  170    H    THR  25           HN       THR  25  91.896  10.431   2.221
  171    HA   THR  25           HA       THR  25  94.314  12.025   1.804
  172    HB   THR  25           HB       THR  25  93.896  11.777  -0.450
  173    HG1  THR  25           HG1      THR  25  91.394  11.493  -0.894
  174   HG21  THR  25          HG21      THR  25  93.645   9.522   0.675
  175   HG22  THR  25          HG22      THR  25  92.882   9.647  -0.910
  176   HG23  THR  25          HG23      THR  25  91.900   9.736   0.551
  177    H    ASP  26           HN       ASP  26  90.822  12.664   2.029
  178    HA   ASP  26           HA       ASP  26  91.031  15.465   1.380
  179    HB2  ASP  26           HB2      ASP  26  88.911  13.964   1.464
  180    HB3  ASP  26           HB1      ASP  26  88.913  14.297   3.196
  181    H    LEU  27           HN       LEU  27  92.439  13.848   3.820
  182    HA   LEU  27           HA       LEU  27  92.509  16.260   5.571
  183    HB2  LEU  27           HB2      LEU  27  91.440  13.601   6.218
  184    HB3  LEU  27           HB1      LEU  27  92.646  14.118   7.376
  185    HG   LEU  27           HG       LEU  27  90.352  15.909   6.532
  186   HD11  LEU  27          HD11      LEU  27  89.345  15.143   8.772
  187   HD12  LEU  27          HD12      LEU  27  90.462  13.780   8.673
  188   HD13  LEU  27          HD13      LEU  27  89.237  14.010   7.426
  189   HD21  LEU  27          HD21      LEU  27  92.084  17.126   7.660
  190   HD22  LEU  27          HD22      LEU  27  92.301  15.849   8.853
  191   HD23  LEU  27          HD23      LEU  27  90.839  16.831   8.871
  192    H    ASN  28           HN       ASN  28  93.970  13.338   4.365
  193    HA   ASN  28           HA       ASN  28  96.243  12.890   3.983
  194    HB2  ASN  28           HB2      ASN  28  96.512  15.476   4.180
  195    HB3  ASN  28           HB1      ASN  28  97.079  15.142   5.811
  196   HD21  ASN  28          HD21      ASN  28  98.092  12.449   4.757
  197   HD22  ASN  28          HD22      ASN  28  99.571  12.830   4.025
  198    H    ARG  29           HN       ARG  29  94.492  12.367   6.588
  199    HA   ARG  29           HA       ARG  29  96.693  11.659   8.427
  200    HB2  ARG  29           HB2      ARG  29  93.697  11.390   8.705
  201    HB3  ARG  29           HB1      ARG  29  94.879  11.042   9.967
  202    HG2  ARG  29           HG2      ARG  29  95.634  13.348   9.966
  203    HG3  ARG  29           HG1      ARG  29  94.582  13.726   8.609
  204    HD2  ARG  29           HD2      ARG  29  93.315  14.467  10.436
  205    HD3  ARG  29           HD1      ARG  29  92.670  12.850  10.162
  206    HE   ARG  29           HE       ARG  29  94.405  13.679  12.416
  207   HH11  ARG  29          HH11      ARG  29  94.503  12.196  14.105
  208   HH12  ARG  29          HH12      ARG  29  93.844  10.609  13.892
  209   HH21  ARG  29          HH21      ARG  29  92.823  11.167  10.632
  210   HH22  ARG  29          HH22      ARG  29  92.896  10.030  11.934
  211    H    ASP  30           HN       ASP  30  96.060   9.468   9.560
  212    HA   ASP  30           HA       ASP  30  95.340   7.393   7.574
  213    HB2  ASP  30           HB2      ASP  30  97.869   7.456   9.237
  214    HB3  ASP  30           HB1      ASP  30  97.240   5.994   8.474
  215    H    VAL  31           HN       VAL  31  93.695   6.355   8.474
  216    HA   VAL  31           HA       VAL  31  93.699   5.981  11.459
  217    HB   VAL  31           HB       VAL  31  91.301   6.032   9.620
  218   HG11  VAL  31          HG11      VAL  31  90.159   6.463  11.836
  219   HG12  VAL  31          HG12      VAL  31  91.699   6.131  12.623
  220   HG13  VAL  31          HG13      VAL  31  90.895   4.866  11.695
  221   HG21  VAL  31          HG21      VAL  31  90.951   8.337  10.646
  222   HG22  VAL  31          HG22      VAL  31  92.292   8.235   9.506
  223   HG23  VAL  31          HG23      VAL  31  92.608   8.244  11.241
  224    H    THR  32           HN       THR  32  92.771   4.015  12.229
  225    HA   THR  32           HA       THR  32  92.663   1.773  10.256
  226    HB   THR  32           HB       THR  32  93.728   0.771  12.735
  227    HG1  THR  32           HG1      THR  32  94.292   3.156  12.781
  228   HG21  THR  32          HG21      THR  32  95.471  -0.076  11.408
  229   HG22  THR  32          HG22      THR  32  95.415   1.291  10.295
  230   HG23  THR  32          HG23      THR  32  94.144   0.069  10.257
  231    H    LEU  33           HN       LEU  33  90.884   0.557  10.565
  232    HA   LEU  33           HA       LEU  33  89.283   0.895  13.075
  233    HB2  LEU  33           HB2      LEU  33  88.604   0.726  10.163
  234    HB3  LEU  33           HB1      LEU  33  87.452   0.062  11.301
  235    HG   LEU  33           HG       LEU  33  87.114   2.504  10.605
  236   HD11  LEU  33          HD11      LEU  33  86.217   1.321  12.726
  237   HD12  LEU  33          HD12      LEU  33  86.198   3.081  12.681
  238   HD13  LEU  33          HD13      LEU  33  87.454   2.238  13.586
  239   HD21  LEU  33          HD21      LEU  33  88.501   4.189  11.512
  240   HD22  LEU  33          HD22      LEU  33  89.632   2.994  10.885
  241   HD23  LEU  33          HD23      LEU  33  89.295   3.080  12.612
  242    H    ARG  34           HN       ARG  34  89.428  -0.954  14.280
  243    HA   ARG  34           HA       ARG  34  90.309  -3.434  13.272
  244    HB2  ARG  34           HB2      ARG  34  90.375  -2.831  15.679
  245    HB3  ARG  34           HB1      ARG  34  88.622  -3.015  15.725
  246    HG2  ARG  34           HG2      ARG  34  90.409  -5.218  14.641
  247    HG3  ARG  34           HG1      ARG  34  90.078  -5.076  16.332
  248    HD2  ARG  34           HD2      ARG  34  87.541  -4.893  15.156
  249    HD3  ARG  34           HD1      ARG  34  88.379  -6.145  14.267
  250    HE   ARG  34           HE       ARG  34  88.286  -7.490  16.197
  251   HH11  ARG  34          HH11      ARG  34  87.707  -7.880  18.348
  252   HH12  ARG  34          HH12      ARG  34  87.274  -6.548  19.368
  253   HH21  ARG  34          HH21      ARG  34  87.734  -4.162  16.893
  254   HH22  ARG  34          HH22      ARG  34  87.290  -4.443  18.544
  255    H    VAL  35           HN       VAL  35  89.242  -5.066  12.451
  256    HA   VAL  35           HA       VAL  35  86.315  -5.186  12.425
  257    HB   VAL  35           HB       VAL  35  86.284  -5.191   9.875
  258   HG11  VAL  35          HG11      VAL  35  87.193  -2.514  10.950
  259   HG12  VAL  35          HG12      VAL  35  85.643  -3.211  11.421
  260   HG13  VAL  35          HG13      VAL  35  85.967  -2.848   9.730
  261   HG21  VAL  35          HG21      VAL  35  88.992  -3.886  10.280
  262   HG22  VAL  35          HG22      VAL  35  88.150  -4.068   8.741
  263   HG23  VAL  35          HG23      VAL  35  88.730  -5.493   9.604
  264    H    THR  36           HN       THR  36  85.902  -6.900  10.410
  265    HA   THR  36           HA       THR  36  87.935  -9.047  10.523
  266    HB   THR  36           HB       THR  36  85.942 -10.656  10.985
  267    HG1  THR  36           HG1      THR  36  84.951  -8.375  12.305
  268   HG21  THR  36          HG21      THR  36  86.190 -10.309  13.467
  269   HG22  THR  36          HG22      THR  36  87.123  -8.860  13.103
  270   HG23  THR  36          HG23      THR  36  87.709 -10.439  12.587
  271    H    GLY  37           HN       GLY  37  87.293 -10.740   8.832
  272    HA2  GLY  37           HA2      GLY  37  86.429  -9.354   6.454
  273    HA3  GLY  37           HA1      GLY  37  86.842 -11.061   6.543
  274    H    GLU  38           HN       GLU  38  84.436  -9.208   8.359
  275    HA   GLU  38           HA       GLU  38  82.246 -10.646   6.986
  276    HB2  GLU  38           HB2      GLU  38  81.338 -11.574   8.938
  277    HB3  GLU  38           HB1      GLU  38  83.058 -11.889   9.103
  278    HG2  GLU  38           HG2      GLU  38  82.660 -10.996  11.209
  279    HG3  GLU  38           HG1      GLU  38  82.993  -9.503  10.335
  280    H    VAL  39           HN       VAL  39  83.538  -7.789   7.943
  281    HA   VAL  39           HA       VAL  39  81.034  -6.558   8.899
  282    HB   VAL  39           HB       VAL  39  82.295  -4.627   9.365
  283   HG11  VAL  39          HG11      VAL  39  82.825  -6.636  10.750
  284   HG12  VAL  39          HG12      VAL  39  84.127  -5.450  10.702
  285   HG13  VAL  39          HG13      VAL  39  84.230  -6.915   9.726
  286   HG21  VAL  39          HG21      VAL  39  84.655  -4.346   8.518
  287   HG22  VAL  39          HG22      VAL  39  83.433  -4.244   7.264
  288   HG23  VAL  39          HG23      VAL  39  84.378  -5.726   7.461
  289    H    HIS  40           HN       HIS  40  79.932  -4.914   7.736
  290    HA   HIS  40           HA       HIS  40  80.185  -5.164   4.801
  291    HB2  HIS  40           HB2      HIS  40  78.221  -3.208   5.333
  292    HB3  HIS  40           HB1      HIS  40  77.922  -4.915   5.016
  293    HD1  HIS  40           HD1      HIS  40  77.660  -6.490   7.118
  294    HD2  HIS  40           HD2      HIS  40  77.820  -2.421   8.007
  295    HE1  HIS  40           HE1      HIS  40  76.854  -6.248   9.507
  296    H    ILE  41           HN       ILE  41  80.886  -3.470   3.449
  297    HA   ILE  41           HA       ILE  41  82.878  -1.713   4.305
  298    HB   ILE  41           HB       ILE  41  80.871  -1.291   2.074
  299   HG12  ILE  41          HG12      ILE  41  83.717  -2.315   1.921
  300   HG13  ILE  41          HG11      ILE  41  82.316  -3.379   2.065
  301   HG21  ILE  41          HG21      ILE  41  82.774   0.120   1.124
  302   HG22  ILE  41          HG22      ILE  41  83.473   0.092   2.747
  303   HG23  ILE  41          HG23      ILE  41  81.891   0.824   2.481
  304   HD11  ILE  41          HD11      ILE  41  81.471  -2.779  -0.021
  305   HD12  ILE  41          HD12      ILE  41  83.208  -2.790  -0.321
  306   HD13  ILE  41          HD13      ILE  41  82.365  -1.262  -0.071
  307    H    GLY  42           HN       GLY  42  79.468  -0.870   3.750
  308    HA2  GLY  42           HA2      GLY  42  79.569   1.766   4.742
  309    HA3  GLY  42           HA1      GLY  42  78.122   0.761   4.772
  310    H    GLY  43           HN       GLY  43  79.903  -1.224   6.315
  311    HA2  GLY  43           HA2      GLY  43  79.016  -0.431   8.961
  312    HA3  GLY  43           HA1      GLY  43  80.054  -1.811   8.586
  313    H    VAL  44           HN       VAL  44  81.929  -0.126   7.092
  314    HA   VAL  44           HA       VAL  44  83.567   0.788   9.361
  315    HB   VAL  44           HB       VAL  44  83.980   0.352   6.399
  316   HG11  VAL  44          HG11      VAL  44  85.067   2.477   6.657
  317   HG12  VAL  44          HG12      VAL  44  86.343   1.264   6.761
  318   HG13  VAL  44          HG13      VAL  44  85.728   2.024   8.228
  319   HG21  VAL  44          HG21      VAL  44  85.568  -0.495   8.842
  320   HG22  VAL  44          HG22      VAL  44  85.801  -1.064   7.189
  321   HG23  VAL  44          HG23      VAL  44  84.325  -1.475   8.063
  322    H    MET  45           HN       MET  45  81.766   2.153   6.617
  323    HA   MET  45           HA       MET  45  82.612   4.846   6.724
  324    HB2  MET  45           HB2      MET  45  79.924   3.568   6.182
  325    HB3  MET  45           HB1      MET  45  80.076   5.318   6.192
  326    HG2  MET  45           HG2      MET  45  82.081   4.841   4.517
  327    HG3  MET  45           HG1      MET  45  81.213   3.333   4.247
  328    HE1  MET  45           HE1      MET  45  78.347   3.749   4.520
  329    HE2  MET  45           HE2      MET  45  78.933   3.117   2.981
  330    HE3  MET  45           HE3      MET  45  77.732   4.413   3.000
  331    H    LEU  46           HN       LEU  46  80.402   3.036   8.769
  332    HA   LEU  46           HA       LEU  46  79.478   5.266  10.343
  333    HB2  LEU  46           HB2      LEU  46  78.487   2.878  10.095
  334    HB3  LEU  46           HB1      LEU  46  79.662   2.415  11.322
  335    HG   LEU  46           HG       LEU  46  78.627   4.619  12.546
  336   HD11  LEU  46          HD11      LEU  46  76.363   3.463  10.883
  337   HD12  LEU  46          HD12      LEU  46  77.001   5.110  10.800
  338   HD13  LEU  46          HD13      LEU  46  76.152   4.566  12.245
  339   HD21  LEU  46          HD21      LEU  46  77.229   3.093  13.864
  340   HD22  LEU  46          HD22      LEU  46  78.779   2.336  13.501
  341   HD23  LEU  46          HD23      LEU  46  77.338   1.870  12.596
  342    H    LYS  47           HN       LYS  47  81.589   2.584  11.399
  343    HA   LYS  47           HA       LYS  47  82.476   3.764  13.773
  344    HB2  LYS  47           HB2      LYS  47  84.110   1.944  11.998
  345    HB3  LYS  47           HB1      LYS  47  84.278   2.154  13.744
  346    HG2  LYS  47           HG2      LYS  47  81.851   1.418  13.944
  347    HG3  LYS  47           HG1      LYS  47  81.933   0.971  12.242
  348    HD2  LYS  47           HD2      LYS  47  83.973  -0.084  14.205
  349    HD3  LYS  47           HD1      LYS  47  82.404  -0.863  14.037
  350    HE2  LYS  47           HE2      LYS  47  84.359  -0.371  11.771
  351    HE3  LYS  47           HE1      LYS  47  84.094  -1.916  12.575
  352    HZ1  LYS  47           HZ1      LYS  47  81.660  -0.701  11.681
  353    HZ2  LYS  47           HZ2      LYS  47  82.247  -2.273  11.419
  354    HZ3  LYS  47           HZ3      LYS  47  82.738  -1.000  10.406
  355    H    LEU  48           HN       LEU  48  84.294   3.788  10.670
  356    HA   LEU  48           HA       LEU  48  86.459   5.321  11.451
  357    HB2  LEU  48           HB2      LEU  48  86.230   4.424   9.177
  358    HB3  LEU  48           HB1      LEU  48  84.919   5.548   8.845
  359    HG   LEU  48           HG       LEU  48  86.519   7.453   9.182
  360   HD11  LEU  48          HD11      LEU  48  88.195   6.484  10.608
  361   HD12  LEU  48          HD12      LEU  48  88.976   6.819   9.067
  362   HD13  LEU  48          HD13      LEU  48  88.486   5.174   9.463
  363   HD21  LEU  48          HD21      LEU  48  87.888   6.943   7.098
  364   HD22  LEU  48          HD22      LEU  48  86.142   6.748   6.922
  365   HD23  LEU  48          HD23      LEU  48  87.173   5.331   7.131
  366    H    VAL  49           HN       VAL  49  83.304   6.634  10.381
  367    HA   VAL  49           HA       VAL  49  84.046   9.382  10.840
  368    HB   VAL  49           HB       VAL  49  81.366   7.992  10.635
  369   HG11  VAL  49          HG11      VAL  49  82.033  10.913  11.050
  370   HG12  VAL  49          HG12      VAL  49  80.897   9.917  11.959
  371   HG13  VAL  49          HG13      VAL  49  80.519  10.398  10.305
  372   HG21  VAL  49          HG21      VAL  49  82.653   9.982   8.752
  373   HG22  VAL  49          HG22      VAL  49  81.324   8.870   8.419
  374   HG23  VAL  49          HG23      VAL  49  82.961   8.248   8.629
  375    H    GLU  50           HN       GLU  50  82.238   7.014  12.824
  376    HA   GLU  50           HA       GLU  50  81.505   8.574  14.997
  377    HB2  GLU  50           HB2      GLU  50  82.620   5.770  14.914
  378    HB3  GLU  50           HB1      GLU  50  82.065   6.498  16.415
  379    HG2  GLU  50           HG2      GLU  50  80.351   6.315  13.924
  380    HG3  GLU  50           HG1      GLU  50  80.322   5.115  15.214
  381    H    LYS  51           HN       LYS  51  84.729   7.319  14.259
  382    HA   LYS  51           HA       LYS  51  85.964   8.172  16.699
  383    HB2  LYS  51           HB2      LYS  51  87.088   7.659  13.935
  384    HB3  LYS  51           HB1      LYS  51  88.076   7.939  15.369
  385    HG2  LYS  51           HG2      LYS  51  87.013   6.019  16.488
  386    HG3  LYS  51           HG1      LYS  51  86.026   5.726  15.055
  387    HD2  LYS  51           HD2      LYS  51  87.847   5.005  13.775
  388    HD3  LYS  51           HD1      LYS  51  89.019   5.844  14.787
  389    HE2  LYS  51           HE2      LYS  51  88.579   4.254  16.624
  390    HE3  LYS  51           HE1      LYS  51  87.406   3.414  15.612
  391    HZ1  LYS  51           HZ1      LYS  51  90.058   2.858  15.759
  392    HZ2  LYS  51           HZ2      LYS  51  89.946   3.771  14.330
  393    HZ3  LYS  51           HZ3      LYS  51  89.016   2.362  14.517
  394    H    LEU  52           HN       LEU  52  85.683   9.749  13.488
  395    HA   LEU  52           HA       LEU  52  87.195  12.035  14.137
  396    HB2  LEU  52           HB2      LEU  52  85.768  11.042  11.943
  397    HB3  LEU  52           HB1      LEU  52  84.906  12.512  12.349
  398    HG   LEU  52           HG       LEU  52  86.595  13.089  10.770
  399   HD11  LEU  52          HD11      LEU  52  88.040  13.973  13.226
  400   HD12  LEU  52          HD12      LEU  52  86.332  14.392  13.114
  401   HD13  LEU  52          HD13      LEU  52  87.452  14.918  11.861
  402   HD21  LEU  52          HD21      LEU  52  88.819  12.383  10.783
  403   HD22  LEU  52          HD22      LEU  52  88.011  10.967  11.445
  404   HD23  LEU  52          HD23      LEU  52  88.832  12.097  12.520
  405    H    ASP  53           HN       ASP  53  83.658  11.822  13.953
  406    HA   ASP  53           HA       ASP  53  81.997  12.641  15.354
  407    HB2  ASP  53           HB2      ASP  53  83.870  12.043  17.076
  408    HB3  ASP  53           HB1      ASP  53  84.046  13.780  17.212
  409    H    VAL  54           HN       VAL  54  81.676  14.094  13.601
  410    HA   VAL  54           HA       VAL  54  81.615  16.840  14.427
  411    HB   VAL  54           HB       VAL  54  83.957  16.841  13.938
  412   HG11  VAL  54          HG11      VAL  54  84.798  16.074  11.726
  413   HG12  VAL  54          HG12      VAL  54  83.172  15.508  11.339
  414   HG13  VAL  54          HG13      VAL  54  84.066  14.778  12.676
  415   HG21  VAL  54          HG21      VAL  54  84.081  18.492  12.165
  416   HG22  VAL  54          HG22      VAL  54  82.579  18.754  13.049
  417   HG23  VAL  54          HG23      VAL  54  82.551  17.945  11.486
  418    H    LYS  55           HN       LYS  55  80.119  17.950  13.201
  419    HA   LYS  55           HA       LYS  55  78.471  16.402  11.431
  420    HB2  LYS  55           HB2      LYS  55  78.069  18.646  12.924
  421    HB3  LYS  55           HB1      LYS  55  78.216  19.364  11.324
  422    HG2  LYS  55           HG2      LYS  55  75.919  18.881  11.520
  423    HG3  LYS  55           HG1      LYS  55  76.538  17.563  10.558
  424    HD2  LYS  55           HD2      LYS  55  76.816  16.713  13.265
  425    HD3  LYS  55           HD1      LYS  55  75.232  17.458  13.149
  426    HE2  LYS  55           HE2      LYS  55  75.026  15.095  12.675
  427    HE3  LYS  55           HE1      LYS  55  74.709  16.006  11.202
  428    HZ1  LYS  55           HZ1      LYS  55  77.022  15.619  10.544
  429    HZ2  LYS  55           HZ2      LYS  55  76.172  14.162  10.750
  430    HZ3  LYS  55           HZ3      LYS  55  77.266  14.686  11.939
  431    H    LYS  56           HN       LYS  56  81.226  16.525  10.493
  432    HA   LYS  56           HA       LYS  56  81.261  18.381   8.221
  433    HB2  LYS  56           HB2      LYS  56  83.348  17.575   9.363
  434    HB3  LYS  56           HB1      LYS  56  83.047  15.976   8.702
  435    HG2  LYS  56           HG2      LYS  56  82.989  17.150   6.399
  436    HG3  LYS  56           HG1      LYS  56  83.699  18.532   7.226
  437    HD2  LYS  56           HD2      LYS  56  84.854  15.733   7.092
  438    HD3  LYS  56           HD1      LYS  56  85.467  17.154   6.248
  439    HE2  LYS  56           HE2      LYS  56  85.505  16.569   9.207
  440    HE3  LYS  56           HE1      LYS  56  86.855  16.994   8.154
  441    HZ1  LYS  56           HZ1      LYS  56  85.455  19.150   7.814
  442    HZ2  LYS  56           HZ2      LYS  56  86.455  18.979   9.177
  443    HZ3  LYS  56           HZ3      LYS  56  84.781  18.719   9.309
  444    H    ASP  57           HN       ASP  57  80.980  17.816   6.048
  445    HA   ASP  57           HA       ASP  57  78.984  15.864   5.453
  446    HB2  ASP  57           HB2      ASP  57  80.987  17.036   3.503
  447    HB3  ASP  57           HB1      ASP  57  79.370  16.433   3.145
  448    H    TRP  58           HN       TRP  58  79.412  13.712   5.823
  449    HA   TRP  58           HA       TRP  58  82.052  12.606   4.967
  450    HB2  TRP  58           HB2      TRP  58  79.922  11.558   6.841
  451    HB3  TRP  58           HB1      TRP  58  81.374  10.676   6.394
  452    HD1  TRP  58           HD1      TRP  58  80.135  12.837   8.995
  453    HE1  TRP  58           HE1      TRP  58  82.042  13.955  10.315
  454    HE3  TRP  58           HE3      TRP  58  84.074  11.911   5.859
  455    HZ2  TRP  58           HZ2      TRP  58  84.838  14.408  10.081
  456    HZ3  TRP  58           HZ3      TRP  58  86.347  12.699   6.443
  457    HH2  TRP  58           HH2      TRP  58  86.737  13.944   8.551
  458    H    SER  59           HN       SER  59  78.564  12.210   4.597
  459    HA   SER  59           HA       SER  59  78.275   9.814   3.263
  460    HB2  SER  59           HB2      SER  59  76.270  10.980   3.390
  461    HB3  SER  59           HB1      SER  59  77.006  12.497   2.880
  462    HG   SER  59           HG       SER  59  75.787  10.604   1.405
  463    H    ASP  60           HN       ASP  60  79.265  12.865   1.685
  464    HA   ASP  60           HA       ASP  60  79.718  11.783  -0.894
  465    HB2  ASP  60           HB2      ASP  60  79.752  14.175  -0.582
  466    HB3  ASP  60           HB1      ASP  60  81.060  14.056   0.596
  467    H    HIS  61           HN       HIS  61  81.758  11.876   1.992
  468    HA   HIS  61           HA       HIS  61  84.093  10.749   0.713
  469    HB2  HIS  61           HB2      HIS  61  83.365  10.754   3.652
  470    HB3  HIS  61           HB1      HIS  61  84.967  10.525   2.965
  471    HD1  HIS  61           HD1      HIS  61  86.329  12.588   3.127
  472    HD2  HIS  61           HD2      HIS  61  82.300  13.479   2.530
  473    HE1  HIS  61           HE1      HIS  61  86.157  15.113   3.047
  474    H    ALA  62           HN       ALA  62  84.617   8.663   0.412
  475    HA   ALA  62           HA       ALA  62  83.121   6.515   1.809
  476    HB1  ALA  62           HB1      ALA  62  82.949   5.382  -0.538
  477    HB2  ALA  62           HB2      ALA  62  83.137   7.021  -1.166
  478    HB3  ALA  62           HB3      ALA  62  81.770   6.628  -0.125
  479    H    LEU  63           HN       LEU  63  84.231   4.306   1.054
  480    HA   LEU  63           HA       LEU  63  87.154   4.813   1.242
  481    HB2  LEU  63           HB2      LEU  63  85.564   2.250   1.524
  482    HB3  LEU  63           HB1      LEU  63  87.302   2.382   1.733
  483    HG   LEU  63           HG       LEU  63  86.155   2.400   3.878
  484   HD11  LEU  63          HD11      LEU  63  87.096   5.226   3.516
  485   HD12  LEU  63          HD12      LEU  63  88.229   3.891   3.309
  486   HD13  LEU  63          HD13      LEU  63  87.397   4.113   4.846
  487   HD21  LEU  63          HD21      LEU  63  84.077   3.621   2.777
  488   HD22  LEU  63          HD22      LEU  63  84.922   5.078   3.305
  489   HD23  LEU  63          HD23      LEU  63  84.449   3.858   4.483
  490    H    TRP  64           HN       TRP  64  88.620   4.180  -0.298
  491    HA   TRP  64           HA       TRP  64  87.547   2.918  -2.810
  492    HB2  TRP  64           HB2      TRP  64  88.099   4.826  -3.925
  493    HB3  TRP  64           HB1      TRP  64  88.584   5.556  -2.420
  494    HD1  TRP  64           HD1      TRP  64  91.297   4.338  -1.755
  495    HE1  TRP  64           HE1      TRP  64  93.328   4.587  -3.309
  496    HE3  TRP  64           HE3      TRP  64  88.923   5.419  -6.147
  497    HZ2  TRP  64           HZ2      TRP  64  93.886   5.211  -6.042
  498    HZ3  TRP  64           HZ3      TRP  64  90.232   5.861  -8.203
  499    HH2  TRP  64           HH2      TRP  64  92.708   5.760  -8.158
  500    H    TRP  65           HN       TRP  65  89.047   1.506  -3.894
  501    HA   TRP  65           HA       TRP  65  91.259   0.524  -2.127
  502    HB2  TRP  65           HB2      TRP  65  89.295  -1.017  -2.732
  503    HB3  TRP  65           HB1      TRP  65  89.942  -1.016  -4.368
  504    HD1  TRP  65           HD1      TRP  65  92.979  -0.813  -2.542
  505    HE1  TRP  65           HE1      TRP  65  93.993  -3.115  -2.024
  506    HE3  TRP  65           HE3      TRP  65  88.907  -3.785  -3.391
  507    HZ2  TRP  65           HZ2      TRP  65  93.193  -5.862  -1.992
  508    HZ3  TRP  65           HZ3      TRP  65  89.072  -6.240  -3.110
  509    HH2  TRP  65           HH2      TRP  65  91.207  -7.282  -2.410
  510    H    GLU  66           HN       GLU  66  92.928   1.883  -2.963
  511    HA   GLU  66           HA       GLU  66  93.360   2.524  -5.667
  512    HB2  GLU  66           HB2      GLU  66  95.786   2.767  -5.015
  513    HB3  GLU  66           HB1      GLU  66  94.643   3.643  -4.008
  514    HG2  GLU  66           HG2      GLU  66  94.672   1.769  -2.377
  515    HG3  GLU  66           HG1      GLU  66  95.870   0.959  -3.378
  516    H    LYS  67           HN       LYS  67  93.957  -0.539  -4.065
  517    HA   LYS  67           HA       LYS  67  95.838  -1.504  -6.048
  518    HB2  LYS  67           HB2      LYS  67  93.861  -3.201  -4.502
  519    HB3  LYS  67           HB1      LYS  67  95.393  -3.718  -5.194
  520    HG2  LYS  67           HG2      LYS  67  95.056  -1.750  -2.915
  521    HG3  LYS  67           HG1      LYS  67  95.596  -3.418  -2.767
  522    HD2  LYS  67           HD2      LYS  67  97.462  -2.765  -4.424
  523    HD3  LYS  67           HD1      LYS  67  97.014  -1.097  -4.064
  524    HE2  LYS  67           HE2      LYS  67  98.631  -1.428  -2.428
  525    HE3  LYS  67           HE1      LYS  67  97.202  -1.965  -1.540
  526    HZ1  LYS  67           HZ1      LYS  67  99.129  -3.517  -1.466
  527    HZ2  LYS  67           HZ2      LYS  67  98.927  -3.781  -3.133
  528    HZ3  LYS  67           HZ3      LYS  67  97.695  -4.214  -2.046
  529    H    LYS  68           HN       LYS  68  92.653  -0.611  -6.071
  530    HA   LYS  68           HA       LYS  68  92.097  -2.013  -8.641
  531    HB2  LYS  68           HB2      LYS  68  89.874  -1.411  -6.700
  532    HB3  LYS  68           HB1      LYS  68  89.950  -2.643  -7.957
  533    HG2  LYS  68           HG2      LYS  68  91.718  -2.761  -5.491
  534    HG3  LYS  68           HG1      LYS  68  90.112  -3.451  -5.535
  535    HD2  LYS  68           HD2      LYS  68  90.671  -4.992  -7.241
  536    HD3  LYS  68           HD1      LYS  68  92.148  -4.122  -7.648
  537    HE2  LYS  68           HE2      LYS  68  93.317  -4.991  -5.848
  538    HE3  LYS  68           HE1      LYS  68  91.876  -5.182  -4.853
  539    HZ1  LYS  68           HZ1      LYS  68  93.146  -7.106  -6.405
  540    HZ2  LYS  68           HZ2      LYS  68  91.653  -6.791  -7.152
  541    HZ3  LYS  68           HZ3      LYS  68  91.707  -7.268  -5.522
  542    H    ARG  69           HN       ARG  69  92.240   0.875  -6.827
  543    HA   ARG  69           HA       ARG  69  91.543   3.066  -7.288
  544    HB2  ARG  69           HB2      ARG  69  91.779   1.909 -10.086
  545    HB3  ARG  69           HB1      ARG  69  91.355   3.590  -9.797
  546    HG2  ARG  69           HG2      ARG  69  93.667   3.764 -10.035
  547    HG3  ARG  69           HG1      ARG  69  93.538   3.579  -8.289
  548    HD2  ARG  69           HD2      ARG  69  95.216   2.035  -8.940
  549    HD3  ARG  69           HD1      ARG  69  93.768   1.061  -8.710
  550    HE   ARG  69           HE       ARG  69  93.807   0.570 -11.012
  551   HH11  ARG  69          HH11      ARG  69  94.607   0.794 -13.112
  552   HH12  ARG  69          HH12      ARG  69  95.685   2.099 -13.479
  553   HH21  ARG  69          HH21      ARG  69  95.658   3.379 -10.256
  554   HH22  ARG  69          HH22      ARG  69  96.281   3.562 -11.861
  555    H    THR  70           HN       THR  70  89.573   1.370  -6.433
  556    HA   THR  70           HA       THR  70  87.220   1.950  -8.208
  557    HB   THR  70           HB       THR  70  87.878  -0.452  -7.527
  558    HG1  THR  70           HG1      THR  70  85.859   0.020  -8.365
  559   HG21  THR  70          HG21      THR  70  88.192   0.358  -5.069
  560   HG22  THR  70          HG22      THR  70  87.464  -1.221  -5.365
  561   HG23  THR  70          HG23      THR  70  86.442   0.162  -4.968
  562    H    TRP  71           HN       TRP  71  85.208   1.761  -6.510
  563    HA   TRP  71           HA       TRP  71  85.734   3.626  -4.244
  564    HB2  TRP  71           HB2      TRP  71  83.317   4.467  -4.774
  565    HB3  TRP  71           HB1      TRP  71  84.663   5.124  -5.684
  566    HD1  TRP  71           HD1      TRP  71  83.540   1.620  -6.627
  567    HE1  TRP  71           HE1      TRP  71  82.325   1.707  -8.854
  568    HE3  TRP  71           HE3      TRP  71  83.150   6.677  -7.233
  569    HZ2  TRP  71           HZ2      TRP  71  81.323   3.638 -10.714
  570    HZ3  TRP  71           HZ3      TRP  71  82.062   7.610  -9.255
  571    HH2  TRP  71           HH2      TRP  71  81.148   6.098 -10.996
  572    H    LEU  72           HN       LEU  72  85.629   2.080  -2.702
  573    HA   LEU  72           HA       LEU  72  84.000  -0.216  -2.795
  574    HB2  LEU  72           HB2      LEU  72  85.044   1.235  -0.377
  575    HB3  LEU  72           HB1      LEU  72  84.504  -0.435  -0.401
  576    HG   LEU  72           HG       LEU  72  86.675   0.595  -2.224
  577   HD11  LEU  72          HD11      LEU  72  87.600   1.009  -0.108
  578   HD12  LEU  72          HD12      LEU  72  88.220  -0.583  -0.542
  579   HD13  LEU  72          HD13      LEU  72  86.874  -0.438   0.592
  580   HD21  LEU  72          HD21      LEU  72  85.620  -2.117  -1.461
  581   HD22  LEU  72          HD22      LEU  72  87.287  -1.947  -2.002
  582   HD23  LEU  72          HD23      LEU  72  85.966  -1.464  -3.064
  583    H    LEU  73           HN       LEU  73  82.014   0.539  -3.504
  584    HA   LEU  73           HA       LEU  73  80.242   1.681  -1.376
  585    HB2  LEU  73           HB2      LEU  73  78.775   2.467  -3.256
  586    HB3  LEU  73           HB1      LEU  73  80.346   3.258  -3.219
  587    HG   LEU  73           HG       LEU  73  80.938   1.170  -4.884
  588   HD11  LEU  73          HD11      LEU  73  79.162   0.593  -6.323
  589   HD12  LEU  73          HD12      LEU  73  78.145   1.920  -5.760
  590   HD13  LEU  73          HD13      LEU  73  78.418   0.526  -4.727
  591   HD21  LEU  73          HD21      LEU  73  79.587   3.735  -5.785
  592   HD22  LEU  73          HD22      LEU  73  80.688   2.743  -6.739
  593   HD23  LEU  73          HD23      LEU  73  81.278   3.603  -5.322
  594    H    LYS  74           HN       LYS  74  81.218  -1.067  -2.672
  595    HA   LYS  74           HA       LYS  74  78.637  -2.307  -3.312
  596    HB2  LYS  74           HB2      LYS  74  81.510  -3.200  -3.269
  597    HB3  LYS  74           HB1      LYS  74  80.258  -4.431  -3.185
  598    HG2  LYS  74           HG2      LYS  74  80.910  -4.032  -5.518
  599    HG3  LYS  74           HG1      LYS  74  79.238  -3.559  -5.250
  600    HD2  LYS  74           HD2      LYS  74  80.414  -1.863  -6.587
  601    HD3  LYS  74           HD1      LYS  74  79.934  -1.203  -5.028
  602    HE2  LYS  74           HE2      LYS  74  82.370  -0.778  -5.905
  603    HE3  LYS  74           HE1      LYS  74  82.123  -1.184  -4.211
  604    HZ1  LYS  74           HZ1      LYS  74  82.816  -3.363  -4.552
  605    HZ2  LYS  74           HZ2      LYS  74  83.899  -2.453  -5.494
  606    HZ3  LYS  74           HZ3      LYS  74  82.610  -3.278  -6.234
  607    H    THR  75           HN       THR  75  78.199  -1.327  -0.906
  608    HA   THR  75           HA       THR  75  79.069  -2.628   1.414
  609    HB   THR  75           HB       THR  75  76.165  -1.930   0.943
  610    HG1  THR  75           HG1      THR  75  77.329   0.167   1.859
  611   HG21  THR  75          HG21      THR  75  77.745  -1.205   3.380
  612   HG22  THR  75          HG22      THR  75  77.271  -2.894   3.180
  613   HG23  THR  75          HG23      THR  75  76.042  -1.632   3.241
  614    H    HIS  76           HN       HIS  76  77.467  -3.983  -1.242
  615    HA   HIS  76           HA       HIS  76  75.914  -6.028   0.015
  616    HB2  HIS  76           HB2      HIS  76  77.326  -6.082  -2.671
  617    HB3  HIS  76           HB1      HIS  76  76.027  -7.163  -2.167
  618    HD1  HIS  76           HD1      HIS  76  76.546  -4.119  -3.977
  619    HD2  HIS  76           HD2      HIS  76  73.585  -5.487  -1.382
  620    HE1  HIS  76           HE1      HIS  76  74.517  -2.656  -4.372
  621    H    TRP  77           HN       TRP  77  76.459  -8.204   0.422
  622    HA   TRP  77           HA       TRP  77  77.775  -9.907   1.263
  623    HB2  TRP  77           HB2      TRP  77  79.619  -8.894  -0.883
  624    HB3  TRP  77           HB1      TRP  77  79.797 -10.430  -0.053
  625    HD1  TRP  77           HD1      TRP  77  78.421  -9.019  -3.067
  626    HE1  TRP  77           HE1      TRP  77  76.670 -10.564  -4.116
  627    HE3  TRP  77           HE3      TRP  77  77.581 -12.200   0.839
  628    HZ2  TRP  77           HZ2      TRP  77  75.097 -12.851  -3.416
  629    HZ3  TRP  77           HZ3      TRP  77  75.950 -14.053   0.618
  630    HH2  TRP  77           HH2      TRP  77  74.708 -14.382  -1.502
  631    H    THR  78           HN       THR  78  80.914  -9.281   0.824
  632    HA   THR  78           HA       THR  78  81.229  -7.314   3.009
  633    HB   THR  78           HB       THR  78  82.594  -9.778   3.837
  634    HG1  THR  78           HG1      THR  78  81.047 -11.149   3.665
  635   HG21  THR  78          HG21      THR  78  80.714  -7.775   5.053
  636   HG22  THR  78          HG22      THR  78  82.270  -8.371   5.630
  637   HG23  THR  78          HG23      THR  78  80.824  -9.365   5.788
  638    H    LEU  79           HN       LEU  79  83.723  -7.987   3.901
  639    HA   LEU  79           HA       LEU  79  85.488  -6.937   1.851
  640    HB2  LEU  79           HB2      LEU  79  85.964  -8.248   4.535
  641    HB3  LEU  79           HB1      LEU  79  87.278  -7.650   3.541
  642    HG   LEU  79           HG       LEU  79  86.422  -5.377   3.689
  643   HD11  LEU  79          HD11      LEU  79  84.115  -6.722   5.090
  644   HD12  LEU  79          HD12      LEU  79  84.055  -5.672   3.671
  645   HD13  LEU  79          HD13      LEU  79  84.428  -4.997   5.254
  646   HD21  LEU  79          HD21      LEU  79  86.432  -5.145   6.257
  647   HD22  LEU  79          HD22      LEU  79  87.836  -5.930   5.532
  648   HD23  LEU  79          HD23      LEU  79  86.583  -6.905   6.306
  649    H    ASP  80           HN       ASP  80  85.291  -9.994   3.597
  650    HA   ASP  80           HA       ASP  80  87.116 -11.596   2.289
  651    HB2  ASP  80           HB2      ASP  80  85.573 -12.202   4.182
  652    HB3  ASP  80           HB1      ASP  80  84.305 -12.455   2.987
  653    H    LYS  81           HN       LYS  81  83.766 -10.988   1.237
  654    HA   LYS  81           HA       LYS  81  83.863 -12.677  -1.006
  655    HB2  LYS  81           HB2      LYS  81  81.681 -12.106  -0.882
  656    HB3  LYS  81           HB1      LYS  81  82.074 -10.719   0.114
  657    HG2  LYS  81           HG2      LYS  81  82.482 -10.570  -2.870
  658    HG3  LYS  81           HG1      LYS  81  80.878 -10.372  -2.202
  659    HD2  LYS  81           HD2      LYS  81  81.811  -8.614  -0.693
  660    HD3  LYS  81           HD1      LYS  81  83.308  -8.711  -1.565
  661    HE2  LYS  81           HE2      LYS  81  81.873  -8.325  -3.688
  662    HE3  LYS  81           HE1      LYS  81  80.644  -7.770  -2.556
  663    HZ1  LYS  81           HZ1      LYS  81  82.661  -6.263  -3.562
  664    HZ2  LYS  81           HZ2      LYS  81  83.231  -6.672  -2.015
  665    HZ3  LYS  81           HZ3      LYS  81  81.736  -5.885  -2.192
  666    H    TYR  82           HN       TYR  82  85.073  -9.461  -0.516
  667    HA   TYR  82           HA       TYR  82  85.710  -9.127  -3.368
  668    HB2  TYR  82           HB2      TYR  82  85.196  -7.342  -1.368
  669    HB3  TYR  82           HB1      TYR  82  86.949  -7.335  -1.323
  670    HD1  TYR  82           HD1      TYR  82  87.437  -7.881  -4.301
  671    HD2  TYR  82           HD2      TYR  82  84.793  -5.173  -2.269
  672    HE1  TYR  82           HE1      TYR  82  87.461  -6.382  -6.270
  673    HE2  TYR  82           HE2      TYR  82  84.821  -3.672  -4.241
  674    HH   TYR  82           HH       TYR  82  85.247  -3.932  -6.741
  675    H    GLY  83           HN       GLY  83  87.476  -9.637  -0.308
  676    HA2  GLY  83           HA2      GLY  83  89.331 -11.331  -0.370
  677    HA3  GLY  83           HA1      GLY  83  89.823 -10.637  -1.916
  678    H    ILE  84           HN       ILE  84  88.667  -8.370   0.320
  679    HA   ILE  84           HA       ILE  84  91.222  -7.027   0.486
  680    HB   ILE  84           HB       ILE  84  88.611  -6.596   1.951
  681   HG12  ILE  84          HG12      ILE  84  89.709  -4.830  -0.236
  682   HG13  ILE  84          HG11      ILE  84  88.885  -6.328  -0.666
  683   HG21  ILE  84          HG21      ILE  84  89.619  -4.266   2.275
  684   HG22  ILE  84          HG22      ILE  84  91.172  -4.993   1.849
  685   HG23  ILE  84          HG23      ILE  84  90.286  -5.559   3.267
  686   HD11  ILE  84          HD11      ILE  84  86.855  -5.639   0.333
  687   HD12  ILE  84          HD12      ILE  84  87.444  -4.194  -0.492
  688   HD13  ILE  84          HD13      ILE  84  87.647  -4.357   1.252
  689    H    GLN  85           HN       GLN  85  92.268  -6.486   2.567
  690    HA   GLN  85           HA       GLN  85  91.715  -7.961   4.967
  691    HB2  GLN  85           HB2      GLN  85  92.877  -9.607   3.151
  692    HB3  GLN  85           HB1      GLN  85  94.329  -8.869   3.815
  693    HG2  GLN  85           HG2      GLN  85  94.090 -10.645   5.296
  694    HG3  GLN  85           HG1      GLN  85  93.146  -9.422   6.143
  695   HE21  GLN  85          HE21      GLN  85  90.794  -9.416   4.611
  696   HE22  GLN  85          HE22      GLN  85  90.033 -10.919   4.746
  697    H    ALA  86           HN       ALA  86  94.109  -7.911   6.222
  698    HA   ALA  86           HA       ALA  86  94.581  -5.108   6.604
  699    HB1  ALA  86           HB1      ALA  86  95.851  -7.644   7.581
  700    HB2  ALA  86           HB2      ALA  86  95.001  -6.409   8.510
  701    HB3  ALA  86           HB3      ALA  86  96.634  -6.100   7.921
  702    H    ASP  87           HN       ASP  87  95.922  -7.423   4.430
  703    HA   ASP  87           HA       ASP  87  98.409  -5.935   4.018
  704    HB2  ASP  87           HB2      ASP  87  98.789  -7.519   2.192
  705    HB3  ASP  87           HB1      ASP  87  98.244  -8.396   3.623
  706    H    ALA  88           HN       ALA  88  95.157  -5.863   2.934
  707    HA   ALA  88           HA       ALA  88  95.827  -4.087   0.622
  708    HB1  ALA  88           HB1      ALA  88  93.380  -5.648   1.448
  709    HB2  ALA  88           HB2      ALA  88  94.347  -5.847  -0.007
  710    HB3  ALA  88           HB3      ALA  88  93.324  -4.420   0.181
  711    H    LYS  89           HN       LYS  89  95.905  -1.920   1.339
  712    HA   LYS  89           HA       LYS  89  94.093  -1.178   3.557
  713    HB2  LYS  89           HB2      LYS  89  95.365   0.978   3.493
  714    HB3  LYS  89           HB1      LYS  89  96.276  -0.444   3.994
  715    HG2  LYS  89           HG2      LYS  89  97.081  -0.653   1.651
  716    HG3  LYS  89           HG1      LYS  89  96.276   0.861   1.290
  717    HD2  LYS  89           HD2      LYS  89  98.381   1.675   1.827
  718    HD3  LYS  89           HD1      LYS  89  97.586   1.720   3.403
  719    HE2  LYS  89           HE2      LYS  89  99.480   0.559   4.035
  720    HE3  LYS  89           HE1      LYS  89  98.532  -0.815   3.464
  721    HZ1  LYS  89           HZ1      LYS  89  99.964   0.566   1.383
  722    HZ2  LYS  89           HZ2      LYS  89  99.857  -1.097   1.711
  723    HZ3  LYS  89           HZ3      LYS  89 100.974  -0.132   2.552
  724    H    LEU  90           HN       LEU  90  93.271   1.143   3.342
  725    HA   LEU  90           HA       LEU  90  92.274   1.700   0.588
  726    HB2  LEU  90           HB2      LEU  90  90.318   2.009   2.841
  727    HB3  LEU  90           HB1      LEU  90  90.025   1.622   1.148
  728    HG   LEU  90           HG       LEU  90  91.263  -0.267   3.154
  729   HD11  LEU  90          HD11      LEU  90  88.978  -1.431   2.844
  730   HD12  LEU  90          HD12      LEU  90  88.427   0.131   2.241
  731   HD13  LEU  90          HD13      LEU  90  89.050  -0.009   3.884
  732   HD21  LEU  90          HD21      LEU  90  91.706  -1.644   1.394
  733   HD22  LEU  90          HD22      LEU  90  91.206  -0.356   0.292
  734   HD23  LEU  90          HD23      LEU  90  90.033  -1.543   0.846
  735    H    GLN  91           HN       GLN  91  90.898   3.831   0.817
  736    HA   GLN  91           HA       GLN  91  92.311   5.785   2.575
  737    HB2  GLN  91           HB2      GLN  91  91.397   6.349  -0.267
  738    HB3  GLN  91           HB1      GLN  91  92.381   7.387   0.761
  739    HG2  GLN  91           HG2      GLN  91  94.319   6.141   0.404
  740    HG3  GLN  91           HG1      GLN  91  93.443   4.656   0.088
  741   HE21  GLN  91          HE21      GLN  91  92.154   7.369  -1.542
  742   HE22  GLN  91          HE22      GLN  91  92.804   7.030  -3.065
  743    H    PHE  92           HN       PHE  92  90.828   7.831   2.713
  744    HA   PHE  92           HA       PHE  92  87.958   7.090   2.338
  745    HB2  PHE  92           HB2      PHE  92  88.496   6.703   4.684
  746    HB3  PHE  92           HB1      PHE  92  89.198   8.300   4.828
  747    HD1  PHE  92           HD1      PHE  92  87.839   9.423   6.372
  748    HD2  PHE  92           HD2      PHE  92  85.946   7.226   3.192
  749    HE1  PHE  92           HE1      PHE  92  85.634  10.290   7.071
  750    HE2  PHE  92           HE2      PHE  92  83.755   8.108   3.892
  751    HZ   PHE  92           HZ       PHE  92  83.590   9.635   5.831
  752    H    THR  93           HN       THR  93  87.601   8.392   0.642
  753    HA   THR  93           HA       THR  93  87.728  11.319   1.108
  754    HB   THR  93           HB       THR  93  89.874  11.130   0.190
  755    HG1  THR  93           HG1      THR  93  89.458  11.393  -2.232
  756   HG21  THR  93          HG21      THR  93  90.363   9.531  -1.710
  757   HG22  THR  93          HG22      THR  93  88.737   8.884  -1.494
  758   HG23  THR  93          HG23      THR  93  89.919   8.747  -0.194
  759    HA   PRO  94           HA       PRO  94  83.996  11.862  -1.273
  760    HB2  PRO  94           HB2      PRO  94  85.863  13.187  -3.228
  761    HB3  PRO  94           HB1      PRO  94  84.244  13.700  -2.705
  762    HG2  PRO  94           HG2      PRO  94  86.491  14.757  -1.655
  763    HG3  PRO  94           HG1      PRO  94  85.008  14.547  -0.708
  764    HD2  PRO  94           HD2      PRO  94  87.567  13.139  -0.409
  765    HD3  PRO  94           HD1      PRO  94  86.166  13.130   0.677
  766    H    TYR 541           HT1      TYR 541  49.217  32.806  15.078
  767    HA   TYR 541           HA       TYR 541  48.258  34.468  16.207
  768    HB2  TYR 541           HB2      TYR 541  51.219  35.060  16.356
  769    HB3  TYR 541           HB1      TYR 541  50.048  35.987  17.293
  770    HD1  TYR 541           HD1      TYR 541  48.585  34.832  18.962
  771    HD2  TYR 541           HD2      TYR 541  51.804  32.812  16.958
  772    HE1  TYR 541           HE1      TYR 541  48.515  33.031  20.666
  773    HE2  TYR 541           HE2      TYR 541  51.733  31.011  18.663
  774    HH   TYR 541           HH       TYR 541  50.951  30.502  20.767
  775    H    HIS 542           HN       HIS 542  50.881  36.453  14.826
  776    HA   HIS 542           HA       HIS 542  49.020  38.605  14.249
  777    HB2  HIS 542           HB2      HIS 542  51.961  38.135  13.746
  778    HB3  HIS 542           HB1      HIS 542  51.140  39.545  13.089
  779    HD1  HIS 542           HD1      HIS 542  49.532  38.746  16.185
  780    HD2  HIS 542           HD2      HIS 542  53.046  40.740  15.161
  781    HE1  HIS 542           HE1      HIS 542  50.187  40.127  18.205
  782    H    GLU 543           HN       GLU 543  51.398  37.436  11.906
  783    HA   GLU 543           HA       GLU 543  49.194  36.901   9.944
  784    HB2  GLU 543           HB2      GLU 543  50.712  37.997   8.222
  785    HB3  GLU 543           HB1      GLU 543  49.974  39.103   9.382
  786    HG2  GLU 543           HG2      GLU 543  51.982  39.323  10.625
  787    HG3  GLU 543           HG1      GLU 543  52.705  37.902   9.870
  788    H    ARG 544           HN       ARG 544  51.782  35.676  11.559
  789    HA   ARG 544           HA       ARG 544  53.563  34.433   9.913
  790    HB2  ARG 544           HB2      ARG 544  52.023  33.258  12.231
  791    HB3  ARG 544           HB1      ARG 544  53.311  32.376  11.425
  792    HG2  ARG 544           HG2      ARG 544  54.275  33.532  13.319
  793    HG3  ARG 544           HG1      ARG 544  54.845  34.308  11.851
  794    HD2  ARG 544           HD2      ARG 544  53.470  36.175  12.139
  795    HD3  ARG 544           HD1      ARG 544  52.357  35.328  13.201
  796    HE   ARG 544           HE       ARG 544  54.693  36.848  13.967
  797   HH11  ARG 544          HH11      ARG 544  55.649  36.646  15.984
  798   HH12  ARG 544          HH12      ARG 544  55.237  35.300  16.994
  799   HH21  ARG 544          HH21      ARG 544  53.005  33.933  14.728
  800   HH22  ARG 544          HH22      ARG 544  53.746  33.769  16.285
  801    H    ARG 545           HN       ARG 545  53.564  32.892   8.305
  802    HA   ARG 545           HA       ARG 545  50.918  31.705   7.538
  803    HB2  ARG 545           HB2      ARG 545  52.297  31.531   5.254
  804    HB3  ARG 545           HB1      ARG 545  51.460  33.014   5.698
  805    HG2  ARG 545           HG2      ARG 545  54.287  32.650   6.662
  806    HG3  ARG 545           HG1      ARG 545  54.037  33.035   4.967
  807    HD2  ARG 545           HD2      ARG 545  52.603  34.666   7.037
  808    HD3  ARG 545           HD1      ARG 545  54.311  34.976   6.734
  809    HE   ARG 545           HE       ARG 545  53.190  34.940   4.202
  810   HH11  ARG 545          HH11      ARG 545  52.390  36.803   3.204
  811   HH12  ARG 545          HH12      ARG 545  51.853  38.130   4.180
  812   HH21  ARG 545          HH21      ARG 545  52.575  36.558   7.184
  813   HH22  ARG 545          HH22      ARG 545  51.958  37.991   6.432
  814    H    GLY 546           HN       GLY 546  54.424  31.056   7.370
  815    HA2  GLY 546           HA2      GLY 546  54.271  28.363   6.587
  816    HA3  GLY 546           HA1      GLY 546  55.608  29.046   7.504
  817    H    SER 547           HN       SER 547  55.960  28.119   9.402
  818    HA   SER 547           HA       SER 547  53.884  27.422  11.297
  819    HB2  SER 547           HB2      SER 547  55.084  25.318   9.520
  820    HB3  SER 547           HB1      SER 547  54.780  24.905  11.206
  821    HG   SER 547           HG       SER 547  52.700  24.952  10.831
  822    H    LEU 548           HN       LEU 548  54.968  27.922  13.176
  823    HA   LEU 548           HA       LEU 548  57.726  28.409  13.258
  824    HB2  LEU 548           HB2      LEU 548  55.568  28.131  15.262
  825    HB3  LEU 548           HB1      LEU 548  57.185  27.849  15.896
  826    HG   LEU 548           HG       LEU 548  57.874  30.048  14.794
  827   HD11  LEU 548          HD11      LEU 548  56.190  30.408  13.183
  828   HD12  LEU 548          HD12      LEU 548  55.861  31.604  14.431
  829   HD13  LEU 548          HD13      LEU 548  54.895  30.134  14.344
  830   HD21  LEU 548          HD21      LEU 548  57.198  29.719  17.248
  831   HD22  LEU 548          HD22      LEU 548  55.654  30.437  16.789
  832   HD23  LEU 548          HD23      LEU 548  57.148  31.360  16.605
  833    H    CYS 549           HN       CYS 549  59.524  27.220  13.609
  834    HA   CYS 549           HA       CYS 549  59.221  24.288  13.661
  835    HB2  CYS 549           HB2      CYS 549  60.986  24.971  12.249
  836    HB3  CYS 549           HB1      CYS 549  61.492  26.243  13.345
  837    H    SER 550           HN       SER 550  58.603  23.657  15.641
  838    HA   SER 550           HA       SER 550  58.982  24.896  18.089
  839    HB2  SER 550           HB2      SER 550  57.499  23.109  18.123
  840    HB3  SER 550           HB1      SER 550  58.634  22.020  17.328
  841    HG   SER 550           HG       SER 550  58.295  21.817  19.711
  842    H    GLY 551           HN       GLY 551  60.641  25.332  19.284
  843    HA2  GLY 551           HA2      GLY 551  62.715  24.633  20.455
  844    HA3  GLY 551           HA1      GLY 551  63.182  23.768  18.984
  845    H    CYS 552           HN       CYS 552  62.229  25.726  17.188
  846    HA   CYS 552           HA       CYS 552  64.346  27.811  17.460
  847    HB2  CYS 552           HB2      CYS 552  62.861  26.510  15.186
  848    HB3  CYS 552           HB1      CYS 552  63.585  28.093  14.957
  849    H    GLN 553           HN       GLN 553  60.944  27.164  16.906
  850    HA   GLN 553           HA       GLN 553  59.096  28.506  16.883
  851    HB2  GLN 553           HB2      GLN 553  60.767  30.096  18.808
  852    HB3  GLN 553           HB1      GLN 553  59.049  30.379  18.509
  853    HG2  GLN 553           HG2      GLN 553  60.196  27.718  19.358
  854    HG3  GLN 553           HG1      GLN 553  59.494  28.872  20.472
  855   HE21  GLN 553          HE21      GLN 553  58.760  26.731  17.749
  856   HE22  GLN 553          HE22      GLN 553  57.088  26.639  18.034
  857    H    LYS 554           HN       LYS 554  60.231  28.739  14.725
  858    HA   LYS 554           HA       LYS 554  59.982  31.583  13.945
  859    HB2  LYS 554           HB2      LYS 554  62.224  29.752  13.047
  860    HB3  LYS 554           HB1      LYS 554  61.896  31.335  12.354
  861    HG2  LYS 554           HG2      LYS 554  62.516  30.855  15.279
  862    HG3  LYS 554           HG1      LYS 554  63.714  31.347  14.088
  863    HD2  LYS 554           HD2      LYS 554  62.019  33.301  13.591
  864    HD3  LYS 554           HD1      LYS 554  61.380  32.901  15.185
  865    HE2  LYS 554           HE2      LYS 554  63.580  33.243  16.193
  866    HE3  LYS 554           HE1      LYS 554  64.282  33.559  14.606
  867    HZ1  LYS 554           HZ1      LYS 554  63.750  35.601  15.819
  868    HZ2  LYS 554           HZ2      LYS 554  62.111  35.154  15.856
  869    HZ3  LYS 554           HZ3      LYS 554  62.873  35.479  14.373
  870    HA   PRO 555           HA       PRO 555  57.013  29.412  11.292
  871    HB2  PRO 555           HB2      PRO 555  57.703  31.556   9.356
  872    HB3  PRO 555           HB1      PRO 555  56.113  31.005   9.900
  873    HG2  PRO 555           HG2      PRO 555  57.277  33.314  10.803
  874    HG3  PRO 555           HG1      PRO 555  56.144  32.367  11.773
  875    HD2  PRO 555           HD2      PRO 555  59.052  32.724  12.168
  876    HD3  PRO 555           HD1      PRO 555  57.841  32.088  13.307
  877    H    ILE 556           HN       ILE 556  57.238  27.774   9.952
  878    HA   ILE 556           HA       ILE 556  59.783  27.364   8.489
  879    HB   ILE 556           HB       ILE 556  57.388  25.590   9.085
  880   HG12  ILE 556          HG12      ILE 556  60.224  25.108   9.985
  881   HG13  ILE 556          HG11      ILE 556  59.242  26.254  10.872
  882   HG21  ILE 556          HG21      ILE 556  59.890  25.087   7.477
  883   HG22  ILE 556          HG22      ILE 556  58.212  24.858   6.984
  884   HG23  ILE 556          HG23      ILE 556  58.933  23.790   8.185
  885   HD11  ILE 556          HD11      ILE 556  59.282  23.593  11.423
  886   HD12  ILE 556          HD12      ILE 556  57.936  23.636  10.288
  887   HD13  ILE 556          HD13      ILE 556  57.889  24.617  11.752
  888    H    THR 557           HN       THR 557  59.581  28.666   6.633
  889    HA   THR 557           HA       THR 557  57.069  28.495   5.048
  890    HB   THR 557           HB       THR 557  57.745  30.497   4.020
  891    HG1  THR 557           HG1      THR 557  59.773  30.218   3.378
  892   HG21  THR 557          HG21      THR 557  58.186  31.947   5.876
  893   HG22  THR 557          HG22      THR 557  59.007  30.661   6.761
  894   HG23  THR 557          HG23      THR 557  57.262  30.586   6.518
  895    H    GLY 558           HN       GLY 558  57.275  26.485   4.089
  896    HA2  GLY 558           HA2      GLY 558  58.177  26.151   1.558
  897    HA3  GLY 558           HA1      GLY 558  59.634  25.784   2.492
  898    H    ARG 559           HN       ARG 559  59.720  23.913   3.672
  899    HA   ARG 559           HA       ARG 559  57.410  22.021   3.461
  900    HB2  ARG 559           HB2      ARG 559  60.399  21.657   3.280
  901    HB3  ARG 559           HB1      ARG 559  59.414  20.329   3.893
  902    HG2  ARG 559           HG2      ARG 559  58.629  21.711   1.332
  903    HG3  ARG 559           HG1      ARG 559  59.909  20.502   1.308
  904    HD2  ARG 559           HD2      ARG 559  58.463  18.763   1.876
  905    HD3  ARG 559           HD1      ARG 559  57.325  19.832   2.692
  906    HE   ARG 559           HE       ARG 559  57.195  20.621   0.037
  907   HH11  ARG 559          HH11      ARG 559  55.721  19.715  -1.418
  908   HH12  ARG 559          HH12      ARG 559  55.107  18.122  -1.129
  909   HH21  ARG 559          HH21      ARG 559  56.905  17.674   1.802
  910   HH22  ARG 559          HH22      ARG 559  55.777  16.966   0.695
  911    H    CYS 560           HN       CYS 560  57.022  20.770   5.418
  912    HA   CYS 560           HA       CYS 560  58.537  21.631   7.813
  913    HB2  CYS 560           HB2      CYS 560  56.469  22.119   9.064
  914    HB3  CYS 560           HB1      CYS 560  56.705  23.231   7.713
  915    HG   CYS 560           HG       CYS 560  54.791  20.769   7.434
  916    H    ILE 561           HN       ILE 561  59.002  20.028   9.047
  917    HA   ILE 561           HA       ILE 561  57.650  17.431   8.678
  918    HB   ILE 561           HB       ILE 561  60.026  18.290  10.356
  919   HG12  ILE 561          HG12      ILE 561  59.734  16.851   7.725
  920   HG13  ILE 561          HG11      ILE 561  60.378  18.469   7.952
  921   HG21  ILE 561          HG21      ILE 561  59.144  15.476   9.657
  922   HG22  ILE 561          HG22      ILE 561  58.784  16.238  11.214
  923   HG23  ILE 561          HG23      ILE 561  60.458  15.954  10.732
  924   HD11  ILE 561          HD11      ILE 561  61.583  15.863   8.905
  925   HD12  ILE 561          HD12      ILE 561  62.144  17.450   9.440
  926   HD13  ILE 561          HD13      ILE 561  62.265  17.000   7.738
  927    H    THR 562           HN       THR 562  56.560  16.461  10.318
  928    HA   THR 562           HA       THR 562  55.911  18.129  12.720
  929    HB   THR 562           HB       THR 562  53.983  16.183  11.470
  930    HG1  THR 562           HG1      THR 562  54.331  17.781   9.955
  931   HG21  THR 562          HG21      THR 562  53.769  16.910  13.880
  932   HG22  THR 562          HG22      THR 562  52.375  17.288  12.866
  933   HG23  THR 562          HG23      THR 562  53.531  18.553  13.283
  934    H    ALA 563           HN       ALA 563  55.720  17.095  14.619
  935    HA   ALA 563           HA       ALA 563  56.623  14.246  14.715
  936    HB1  ALA 563           HB1      ALA 563  57.921  14.803  16.654
  937    HB2  ALA 563           HB2      ALA 563  57.202  16.414  16.735
  938    HB3  ALA 563           HB3      ALA 563  58.301  16.006  15.413
  939    H    MET 564           HN       MET 564  56.239  15.069  17.747
  940    HA   MET 564           HA       MET 564  53.755  13.695  18.123
  941    HB2  MET 564           HB2      MET 564  54.922  15.596  20.142
  942    HB3  MET 564           HB1      MET 564  54.146  14.032  20.407
  943    HG2  MET 564           HG2      MET 564  56.142  13.035  19.099
  944    HG3  MET 564           HG1      MET 564  56.911  14.600  19.351
  945    HE1  MET 564           HE1      MET 564  56.837  11.098  20.813
  946    HE2  MET 564           HE2      MET 564  58.213  11.630  21.776
  947    HE3  MET 564           HE3      MET 564  58.115  12.073  20.073
  948    H    ALA 565           HN       ALA 565  53.815  16.095  16.430
  949    HA   ALA 565           HA       ALA 565  51.859  17.412  15.851
  950    HB1  ALA 565           HB1      ALA 565  51.724  18.187  18.779
  951    HB2  ALA 565           HB2      ALA 565  50.727  16.902  18.083
  952    HB3  ALA 565           HB3      ALA 565  50.560  18.558  17.511
  953    H    LYS 566           HN       LYS 566  54.782  17.716  17.406
  954    HA   LYS 566           HA       LYS 566  54.969  20.643  17.308
  955    HB2  LYS 566           HB2      LYS 566  57.169  18.579  17.602
  956    HB3  LYS 566           HB1      LYS 566  57.260  20.280  18.018
  957    HG2  LYS 566           HG2      LYS 566  55.336  18.327  19.311
  958    HG3  LYS 566           HG1      LYS 566  56.898  18.756  19.988
  959    HD2  LYS 566           HD2      LYS 566  55.764  20.427  21.072
  960    HD3  LYS 566           HD1      LYS 566  55.809  21.266  19.525
  961    HE2  LYS 566           HE2      LYS 566  53.528  21.329  20.031
  962    HE3  LYS 566           HE1      LYS 566  53.615  19.874  19.041
  963    HZ1  LYS 566           HZ1      LYS 566  53.804  18.559  21.065
  964    HZ2  LYS 566           HZ2      LYS 566  52.369  19.468  21.055
  965    HZ3  LYS 566           HZ3      LYS 566  53.686  19.965  22.007
  966    H    LYS 567           HN       LYS 567  56.194  21.799  15.730
  967    HA   LYS 567           HA       LYS 567  56.481  20.360  13.142
  968    HB2  LYS 567           HB2      LYS 567  56.976  23.294  13.457
  969    HB3  LYS 567           HB1      LYS 567  56.269  22.435  12.103
  970    HG2  LYS 567           HG2      LYS 567  54.952  22.947  14.793
  971    HG3  LYS 567           HG1      LYS 567  54.544  23.728  13.273
  972    HD2  LYS 567           HD2      LYS 567  54.298  20.723  13.746
  973    HD3  LYS 567           HD1      LYS 567  52.971  21.873  13.898
  974    HE2  LYS 567           HE2      LYS 567  53.512  22.607  11.505
  975    HE3  LYS 567           HE1      LYS 567  54.518  21.164  11.407
  976    HZ1  LYS 567           HZ1      LYS 567  52.217  20.231  12.468
  977    HZ2  LYS 567           HZ2      LYS 567  52.646  20.138  10.827
  978    HZ3  LYS 567           HZ3      LYS 567  51.657  21.404  11.379
  979    H    PHE 568           HN       PHE 568  58.524  21.229  11.820
  980    HA   PHE 568           HA       PHE 568  60.833  21.821  13.529
  981    HB2  PHE 568           HB2      PHE 568  60.132  19.056  12.910
  982    HB3  PHE 568           HB1      PHE 568  61.701  19.423  12.227
  983    HD1  PHE 568           HD1      PHE 568  59.905  18.572  15.213
  984    HD2  PHE 568           HD2      PHE 568  63.426  20.581  13.790
  985    HE1  PHE 568           HE1      PHE 568  60.928  18.371  17.462
  986    HE2  PHE 568           HE2      PHE 568  64.449  20.378  16.041
  987    HZ   PHE 568           HZ       PHE 568  63.200  19.273  17.876
  988    H    HIS 569           HN       HIS 569  62.416  22.776  12.336
  989    HA   HIS 569           HA       HIS 569  61.971  23.558   9.647
  990    HB2  HIS 569           HB2      HIS 569  64.364  23.412  11.430
  991    HB3  HIS 569           HB1      HIS 569  64.629  23.739   9.730
  992    HD2  HIS 569           HD2      HIS 569  62.765  26.076   8.926
  993    HE1  HIS 569           HE1      HIS 569  63.506  27.864  12.672
  994    HA   PRO 570           HA       PRO 570  62.536  19.302   8.063
  995    HB2  PRO 570           HB2      PRO 570  63.170  20.775   5.538
  996    HB3  PRO 570           HB1      PRO 570  62.022  19.454   5.811
  997    HG2  PRO 570           HG2      PRO 570  61.227  22.045   5.487
  998    HG3  PRO 570           HG1      PRO 570  60.328  20.883   6.467
  999    HD2  PRO 570           HD2      PRO 570  61.943  23.202   7.359
 1000    HD3  PRO 570           HD1      PRO 570  60.674  22.308   8.231
 1001    H    GLU 571           HN       GLU 571  64.774  21.870   8.266
 1002    HA   GLU 571           HA       GLU 571  67.078  20.277   7.306
 1003    HB2  GLU 571           HB2      GLU 571  67.244  23.063   8.431
 1004    HB3  GLU 571           HB1      GLU 571  68.264  22.292   7.217
 1005    HG2  GLU 571           HG2      GLU 571  66.212  22.190   5.729
 1006    HG3  GLU 571           HG1      GLU 571  65.416  23.232   6.914
 1007    H    HIS 572           HN       HIS 572  66.136  22.166  10.169
 1008    HA   HIS 572           HA       HIS 572  68.305  21.317  11.803
 1009    HB2  HIS 572           HB2      HIS 572  65.519  22.037  12.769
 1010    HB3  HIS 572           HB1      HIS 572  67.018  22.152  13.690
 1011    HD2  HIS 572           HD2      HIS 572  68.580  23.395  10.824
 1012    HE1  HIS 572           HE1      HIS 572  66.248  26.778  11.740
 1013    H    PHE 573           HN       PHE 573  65.943  19.419  10.473
 1014    HA   PHE 573           HA       PHE 573  66.423  17.280  12.524
 1015    HB2  PHE 573           HB2      PHE 573  64.015  18.305  12.391
 1016    HB3  PHE 573           HB1      PHE 573  63.902  17.407  10.883
 1017    HD1  PHE 573           HD1      PHE 573  64.901  16.948  14.463
 1018    HD2  PHE 573           HD2      PHE 573  63.232  15.155  10.934
 1019    HE1  PHE 573           HE1      PHE 573  64.436  14.872  15.737
 1020    HE2  PHE 573           HE2      PHE 573  62.766  13.080  12.209
 1021    HZ   PHE 573           HZ       PHE 573  63.368  12.938  14.610
 1022    H    VAL 574           HN       VAL 574  68.192  17.402  10.646
 1023    HA   VAL 574           HA       VAL 574  67.394  15.950   8.218
 1024    HB   VAL 574           HB       VAL 574  69.812  16.272   7.613
 1025   HG11  VAL 574          HG11      VAL 574  69.299  19.022   7.951
 1026   HG12  VAL 574          HG12      VAL 574  67.703  18.272   7.908
 1027   HG13  VAL 574          HG13      VAL 574  68.825  18.034   6.589
 1028   HG21  VAL 574          HG21      VAL 574  71.164  17.734   9.019
 1029   HG22  VAL 574          HG22      VAL 574  70.590  16.390  10.006
 1030   HG23  VAL 574          HG23      VAL 574  69.816  17.979  10.134
 1031    H    CYS 575           HN       CYS 575  69.172  14.258   7.507
 1032    HA   CYS 575           HA       CYS 575  69.233  12.084   9.476
 1033    HB2  CYS 575           HB2      CYS 575  69.166  10.953   7.502
 1034    HB3  CYS 575           HB1      CYS 575  69.591  12.408   6.612
 1035    H    ALA 576           HN       ALA 576  71.198  11.236  10.507
 1036    HA   ALA 576           HA       ALA 576  73.339  13.338  10.542
 1037    HB1  ALA 576           HB1      ALA 576  72.646  10.973  12.295
 1038    HB2  ALA 576           HB2      ALA 576  72.779  12.676  12.732
 1039    HB3  ALA 576           HB3      ALA 576  74.235  11.737  12.400
 1040    H    PHE 577           HN       PHE 577  73.820  12.674   8.313
 1041    HA   PHE 577           HA       PHE 577  76.260  11.120   8.259
 1042    HB2  PHE 577           HB2      PHE 577  74.309   9.476   7.498
 1043    HB3  PHE 577           HB1      PHE 577  74.334  10.422   6.020
 1044    HD1  PHE 577           HD1      PHE 577  75.052   7.431   6.229
 1045    HD2  PHE 577           HD2      PHE 577  77.544  10.956   6.391
 1046    HE1  PHE 577           HE1      PHE 577  76.996   6.131   5.447
 1047    HE2  PHE 577           HE2      PHE 577  79.449   9.626   5.614
 1048    HZ   PHE 577           HZ       PHE 577  79.188   7.221   5.143
 1049    H    CYS 578           HN       CYS 578  73.774  12.267   6.125
 1050    HA   CYS 578           HA       CYS 578  75.518  14.401   4.978
 1051    HB2  CYS 578           HB2      CYS 578  73.972  14.293   3.036
 1052    HB3  CYS 578           HB1      CYS 578  74.722  12.729   3.317
 1053    H    LEU 579           HN       LEU 579  74.953  15.625   6.849
 1054    HA   LEU 579           HA       LEU 579  72.474  16.117   7.944
 1055    HB2  LEU 579           HB2      LEU 579  73.741  18.554   8.295
 1056    HB3  LEU 579           HB1      LEU 579  73.970  17.148   9.309
 1057    HG   LEU 579           HG       LEU 579  76.068  18.322   8.409
 1058   HD11  LEU 579          HD11      LEU 579  76.420  15.512   7.539
 1059   HD12  LEU 579          HD12      LEU 579  75.701  15.704   9.134
 1060   HD13  LEU 579          HD13      LEU 579  77.256  16.435   8.772
 1061   HD21  LEU 579          HD21      LEU 579  74.864  18.094   5.943
 1062   HD22  LEU 579          HD22      LEU 579  76.016  16.761   5.903
 1063   HD23  LEU 579          HD23      LEU 579  76.574  18.400   6.215
 1064    H    LYS 580           HN       LYS 580  72.616  16.545   4.727
 1065    HA   LYS 580           HA       LYS 580  71.602  19.330   4.710
 1066    HB2  LYS 580           HB2      LYS 580  71.943  19.336   2.438
 1067    HB3  LYS 580           HB1      LYS 580  73.060  18.060   2.886
 1068    HG2  LYS 580           HG2      LYS 580  70.215  17.548   1.921
 1069    HG3  LYS 580           HG1      LYS 580  71.634  17.529   0.890
 1070    HD2  LYS 580           HD2      LYS 580  72.519  15.619   1.875
 1071    HD3  LYS 580           HD1      LYS 580  71.617  15.839   3.372
 1072    HE2  LYS 580           HE2      LYS 580  70.843  13.988   1.705
 1073    HE3  LYS 580           HE1      LYS 580  69.632  15.032   2.447
 1074    HZ1  LYS 580           HZ1      LYS 580  69.175  16.032   0.509
 1075    HZ2  LYS 580           HZ2      LYS 580  69.855  14.638  -0.184
 1076    HZ3  LYS 580           HZ3      LYS 580  70.792  16.043  -0.002
 1077    H    GLN 581           HN       GLN 581  70.060  16.060   4.272
 1078    HA   GLN 581           HA       GLN 581  67.563  17.392   4.955
 1079    HB2  GLN 581           HB2      GLN 581  67.839  17.897   2.541
 1080    HB3  GLN 581           HB1      GLN 581  67.622  16.180   2.214
 1081    HG2  GLN 581           HG2      GLN 581  65.453  17.142   2.010
 1082    HG3  GLN 581           HG1      GLN 581  65.450  16.376   3.585
 1083   HE21  GLN 581          HE21      GLN 581  65.899  17.849   5.485
 1084   HE22  GLN 581          HE22      GLN 581  65.427  19.468   5.362
 1085    H    LEU 582           HN       LEU 582  66.021  16.193   5.743
 1086    HA   LEU 582           HA       LEU 582  65.992  13.265   5.322
 1087    HB2  LEU 582           HB2      LEU 582  67.183  13.925   7.470
 1088    HB3  LEU 582           HB1      LEU 582  65.632  14.506   8.050
 1089    HG   LEU 582           HG       LEU 582  64.697  12.236   7.728
 1090   HD11  LEU 582          HD11      LEU 582  65.805  11.002   6.158
 1091   HD12  LEU 582          HD12      LEU 582  66.805  10.497   7.516
 1092   HD13  LEU 582          HD13      LEU 582  67.347  11.800   6.454
 1093   HD21  LEU 582          HD21      LEU 582  66.320  11.138   9.500
 1094   HD22  LEU 582          HD22      LEU 582  65.374  12.563   9.926
 1095   HD23  LEU 582          HD23      LEU 582  67.070  12.733   9.503
 1096    H    ASN 583           HN       ASN 583  63.814  12.395   6.188
 1097    HA   ASN 583           HA       ASN 583  61.659  14.424   6.337
 1098    HB2  ASN 583           HB2      ASN 583  62.069  12.524   4.029
 1099    HB3  ASN 583           HB1      ASN 583  60.431  12.964   4.499
 1100   HD21  ASN 583          HD21      ASN 583  61.224  13.752   2.002
 1101   HD22  ASN 583          HD22      ASN 583  61.517  15.418   1.964
 1102    H    LYS 584           HN       LYS 584  60.068  13.720   7.669
 1103    HA   LYS 584           HA       LYS 584  60.293  11.460   9.304
 1104    HB2  LYS 584           HB2      LYS 584  57.776  11.764   9.593
 1105    HB3  LYS 584           HB1      LYS 584  58.760  13.201   9.892
 1106    HG2  LYS 584           HG2      LYS 584  58.076  14.262   7.935
 1107    HG3  LYS 584           HG1      LYS 584  57.773  12.745   7.081
 1108    HD2  LYS 584           HD2      LYS 584  55.687  14.004   7.664
 1109    HD3  LYS 584           HD1      LYS 584  55.749  12.376   8.333
 1110    HE2  LYS 584           HE2      LYS 584  56.136  13.144  10.515
 1111    HE3  LYS 584           HE1      LYS 584  56.734  14.709   9.960
 1112    HZ1  LYS 584           HZ1      LYS 584  54.331  14.454  10.906
 1113    HZ2  LYS 584           HZ2      LYS 584  53.977  13.950   9.322
 1114    HZ3  LYS 584           HZ3      LYS 584  54.639  15.489   9.599
 1115    H    GLY 585           HN       GLY 585  59.324  11.670   6.015
 1116    HA2  GLY 585           HA2      GLY 585  57.859   9.115   6.038
 1117    HA3  GLY 585           HA1      GLY 585  58.138  10.149   4.638
 1118    H    THR 586           HN       THR 586  61.021  10.296   5.576
 1119    HA   THR 586           HA       THR 586  61.937   7.570   4.757
 1120    HB   THR 586           HB       THR 586  63.287   8.396   3.044
 1121    HG1  THR 586           HG1      THR 586  63.878  10.626   2.983
 1122   HG21  THR 586          HG21      THR 586  61.934   9.868   1.681
 1123   HG22  THR 586          HG22      THR 586  61.084  10.478   3.104
 1124   HG23  THR 586          HG23      THR 586  60.844   8.811   2.580
 1125    H    PHE 587           HN       PHE 587  61.799   9.143   7.328
 1126    HA   PHE 587           HA       PHE 587  64.679   9.580   7.895
 1127    HB2  PHE 587           HB2      PHE 587  64.061  10.650   9.868
 1128    HB3  PHE 587           HB1      PHE 587  62.755  11.072   8.784
 1129    HD1  PHE 587           HD1      PHE 587  63.265  10.355  12.043
 1130    HD2  PHE 587           HD2      PHE 587  60.954   8.822   8.761
 1131    HE1  PHE 587           HE1      PHE 587  61.639   9.380  13.637
 1132    HE2  PHE 587           HE2      PHE 587  59.332   7.850  10.356
 1133    HZ   PHE 587           HZ       PHE 587  59.673   8.128  12.796
 1134    H    LYS 588           HN       LYS 588  65.817   7.828   8.253
 1135    HA   LYS 588           HA       LYS 588  64.662   5.541   9.775
 1136    HB2  LYS 588           HB2      LYS 588  66.193   5.703   7.403
 1137    HB3  LYS 588           HB1      LYS 588  67.318   5.167   8.608
 1138    HG2  LYS 588           HG2      LYS 588  66.163   3.324   7.338
 1139    HG3  LYS 588           HG1      LYS 588  66.090   3.198   9.080
 1140    HD2  LYS 588           HD2      LYS 588  63.957   2.703   7.645
 1141    HD3  LYS 588           HD1      LYS 588  63.792   3.586   9.141
 1142    HE2  LYS 588           HE2      LYS 588  63.261   5.567   8.047
 1143    HE3  LYS 588           HE1      LYS 588  64.225   5.169   6.643
 1144    HZ1  LYS 588           HZ1      LYS 588  62.270   4.691   5.726
 1145    HZ2  LYS 588           HZ2      LYS 588  61.480   4.546   7.222
 1146    HZ3  LYS 588           HZ3      LYS 588  62.374   3.242   6.600
 1147    H    GLU 589           HN       GLU 589  66.075   4.604  11.450
 1148    HA   GLU 589           HA       GLU 589  68.228   6.345  12.461
 1149    HB2  GLU 589           HB2      GLU 589  66.520   7.546  13.504
 1150    HB3  GLU 589           HB1      GLU 589  65.528   6.120  13.772
 1151    HG2  GLU 589           HG2      GLU 589  66.934   5.383  15.568
 1152    HG3  GLU 589           HG1      GLU 589  68.188   6.559  15.164
 1153    H    GLN 590           HN       GLN 590  69.362   5.467  14.181
 1154    HA   GLN 590           HA       GLN 590  68.816   2.805  15.192
 1155    HB2  GLN 590           HB2      GLN 590  70.848   1.765  14.349
 1156    HB3  GLN 590           HB1      GLN 590  69.909   2.351  12.985
 1157    HG2  GLN 590           HG2      GLN 590  71.292   4.476  13.110
 1158    HG3  GLN 590           HG1      GLN 590  72.339   3.604  14.209
 1159   HE21  GLN 590          HE21      GLN 590  71.229   1.203  12.295
 1160   HE22  GLN 590          HE22      GLN 590  72.391   1.220  11.057
 1161    H    ASN 591           HN       ASN 591  70.023   2.502  17.085
 1162    HA   ASN 591           HA       ASN 591  70.965   3.305  19.060
 1163    HB2  ASN 591           HB2      ASN 591  73.222   4.754  18.030
 1164    HB3  ASN 591           HB1      ASN 591  73.197   3.138  18.703
 1165   HD21  ASN 591          HD21      ASN 591  71.692   1.811  16.727
 1166   HD22  ASN 591          HD22      ASN 591  72.543   1.830  15.258
 1167    H    ASP 592           HN       ASP 592  69.066   5.088  17.535
 1168    HA   ASP 592           HA       ASP 592  68.025   7.105  18.176
 1169    HB2  ASP 592           HB2      ASP 592  70.522   8.035  19.570
 1170    HB3  ASP 592           HB1      ASP 592  68.841   8.438  19.913
 1171    H    LYS 593           HN       LYS 593  70.877   6.800  16.405
 1172    HA   LYS 593           HA       LYS 593  71.200   9.628  15.759
 1173    HB2  LYS 593           HB2      LYS 593  72.368   7.123  14.573
 1174    HB3  LYS 593           HB1      LYS 593  72.886   8.761  14.201
 1175    HG2  LYS 593           HG2      LYS 593  73.077   8.842  16.911
 1176    HG3  LYS 593           HG1      LYS 593  73.369   7.125  16.652
 1177    HD2  LYS 593           HD2      LYS 593  75.181   7.643  15.079
 1178    HD3  LYS 593           HD1      LYS 593  74.870   9.370  15.270
 1179    HE2  LYS 593           HE2      LYS 593  75.495   7.622  17.655
 1180    HE3  LYS 593           HE1      LYS 593  76.782   8.328  16.678
 1181    HZ1  LYS 593           HZ1      LYS 593  76.376   9.871  18.367
 1182    HZ2  LYS 593           HZ2      LYS 593  74.688   9.722  18.234
 1183    HZ3  LYS 593           HZ3      LYS 593  75.573  10.510  17.016
 1184    HA   PRO 594           HA       PRO 594  67.870   9.219  12.603
 1185    HB2  PRO 594           HB2      PRO 594  69.015  11.795  11.666
 1186    HB3  PRO 594           HB1      PRO 594  67.347  11.399  12.084
 1187    HG2  PRO 594           HG2      PRO 594  68.956  12.938  13.654
 1188    HG3  PRO 594           HG1      PRO 594  67.661  11.926  14.311
 1189    HD2  PRO 594           HD2      PRO 594  70.610  11.513  14.452
 1190    HD3  PRO 594           HD1      PRO 594  69.326  10.892  15.516
 1191    H    TYR 595           HN       TYR 595  67.866   9.044  10.223
 1192    HA   TYR 595           HA       TYR 595  70.309   9.257   8.674
 1193    HB2  TYR 595           HB2      TYR 595  69.472   6.568   9.748
 1194    HB3  TYR 595           HB1      TYR 595  70.304   6.680   8.207
 1195    HD1  TYR 595           HD1      TYR 595  72.452   8.394   8.352
 1196    HD2  TYR 595           HD2      TYR 595  70.826   6.054  11.551
 1197    HE1  TYR 595           HE1      TYR 595  74.663   8.400   9.490
 1198    HE2  TYR 595           HE2      TYR 595  73.030   6.058  12.680
 1199    HH   TYR 595           HH       TYR 595  75.512   8.150  11.850
 1200    H    CYS 596           HN       CYS 596  69.776   9.119   6.453
 1201    HA   CYS 596           HA       CYS 596  66.941   8.830   5.764
 1202    HB2  CYS 596           HB2      CYS 596  69.208   8.614   3.768
 1203    HB3  CYS 596           HB1      CYS 596  67.584   9.238   3.517
 1204    H    GLN 597           HN       GLN 597  66.149   6.904   4.516
 1205    HA   GLN 597           HA       GLN 597  67.189   4.487   5.590
 1206    HB2  GLN 597           HB2      GLN 597  65.012   4.208   4.783
 1207    HB3  GLN 597           HB1      GLN 597  65.307   5.183   3.371
 1208    HG2  GLN 597           HG2      GLN 597  65.147   3.055   2.433
 1209    HG3  GLN 597           HG1      GLN 597  66.876   3.185   2.674
 1210   HE21  GLN 597          HE21      GLN 597  66.619   2.888   5.641
 1211   HE22  GLN 597          HE22      GLN 597  66.272   1.268   5.909
 1212    H    ASN 598           HN       ASN 598  67.541   5.894   2.343
 1213    HA   ASN 598           HA       ASN 598  69.407   4.168   1.235
 1214    HB2  ASN 598           HB2      ASN 598  69.822   7.127   0.916
 1215    HB3  ASN 598           HB1      ASN 598  69.851   5.861  -0.305
 1216   HD21  ASN 598          HD21      ASN 598  67.485   4.589  -0.036
 1217   HD22  ASN 598          HD22      ASN 598  66.186   5.652  -0.256
 1218    H    CYS 599           HN       CYS 599  69.881   6.493   3.807
 1219    HA   CYS 599           HA       CYS 599  72.808   6.259   3.714
 1220    HB2  CYS 599           HB2      CYS 599  70.861   7.679   5.542
 1221    HB3  CYS 599           HB1      CYS 599  72.577   7.579   5.913
 1222    H    PHE 600           HN       PHE 600  70.257   5.483   6.115
 1223    HA   PHE 600           HA       PHE 600  71.885   3.936   7.849
 1224    HB2  PHE 600           HB2      PHE 600  69.802   4.486   8.765
 1225    HB3  PHE 600           HB1      PHE 600  68.931   4.081   7.292
 1226    HD1  PHE 600           HD1      PHE 600  70.374   2.799  10.414
 1227    HD2  PHE 600           HD2      PHE 600  68.415   1.728   6.744
 1228    HE1  PHE 600           HE1      PHE 600  69.871   0.549  11.334
 1229    HE2  PHE 600           HE2      PHE 600  67.919  -0.519   7.663
 1230    HZ   PHE 600           HZ       PHE 600  68.646  -1.108   9.959
 1231    H    LEU 601           HN       LEU 601  69.690   2.794   5.258
 1232    HA   LEU 601           HA       LEU 601  70.305   0.076   5.435
 1233    HB2  LEU 601           HB2      LEU 601  68.929  -0.033   3.621
 1234    HB3  LEU 601           HB1      LEU 601  68.839   1.716   3.714
 1235    HG   LEU 601           HG       LEU 601  70.855   1.813   2.179
 1236   HD11  LEU 601          HD11      LEU 601  70.750  -1.078   2.589
 1237   HD12  LEU 601          HD12      LEU 601  72.001  -0.109   1.820
 1238   HD13  LEU 601          HD13      LEU 601  70.640  -0.693   0.873
 1239   HD21  LEU 601          HD21      LEU 601  68.449   0.343   1.067
 1240   HD22  LEU 601          HD22      LEU 601  69.526   1.424   0.184
 1241   HD23  LEU 601          HD23      LEU 601  68.470   2.064   1.439
 1242    H    LYS 602           HN       LYS 602  72.065   2.653   3.806
 1243    HA   LYS 602           HA       LYS 602  73.992   1.124   2.455
 1244    HB2  LYS 602           HB2      LYS 602  73.632   3.854   3.062
 1245    HB3  LYS 602           HB1      LYS 602  75.216   3.489   3.703
 1246    HG2  LYS 602           HG2      LYS 602  74.289   2.974   0.869
 1247    HG3  LYS 602           HG1      LYS 602  75.354   4.272   1.383
 1248    HD2  LYS 602           HD2      LYS 602  76.833   2.345   2.348
 1249    HD3  LYS 602           HD1      LYS 602  75.898   1.314   1.271
 1250    HE2  LYS 602           HE2      LYS 602  77.728   1.932  -0.063
 1251    HE3  LYS 602           HE1      LYS 602  76.469   3.065  -0.556
 1252    HZ1  LYS 602           HZ1      LYS 602  78.769   3.545   1.236
 1253    HZ2  LYS 602           HZ2      LYS 602  77.416   4.573   1.227
 1254    HZ3  LYS 602           HZ3      LYS 602  78.345   4.373  -0.181
 1255    H    LEU 603           HN       LEU 603  73.751   1.868   5.876
 1256    HA   LEU 603           HA       LEU 603  76.443   0.758   6.405
 1257    HB2  LEU 603           HB2      LEU 603  74.753   1.520   8.719
 1258    HB3  LEU 603           HB1      LEU 603  76.413   1.969   8.344
 1259    HG   LEU 603           HG       LEU 603  73.936   3.151   7.042
 1260   HD11  LEU 603          HD11      LEU 603  74.456   3.694   9.503
 1261   HD12  LEU 603          HD12      LEU 603  74.243   5.045   8.392
 1262   HD13  LEU 603          HD13      LEU 603  75.862   4.548   8.872
 1263   HD21  LEU 603          HD21      LEU 603  76.248   3.025   5.754
 1264   HD22  LEU 603          HD22      LEU 603  76.724   4.293   6.874
 1265   HD23  LEU 603          HD23      LEU 603  75.354   4.539   5.793
 1266    H    PHE 604           HN       PHE 604  73.159   0.138   7.729
 1267    HA   PHE 604           HA       PHE 604  74.107  -2.478   8.715
 1268    HB2  PHE 604           HB2      PHE 604  71.749  -0.708   9.175
 1269    HB3  PHE 604           HB1      PHE 604  71.452  -2.438   9.352
 1270    HD1  PHE 604           HD1      PHE 604  73.794   0.292  10.439
 1271    HD2  PHE 604           HD2      PHE 604  72.088  -3.554  11.327
 1272    HE1  PHE 604           HE1      PHE 604  74.872   0.327  12.668
 1273    HE2  PHE 604           HE2      PHE 604  73.168  -3.513  13.559
 1274    HZ   PHE 604           HZ       PHE 604  74.560  -1.574  14.228
 1275    H    CYS 605           HN       CYS 605  73.752  -1.901   5.757
 1276    HA   CYS 605           HA       CYS 605  72.616  -4.480   5.093
 1277    HB2  CYS 605           HB2      CYS 605  70.959  -2.015   4.718
 1278    HB3  CYS 605           HB1      CYS 605  70.892  -3.247   3.462
 1279    HG   CYS 605           HG       CYS 605  70.409  -4.898   5.687
  Start of MODEL   16
    1    H    MET   1           HT1      MET   1  87.169 -25.299  11.800
    2    HA   MET   1           HA       MET   1  86.326 -25.224   9.350
    3    HB2  MET   1           HB2      MET   1  87.596 -23.471  10.685
    4    HB3  MET   1           HB1      MET   1  89.081 -24.163  10.034
    5    HG2  MET   1           HG2      MET   1  88.010 -23.851   7.715
    6    HG3  MET   1           HG1      MET   1  86.822 -22.834   8.529
    7    HE1  MET   1           HE1      MET   1  87.465 -21.057  10.212
    8    HE2  MET   1           HE2      MET   1  87.156 -20.297   8.653
    9    HE3  MET   1           HE3      MET   1  88.512 -19.753   9.636
   10    H    ALA   2           HN       ALA   2  89.582 -24.956   8.553
   11    HA   ALA   2           HA       ALA   2  89.809 -27.721   7.482
   12    HB1  ALA   2           HB1      ALA   2  88.649 -26.261   5.761
   13    HB2  ALA   2           HB2      ALA   2  90.178 -26.957   5.222
   14    HB3  ALA   2           HB3      ALA   2  90.107 -25.269   5.731
   15    H    LEU   3           HN       LEU   3  91.283 -24.496   7.262
   16    HA   LEU   3           HA       LEU   3  93.958 -25.205   6.943
   17    HB2  LEU   3           HB2      LEU   3  92.678 -22.986   8.541
   18    HB3  LEU   3           HB1      LEU   3  94.422 -23.080   8.285
   19    HG   LEU   3           HG       LEU   3  92.375 -23.053   6.051
   20   HD11  LEU   3          HD11      LEU   3  93.309 -20.685   5.726
   21   HD12  LEU   3          HD12      LEU   3  93.967 -20.839   7.356
   22   HD13  LEU   3          HD13      LEU   3  92.224 -20.920   7.097
   23   HD21  LEU   3          HD21      LEU   3  94.266 -23.942   5.048
   24   HD22  LEU   3          HD22      LEU   3  95.374 -23.172   6.182
   25   HD23  LEU   3          HD23      LEU   3  94.646 -22.232   4.881
   26    H    ASP   4           HN       ASP   4  93.142 -23.889  10.042
   27    HA   ASP   4           HA       ASP   4  93.960 -24.442  12.175
   28    HB2  ASP   4           HB2      ASP   4  91.978 -25.890  11.967
   29    HB3  ASP   4           HB1      ASP   4  92.974 -27.114  11.181
   30    H    GLY   5           HN       GLY   5  95.796 -24.743   9.842
   31    HA2  GLY   5           HA2      GLY   5  97.476 -27.045  10.203
   32    HA3  GLY   5           HA1      GLY   5  97.954 -25.535   9.419
   33    H    ILE   6           HN       ILE   6  96.911 -24.261  11.985
   34    HA   ILE   6           HA       ILE   6  99.448 -24.551  13.543
   35    HB   ILE   6           HB       ILE   6  98.318 -22.148  14.341
   36   HG12  ILE   6          HG12      ILE   6  96.584 -22.553  12.490
   37   HG13  ILE   6          HG11      ILE   6  97.395 -20.991  12.504
   38   HG21  ILE   6          HG21      ILE   6 100.308 -22.762  12.178
   39   HG22  ILE   6          HG22      ILE   6 100.615 -22.258  13.840
   40   HG23  ILE   6          HG23      ILE   6  99.942 -21.112  12.682
   41   HD11  ILE   6          HD11      ILE   6  97.178 -22.644  10.311
   42   HD12  ILE   6          HD12      ILE   6  98.801 -23.025  10.880
   43   HD13  ILE   6          HD13      ILE   6  98.371 -21.362  10.489
   44    H    ARG   7           HN       ARG   7  96.865 -22.786  15.034
   45    HA   ARG   7           HA       ARG   7  95.761 -25.124  16.392
   46    HB2  ARG   7           HB2      ARG   7  96.409 -24.149  18.654
   47    HB3  ARG   7           HB1      ARG   7  97.686 -24.927  17.735
   48    HG2  ARG   7           HG2      ARG   7  97.374 -22.002  17.238
   49    HG3  ARG   7           HG1      ARG   7  97.936 -22.446  18.846
   50    HD2  ARG   7           HD2      ARG   7  99.735 -23.819  17.802
   51    HD3  ARG   7           HD1      ARG   7  99.194 -23.258  16.224
   52    HE   ARG   7           HE       ARG   7 100.253 -21.195  16.655
   53   HH11  ARG   7          HH11      ARG   7 101.434 -19.775  17.959
   54   HH12  ARG   7          HH12      ARG   7 101.612 -20.115  19.647
   55   HH21  ARG   7          HH21      ARG   7  99.765 -23.047  19.521
   56   HH22  ARG   7          HH22      ARG   7 100.667 -21.968  20.532
   57    H    MET   8           HN       MET   8  95.852 -22.098  18.115
   58    HA   MET   8           HA       MET   8  93.280 -21.245  16.915
   59    HB2  MET   8           HB2      MET   8  92.881 -21.049  19.747
   60    HB3  MET   8           HB1      MET   8  92.004 -22.036  18.598
   61    HG2  MET   8           HG2      MET   8  93.560 -23.862  18.830
   62    HG3  MET   8           HG1      MET   8  94.638 -22.916  19.836
   63    HE1  MET   8           HE1      MET   8  93.592 -25.778  20.740
   64    HE2  MET   8           HE2      MET   8  93.392 -25.386  22.446
   65    HE3  MET   8           HE3      MET   8  94.737 -24.693  21.543
   66    HA   PRO   9           HA       PRO   9  94.957 -17.556  19.806
   67    HB2  PRO   9           HB2      PRO   9  97.766 -18.654  19.732
   68    HB3  PRO   9           HB1      PRO   9  97.031 -17.548  20.915
   69    HG2  PRO   9           HG2      PRO   9  97.305 -20.098  21.497
   70    HG3  PRO   9           HG1      PRO   9  95.811 -19.235  21.911
   71    HD2  PRO   9           HD2      PRO   9  96.257 -21.248  19.754
   72    HD3  PRO   9           HD1      PRO   9  94.810 -20.892  20.688
   73    H    ASP  10           HN       ASP  10  96.672 -19.404  17.443
   74    HA   ASP  10           HA       ASP  10  97.083 -16.977  15.718
   75    HB2  ASP  10           HB2      ASP  10  99.154 -18.276  16.576
   76    HB3  ASP  10           HB1      ASP  10  98.641 -19.558  15.481
   77    H    GLY  11           HN       GLY  11  95.858 -20.198  16.037
   78    HA2  GLY  11           HA2      GLY  11  95.256 -20.521  13.192
   79    HA3  GLY  11           HA1      GLY  11  94.755 -21.598  14.490
   80    H    CYS  12           HN       CYS  12  94.053 -18.475  15.386
   81    HA   CYS  12           HA       CYS  12  91.605 -18.014  13.934
   82    HB2  CYS  12           HB2      CYS  12  90.727 -19.905  15.104
   83    HB3  CYS  12           HB1      CYS  12  91.463 -19.386  16.620
   84    HG   CYS  12           HG       CYS  12  89.769 -17.283  16.520
   85    H    TYR  13           HN       TYR  13  93.135 -17.625  17.126
   86    HA   TYR  13           HA       TYR  13  93.782 -15.649  18.221
   87    HB2  TYR  13           HB2      TYR  13  93.671 -14.685  15.712
   88    HB3  TYR  13           HB1      TYR  13  92.225 -13.893  16.331
   89    HD1  TYR  13           HD1      TYR  13  92.477 -12.669  18.638
   90    HD2  TYR  13           HD2      TYR  13  95.775 -13.694  16.081
   91    HE1  TYR  13           HE1      TYR  13  93.879 -10.960  19.761
   92    HE2  TYR  13           HE2      TYR  13  97.176 -11.983  17.206
   93    HH   TYR  13           HH       TYR  13  97.137 -10.858  19.597
   94    H    ALA  14           HN       ALA  14  90.548 -15.909  16.861
   95    HA   ALA  14           HA       ALA  14  89.082 -16.268  19.152
   96    HB1  ALA  14           HB1      ALA  14  89.931 -13.420  18.841
   97    HB2  ALA  14           HB2      ALA  14  89.617 -14.333  20.316
   98    HB3  ALA  14           HB3      ALA  14  88.270 -13.702  19.369
   99    H    ASP  15           HN       ASP  15  89.230 -14.272  16.249
  100    HA   ASP  15           HA       ASP  15  86.862 -15.605  15.202
  101    HB2  ASP  15           HB2      ASP  15  86.002 -13.770  16.749
  102    HB3  ASP  15           HB1      ASP  15  86.690 -12.619  15.604
  103    H    GLY  16           HN       GLY  16  89.790 -14.211  14.735
  104    HA2  GLY  16           HA2      GLY  16  90.964 -13.898  12.702
  105    HA3  GLY  16           HA1      GLY  16  89.448 -14.150  11.831
  106    H    THR  17           HN       THR  17  90.028 -11.851  14.442
  107    HA   THR  17           HA       THR  17  88.874  -9.701  12.854
  108    HB   THR  17           HB       THR  17  89.624  -8.363  14.985
  109    HG1  THR  17           HG1      THR  17  90.790 -10.653  15.414
  110   HG21  THR  17          HG21      THR  17  87.324  -8.821  14.715
  111   HG22  THR  17          HG22      THR  17  87.724  -9.491  16.297
  112   HG23  THR  17          HG23      THR  17  87.562 -10.560  14.903
  113    H    TRP  18           HN       TRP  18  89.968  -8.461  11.531
  114    HA   TRP  18           HA       TRP  18  92.835  -7.829  12.052
  115    HB2  TRP  18           HB2      TRP  18  92.732  -7.793   9.317
  116    HB3  TRP  18           HB1      TRP  18  93.285  -9.178  10.247
  117    HD1  TRP  18           HD1      TRP  18  89.963  -7.818   8.795
  118    HE1  TRP  18           HE1      TRP  18  88.527  -9.839   8.077
  119    HE3  TRP  18           HE3      TRP  18  92.984 -11.638  10.333
  120    HZ2  TRP  18           HZ2      TRP  18  88.648 -12.697   8.147
  121    HZ3  TRP  18           HZ3      TRP  18  92.301 -13.996   9.996
  122    HH2  TRP  18           HH2      TRP  18  90.139 -14.530   8.906
  123    H    GLU  19           HN       GLU  19  93.010  -5.652  12.202
  124    HA   GLU  19           HA       GLU  19  90.767  -3.974  11.438
  125    HB2  GLU  19           HB2      GLU  19  92.873  -2.207  11.978
  126    HB3  GLU  19           HB1      GLU  19  91.676  -2.764  13.141
  127    HG2  GLU  19           HG2      GLU  19  94.001  -3.103  13.927
  128    HG3  GLU  19           HG1      GLU  19  93.099  -4.610  13.787
  129    H    LEU  20           HN       LEU  20  90.504  -2.769   9.641
  130    HA   LEU  20           HA       LEU  20  92.397  -3.224   7.447
  131    HB2  LEU  20           HB2      LEU  20  89.624  -2.742   7.613
  132    HB3  LEU  20           HB1      LEU  20  90.256  -1.254   6.923
  133    HG   LEU  20           HG       LEU  20  89.755  -2.665   5.081
  134   HD11  LEU  20          HD11      LEU  20  92.237  -1.647   5.361
  135   HD12  LEU  20          HD12      LEU  20  91.723  -2.548   3.937
  136   HD13  LEU  20          HD13      LEU  20  92.652  -3.356   5.191
  137   HD21  LEU  20          HD21      LEU  20  90.521  -4.796   6.935
  138   HD22  LEU  20          HD22      LEU  20  91.283  -5.026   5.369
  139   HD23  LEU  20          HD23      LEU  20  89.534  -4.881   5.480
  140    H    SER  21           HN       SER  21  93.951  -1.738   6.855
  141    HA   SER  21           HA       SER  21  94.306   0.611   8.563
  142    HB2  SER  21           HB2      SER  21  96.081  -0.935   7.258
  143    HB3  SER  21           HB1      SER  21  95.852   0.306   6.028
  144    HG   SER  21           HG       SER  21  96.087   1.356   8.525
  145    H    VAL  22           HN       VAL  22  94.059   2.742   7.953
  146    HA   VAL  22           HA       VAL  22  92.907   3.270   5.275
  147    HB   VAL  22           HB       VAL  22  91.601   3.852   7.929
  148   HG11  VAL  22          HG11      VAL  22  91.212   5.316   5.302
  149   HG12  VAL  22          HG12      VAL  22  91.612   6.022   6.873
  150   HG13  VAL  22          HG13      VAL  22  90.031   5.317   6.604
  151   HG21  VAL  22          HG21      VAL  22  91.084   1.814   6.488
  152   HG22  VAL  22          HG22      VAL  22  90.441   2.945   5.291
  153   HG23  VAL  22          HG23      VAL  22  89.702   2.834   6.891
  154    H    HIS  23           HN       HIS  23  93.754   5.025   4.379
  155    HA   HIS  23           HA       HIS  23  95.406   6.870   6.068
  156    HB2  HIS  23           HB2      HIS  23  95.433   6.033   3.162
  157    HB3  HIS  23           HB1      HIS  23  96.229   7.519   3.678
  158    HD1  HIS  23           HD1      HIS  23  96.291   3.782   4.380
  159    HD2  HIS  23           HD2      HIS  23  98.730   7.130   4.854
  160    HE1  HIS  23           HE1      HIS  23  98.530   2.927   5.199
  161    H    VAL  24           HN       VAL  24  93.955   8.495   6.699
  162    HA   VAL  24           HA       VAL  24  91.849   9.337   4.878
  163    HB   VAL  24           HB       VAL  24  92.856  10.904   7.247
  164   HG11  VAL  24          HG11      VAL  24  90.399  11.406   7.427
  165   HG12  VAL  24          HG12      VAL  24  90.147  10.459   5.964
  166   HG13  VAL  24          HG13      VAL  24  91.090  11.933   5.891
  167   HG21  VAL  24          HG21      VAL  24  92.700   8.695   8.116
  168   HG22  VAL  24          HG22      VAL  24  91.231   8.358   7.205
  169   HG23  VAL  24          HG23      VAL  24  91.188   9.484   8.561
  170    H    THR  25           HN       THR  25  92.291  10.524   3.099
  171    HA   THR  25           HA       THR  25  94.802  12.004   2.892
  172    HB   THR  25           HB       THR  25  94.371  12.080   0.626
  173    HG1  THR  25           HG1      THR  25  92.332  12.484  -0.203
  174   HG21  THR  25          HG21      THR  25  93.907   9.710   1.555
  175   HG22  THR  25          HG22      THR  25  93.352  10.063  -0.081
  176   HG23  THR  25          HG23      THR  25  92.207  10.073   1.260
  177    H    ASP  26           HN       ASP  26  91.344  12.885   3.088
  178    HA   ASP  26           HA       ASP  26  91.777  15.707   2.833
  179    HB2  ASP  26           HB2      ASP  26  89.532  15.828   4.100
  180    HB3  ASP  26           HB1      ASP  26  89.540  14.976   2.557
  181    H    LEU  27           HN       LEU  27  92.622  13.549   5.296
  182    HA   LEU  27           HA       LEU  27  92.950  15.792   7.272
  183    HB2  LEU  27           HB2      LEU  27  92.109  12.962   7.615
  184    HB3  LEU  27           HB1      LEU  27  93.045  13.657   8.878
  185    HG   LEU  27           HG       LEU  27  90.745  13.897   9.439
  186   HD11  LEU  27          HD11      LEU  27  90.748  16.077  10.079
  187   HD12  LEU  27          HD12      LEU  27  91.204  16.671   8.485
  188   HD13  LEU  27          HD13      LEU  27  92.425  15.963   9.547
  189   HD21  LEU  27          HD21      LEU  27  90.251  15.427   6.903
  190   HD22  LEU  27          HD22      LEU  27  89.067  14.762   8.027
  191   HD23  LEU  27          HD23      LEU  27  90.015  13.684   7.002
  192    H    ASN  28           HN       ASN  28  94.328  13.123   5.563
  193    HA   ASN  28           HA       ASN  28  96.564  12.500   5.239
  194    HB2  ASN  28           HB2      ASN  28  97.003  15.039   5.551
  195    HB3  ASN  28           HB1      ASN  28  97.449  14.629   7.202
  196   HD21  ASN  28          HD21      ASN  28  98.350  11.905   6.115
  197   HD22  ASN  28          HD22      ASN  28  99.893  12.210   5.490
  198    H    ARG  29           HN       ARG  29  94.681  11.997   7.714
  199    HA   ARG  29           HA       ARG  29  96.652  11.106   9.693
  200    HB2  ARG  29           HB2      ARG  29  93.644  10.920   9.533
  201    HB3  ARG  29           HB1      ARG  29  94.588  10.290  10.880
  202    HG2  ARG  29           HG2      ARG  29  95.320  12.425  11.531
  203    HG3  ARG  29           HG1      ARG  29  94.885  13.161  10.005
  204    HD2  ARG  29           HD2      ARG  29  93.094  13.864  11.326
  205    HD3  ARG  29           HD1      ARG  29  92.427  12.350  10.708
  206    HE   ARG  29           HE       ARG  29  93.918  12.085  13.226
  207   HH11  ARG  29          HH11      ARG  29  92.672  11.432  14.996
  208   HH12  ARG  29          HH12      ARG  29  90.944  11.465  14.881
  209   HH21  ARG  29          HH21      ARG  29  90.914  12.659  11.628
  210   HH22  ARG  29          HH22      ARG  29  89.951  12.159  12.978
  211    H    ASP  30           HN       ASP  30  95.863   8.836  10.594
  212    HA   ASP  30           HA       ASP  30  95.404   6.926   8.392
  213    HB2  ASP  30           HB2      ASP  30  97.743   6.904  10.302
  214    HB3  ASP  30           HB1      ASP  30  97.166   5.429   9.523
  215    H    VAL  31           HN       VAL  31  93.671   5.768   9.015
  216    HA   VAL  31           HA       VAL  31  93.271   5.284  11.959
  217    HB   VAL  31           HB       VAL  31  91.127   5.415   9.823
  218   HG11  VAL  31          HG11      VAL  31  91.119   5.402  12.855
  219   HG12  VAL  31          HG12      VAL  31  90.501   4.142  11.789
  220   HG13  VAL  31          HG13      VAL  31  89.692   5.708  11.865
  221   HG21  VAL  31          HG21      VAL  31  91.901   7.560  11.845
  222   HG22  VAL  31          HG22      VAL  31  90.652   7.679  10.608
  223   HG23  VAL  31          HG23      VAL  31  92.349   7.620  10.142
  224    H    THR  32           HN       THR  32  92.309   3.293  12.546
  225    HA   THR  32           HA       THR  32  92.379   1.125  10.497
  226    HB   THR  32           HB       THR  32  93.217   0.020  13.019
  227    HG1  THR  32           HG1      THR  32  95.302   1.471  12.767
  228   HG21  THR  32          HG21      THR  32  95.075  -0.783  11.820
  229   HG22  THR  32          HG22      THR  32  95.101   0.611  10.742
  230   HG23  THR  32          HG23      THR  32  93.840  -0.611  10.575
  231    H    LEU  33           HN       LEU  33  90.564  -0.121  10.619
  232    HA   LEU  33           HA       LEU  33  88.753   0.211  12.983
  233    HB2  LEU  33           HB2      LEU  33  88.317  -0.015  10.026
  234    HB3  LEU  33           HB1      LEU  33  87.067  -0.611  11.097
  235    HG   LEU  33           HG       LEU  33  86.904   1.837  10.261
  236   HD11  LEU  33          HD11      LEU  33  86.754   1.328  13.238
  237   HD12  LEU  33          HD12      LEU  33  85.528   0.847  12.070
  238   HD13  LEU  33          HD13      LEU  33  85.875   2.554  12.330
  239   HD21  LEU  33          HD21      LEU  33  89.334   2.327  10.879
  240   HD22  LEU  33          HD22      LEU  33  88.802   2.355  12.561
  241   HD23  LEU  33          HD23      LEU  33  88.148   3.503  11.423
  242    H    ARG  34           HN       ARG  34  88.872  -1.546  14.226
  243    HA   ARG  34           HA       ARG  34  89.789  -4.116  13.460
  244    HB2  ARG  34           HB2      ARG  34  89.585  -3.216  15.826
  245    HB3  ARG  34           HB1      ARG  34  87.854  -3.506  15.699
  246    HG2  ARG  34           HG2      ARG  34  88.794  -5.448  16.755
  247    HG3  ARG  34           HG1      ARG  34  88.380  -5.903  15.104
  248    HD2  ARG  34           HD2      ARG  34  90.593  -6.050  14.439
  249    HD3  ARG  34           HD1      ARG  34  91.155  -4.885  15.636
  250    HE   ARG  34           HE       ARG  34  90.136  -7.357  16.812
  251   HH11  ARG  34          HH11      ARG  34  91.688  -8.629  17.856
  252   HH12  ARG  34          HH12      ARG  34  93.370  -8.310  17.592
  253   HH21  ARG  34          HH21      ARG  34  92.799  -5.668  15.418
  254   HH22  ARG  34          HH22      ARG  34  93.999  -6.634  16.211
  255    H    VAL  35           HN       VAL  35  88.773  -5.116  11.780
  256    HA   VAL  35           HA       VAL  35  85.834  -5.626  12.041
  257    HB   VAL  35           HB       VAL  35  85.699  -5.416   9.553
  258   HG11  VAL  35          HG11      VAL  35  85.912  -2.874   9.564
  259   HG12  VAL  35          HG12      VAL  35  86.542  -3.026  11.206
  260   HG13  VAL  35          HG13      VAL  35  84.900  -3.558  10.836
  261   HG21  VAL  35          HG21      VAL  35  88.023  -5.732   8.960
  262   HG22  VAL  35          HG22      VAL  35  88.505  -4.335   9.918
  263   HG23  VAL  35          HG23      VAL  35  87.548  -4.110   8.456
  264    H    THR  36           HN       THR  36  85.448  -7.188   9.902
  265    HA   THR  36           HA       THR  36  87.529  -9.310   9.883
  266    HB   THR  36           HB       THR  36  85.560 -10.975  10.140
  267    HG1  THR  36           HG1      THR  36  84.406  -8.535  10.673
  268   HG21  THR  36          HG21      THR  36  86.648  -9.297  12.386
  269   HG22  THR  36          HG22      THR  36  87.169 -10.901  11.864
  270   HG23  THR  36          HG23      THR  36  85.619 -10.697  12.677
  271    H    GLY  37           HN       GLY  37  86.805 -10.974   8.119
  272    HA2  GLY  37           HA2      GLY  37  86.093  -9.427   5.768
  273    HA3  GLY  37           HA1      GLY  37  86.484 -11.139   5.779
  274    H    GLU  38           HN       GLU  38  84.034  -9.278   7.531
  275    HA   GLU  38           HA       GLU  38  81.878 -10.669   6.062
  276    HB2  GLU  38           HB2      GLU  38  80.883 -11.626   7.962
  277    HB3  GLU  38           HB1      GLU  38  82.590 -11.985   8.165
  278    HG2  GLU  38           HG2      GLU  38  82.169 -11.138  10.283
  279    HG3  GLU  38           HG1      GLU  38  82.529  -9.622   9.460
  280    H    VAL  39           HN       VAL  39  83.177  -7.873   7.271
  281    HA   VAL  39           HA       VAL  39  80.619  -6.637   8.046
  282    HB   VAL  39           HB       VAL  39  81.862  -4.825   8.828
  283   HG11  VAL  39          HG11      VAL  39  82.397  -7.082   9.891
  284   HG12  VAL  39          HG12      VAL  39  83.523  -5.766  10.212
  285   HG13  VAL  39          HG13      VAL  39  83.924  -6.999   9.016
  286   HG21  VAL  39          HG21      VAL  39  84.243  -4.392   8.130
  287   HG22  VAL  39          HG22      VAL  39  83.082  -4.181   6.831
  288   HG23  VAL  39          HG23      VAL  39  84.060  -5.651   6.914
  289    H    HIS  40           HN       HIS  40  79.599  -5.010   6.794
  290    HA   HIS  40           HA       HIS  40  80.217  -5.126   3.917
  291    HB2  HIS  40           HB2      HIS  40  78.342  -3.150   4.085
  292    HB3  HIS  40           HB1      HIS  40  77.922  -4.860   4.066
  293    HD1  HIS  40           HD1      HIS  40  79.485  -3.178   7.058
  294    HD2  HIS  40           HD2      HIS  40  75.768  -4.641   5.870
  295    HE1  HIS  40           HE1      HIS  40  78.020  -3.171   9.123
  296    H    ILE  41           HN       ILE  41  81.467  -3.558   2.839
  297    HA   ILE  41           HA       ILE  41  83.155  -1.888   4.341
  298    HB   ILE  41           HB       ILE  41  83.563  -2.560   1.982
  299   HG12  ILE  41          HG12      ILE  41  84.525  -0.384   3.172
  300   HG13  ILE  41          HG11      ILE  41  84.865  -0.720   1.490
  301   HG21  ILE  41          HG21      ILE  41  81.494  -2.305   0.902
  302   HG22  ILE  41          HG22      ILE  41  82.527  -1.050   0.206
  303   HG23  ILE  41          HG23      ILE  41  81.318  -0.628   1.432
  304   HD11  ILE  41          HD11      ILE  41  82.435   0.911   2.210
  305   HD12  ILE  41          HD12      ILE  41  83.303   0.853   0.695
  306   HD13  ILE  41          HD13      ILE  41  84.013   1.668   2.086
  307    H    GLY  42           HN       GLY  42  79.932  -1.247   3.009
  308    HA2  GLY  42           HA2      GLY  42  79.809   1.536   3.538
  309    HA3  GLY  42           HA1      GLY  42  78.418   0.454   3.545
  310    H    GLY  43           HN       GLY  43  79.885  -1.245   5.533
  311    HA2  GLY  43           HA2      GLY  43  78.761  -0.063   7.923
  312    HA3  GLY  43           HA1      GLY  43  79.718  -1.549   7.847
  313    H    VAL  44           HN       VAL  44  81.822  -0.001   6.282
  314    HA   VAL  44           HA       VAL  44  83.277   0.936   8.683
  315    HB   VAL  44           HB       VAL  44  83.986   0.260   5.848
  316   HG11  VAL  44          HG11      VAL  44  86.252   1.376   6.194
  317   HG12  VAL  44          HG12      VAL  44  85.510   2.286   7.509
  318   HG13  VAL  44          HG13      VAL  44  84.917   2.477   5.860
  319   HG21  VAL  44          HG21      VAL  44  84.308  -1.214   7.891
  320   HG22  VAL  44          HG22      VAL  44  85.557  -0.074   8.410
  321   HG23  VAL  44          HG23      VAL  44  85.749  -0.968   6.900
  322    H    MET  45           HN       MET  45  81.715   2.267   5.819
  323    HA   MET  45           HA       MET  45  82.641   4.932   5.898
  324    HB2  MET  45           HB2      MET  45  79.927   3.736   5.285
  325    HB3  MET  45           HB1      MET  45  80.190   5.470   5.185
  326    HG2  MET  45           HG2      MET  45  82.252   4.725   3.656
  327    HG3  MET  45           HG1      MET  45  81.260   3.285   3.414
  328    HE1  MET  45           HE1      MET  45  77.899   4.638   2.176
  329    HE2  MET  45           HE2      MET  45  78.689   3.596   3.365
  330    HE3  MET  45           HE3      MET  45  79.020   3.364   1.654
  331    H    LEU  46           HN       LEU  46  80.204   3.269   7.840
  332    HA   LEU  46           HA       LEU  46  79.461   5.659   9.318
  333    HB2  LEU  46           HB2      LEU  46  78.304   3.183   8.898
  334    HB3  LEU  46           HB1      LEU  46  78.823   3.048  10.575
  335    HG   LEU  46           HG       LEU  46  77.162   5.335   9.459
  336   HD11  LEU  46          HD11      LEU  46  75.243   4.313  10.222
  337   HD12  LEU  46          HD12      LEU  46  76.086   3.394  11.473
  338   HD13  LEU  46          HD13      LEU  46  76.162   2.869   9.793
  339   HD21  LEU  46          HD21      LEU  46  78.285   4.677  12.182
  340   HD22  LEU  46          HD22      LEU  46  76.833   5.664  12.027
  341   HD23  LEU  46          HD23      LEU  46  78.345   6.203  11.299
  342    H    LYS  47           HN       LYS  47  81.106   2.652  10.456
  343    HA   LYS  47           HA       LYS  47  81.762   3.485  13.022
  344    HB2  LYS  47           HB2      LYS  47  83.669   2.003  11.186
  345    HB3  LYS  47           HB1      LYS  47  83.687   1.992  12.949
  346    HG2  LYS  47           HG2      LYS  47  81.633   0.802  13.070
  347    HG3  LYS  47           HG1      LYS  47  81.279   1.108  11.372
  348    HD2  LYS  47           HD2      LYS  47  83.072  -0.345  10.657
  349    HD3  LYS  47           HD1      LYS  47  83.649  -0.519  12.314
  350    HE2  LYS  47           HE2      LYS  47  80.889  -1.382  11.421
  351    HE3  LYS  47           HE1      LYS  47  82.277  -2.469  11.473
  352    HZ1  LYS  47           HZ1      LYS  47  82.018  -0.994  13.892
  353    HZ2  LYS  47           HZ2      LYS  47  82.082  -2.675  13.657
  354    HZ3  LYS  47           HZ3      LYS  47  80.597  -1.856  13.555
  355    H    LEU  48           HN       LEU  48  83.885   3.979  10.180
  356    HA   LEU  48           HA       LEU  48  85.870   5.477  11.410
  357    HB2  LEU  48           HB2      LEU  48  84.852   5.157   8.688
  358    HB3  LEU  48           HB1      LEU  48  85.414   6.807   8.923
  359    HG   LEU  48           HG       LEU  48  87.075   4.423   9.730
  360   HD11  LEU  48          HD11      LEU  48  88.224   4.465   7.670
  361   HD12  LEU  48          HD12      LEU  48  87.378   5.922   7.141
  362   HD13  LEU  48          HD13      LEU  48  86.509   4.390   7.261
  363   HD21  LEU  48          HD21      LEU  48  87.803   6.498  10.719
  364   HD22  LEU  48          HD22      LEU  48  87.654   7.337   9.177
  365   HD23  LEU  48          HD23      LEU  48  88.911   6.122   9.404
  366    H    VAL  49           HN       VAL  49  83.016   6.990   9.828
  367    HA   VAL  49           HA       VAL  49  83.473   9.598  10.781
  368    HB   VAL  49           HB       VAL  49  80.878   8.143  10.245
  369   HG11  VAL  49          HG11      VAL  49  79.966  10.530  10.045
  370   HG12  VAL  49          HG12      VAL  49  81.415  11.049  10.906
  371   HG13  VAL  49          HG13      VAL  49  80.269   9.957  11.685
  372   HG21  VAL  49          HG21      VAL  49  82.614   8.597   8.396
  373   HG22  VAL  49          HG22      VAL  49  82.247  10.310   8.631
  374   HG23  VAL  49          HG23      VAL  49  80.979   9.201   8.104
  375    H    GLU  50           HN       GLU  50  81.577   6.998  12.382
  376    HA   GLU  50           HA       GLU  50  80.657   8.347  14.627
  377    HB2  GLU  50           HB2      GLU  50  81.867   5.572  14.514
  378    HB3  GLU  50           HB1      GLU  50  80.981   6.197  15.896
  379    HG2  GLU  50           HG2      GLU  50  79.797   6.189  13.120
  380    HG3  GLU  50           HG1      GLU  50  79.649   4.801  14.195
  381    H    LYS  51           HN       LYS  51  83.931   7.057  14.137
  382    HA   LYS  51           HA       LYS  51  84.937   7.753  16.711
  383    HB2  LYS  51           HB2      LYS  51  86.311   7.451  14.031
  384    HB3  LYS  51           HB1      LYS  51  87.165   7.617  15.566
  385    HG2  LYS  51           HG2      LYS  51  86.196   5.610  16.427
  386    HG3  LYS  51           HG1      LYS  51  85.064   5.498  15.087
  387    HD2  LYS  51           HD2      LYS  51  86.823   5.034  13.523
  388    HD3  LYS  51           HD1      LYS  51  88.054   5.342  14.750
  389    HE2  LYS  51           HE2      LYS  51  87.740   2.940  14.592
  390    HE3  LYS  51           HE1      LYS  51  87.059   3.502  16.114
  391    HZ1  LYS  51           HZ1      LYS  51  85.302   3.418  13.788
  392    HZ2  LYS  51           HZ2      LYS  51  84.942   3.180  15.431
  393    HZ3  LYS  51           HZ3      LYS  51  85.697   1.949  14.537
  394    H    LEU  52           HN       LEU  52  84.892   9.599  13.645
  395    HA   LEU  52           HA       LEU  52  86.335  11.825  14.616
  396    HB2  LEU  52           HB2      LEU  52  85.039  11.008  12.231
  397    HB3  LEU  52           HB1      LEU  52  84.265  12.515  12.673
  398    HG   LEU  52           HG       LEU  52  86.134  12.996  11.243
  399   HD11  LEU  52          HD11      LEU  52  85.697  14.292  13.545
  400   HD12  LEU  52          HD12      LEU  52  87.008  14.739  12.456
  401   HD13  LEU  52          HD13      LEU  52  87.342  13.742  13.868
  402   HD21  LEU  52          HD21      LEU  52  87.336  10.771  12.045
  403   HD22  LEU  52          HD22      LEU  52  88.133  11.863  13.176
  404   HD23  LEU  52          HD23      LEU  52  88.281  12.129  11.442
  405    H    ASP  53           HN       ASP  53  82.840  11.649  14.038
  406    HA   ASP  53           HA       ASP  53  81.033  12.351  15.318
  407    HB2  ASP  53           HB2      ASP  53  82.697  11.551  17.170
  408    HB3  ASP  53           HB1      ASP  53  82.864  13.262  17.504
  409    H    VAL  54           HN       VAL  54  80.886  13.986  13.721
  410    HA   VAL  54           HA       VAL  54  80.851  16.644  14.822
  411    HB   VAL  54           HB       VAL  54  83.208  16.615  14.497
  412   HG11  VAL  54          HG11      VAL  54  82.570  15.426  11.793
  413   HG12  VAL  54          HG12      VAL  54  83.408  14.647  13.138
  414   HG13  VAL  54          HG13      VAL  54  84.178  15.978  12.268
  415   HG21  VAL  54          HG21      VAL  54  81.949  18.625  13.590
  416   HG22  VAL  54          HG22      VAL  54  82.090  17.904  11.988
  417   HG23  VAL  54          HG23      VAL  54  83.540  18.374  12.873
  418    H    LYS  55           HN       LYS  55  79.517  17.958  13.602
  419    HA   LYS  55           HA       LYS  55  77.880  16.723  11.592
  420    HB2  LYS  55           HB2      LYS  55  77.339  18.690  13.196
  421    HB3  LYS  55           HB1      LYS  55  78.103  19.699  11.975
  422    HG2  LYS  55           HG2      LYS  55  75.853  19.725  11.329
  423    HG3  LYS  55           HG1      LYS  55  76.531  18.494  10.287
  424    HD2  LYS  55           HD2      LYS  55  75.533  16.736  11.515
  425    HD3  LYS  55           HD1      LYS  55  75.291  17.733  12.931
  426    HE2  LYS  55           HE2      LYS  55  73.497  18.921  11.947
  427    HE3  LYS  55           HE1      LYS  55  73.895  18.336  10.334
  428    HZ1  LYS  55           HZ1      LYS  55  73.442  16.044  11.268
  429    HZ2  LYS  55           HZ2      LYS  55  72.091  17.048  11.035
  430    HZ3  LYS  55           HZ3      LYS  55  72.730  16.826  12.594
  431    H    LYS  56           HN       LYS  56  80.779  16.740  10.907
  432    HA   LYS  56           HA       LYS  56  81.084  18.732   8.782
  433    HB2  LYS  56           HB2      LYS  56  83.089  17.993   9.889
  434    HB3  LYS  56           HB1      LYS  56  82.738  16.303   9.541
  435    HG2  LYS  56           HG2      LYS  56  83.253  16.528   7.261
  436    HG3  LYS  56           HG1      LYS  56  82.983  18.266   7.265
  437    HD2  LYS  56           HD2      LYS  56  85.316  18.151   7.153
  438    HD3  LYS  56           HD1      LYS  56  85.066  18.329   8.883
  439    HE2  LYS  56           HE2      LYS  56  86.708  16.537   8.339
  440    HE3  LYS  56           HE1      LYS  56  85.301  15.907   9.193
  441    HZ1  LYS  56           HZ1      LYS  56  85.282  15.965   6.257
  442    HZ2  LYS  56           HZ2      LYS  56  84.492  14.900   7.320
  443    HZ3  LYS  56           HZ3      LYS  56  86.163  14.749   7.047
  444    H    ASP  57           HN       ASP  57  80.777  18.421   6.599
  445    HA   ASP  57           HA       ASP  57  78.854  16.629   5.645
  446    HB2  ASP  57           HB2      ASP  57  81.155  18.005   4.251
  447    HB3  ASP  57           HB1      ASP  57  79.986  17.026   3.372
  448    H    TRP  58           HN       TRP  58  78.913  14.431   5.599
  449    HA   TRP  58           HA       TRP  58  81.542  13.066   5.174
  450    HB2  TRP  58           HB2      TRP  58  79.117  12.317   6.803
  451    HB3  TRP  58           HB1      TRP  58  80.390  11.176   6.410
  452    HD1  TRP  58           HD1      TRP  58  79.427  13.382   9.065
  453    HE1  TRP  58           HE1      TRP  58  81.421  14.107  10.526
  454    HE3  TRP  58           HE3      TRP  58  83.322  11.950   6.063
  455    HZ2  TRP  58           HZ2      TRP  58  84.266  14.097  10.438
  456    HZ3  TRP  58           HZ3      TRP  58  85.656  12.328   6.781
  457    HH2  TRP  58           HH2      TRP  58  86.137  13.394   8.962
  458    H    SER  59           HN       SER  59  78.235  13.332   4.147
  459    HA   SER  59           HA       SER  59  77.713  10.930   2.869
  460    HB2  SER  59           HB2      SER  59  75.978  12.345   2.418
  461    HB3  SER  59           HB1      SER  59  77.018  13.756   2.320
  462    HG   SER  59           HG       SER  59  77.244  13.437   0.236
  463    H    ASP  60           HN       ASP  60  79.502  13.631   1.375
  464    HA   ASP  60           HA       ASP  60  80.229  12.261  -1.000
  465    HB2  ASP  60           HB2      ASP  60  80.442  14.697  -0.682
  466    HB3  ASP  60           HB1      ASP  60  81.727  14.426   0.497
  467    H    HIS  61           HN       HIS  61  81.091  11.460   2.122
  468    HA   HIS  61           HA       HIS  61  83.857  10.738   1.674
  469    HB2  HIS  61           HB2      HIS  61  83.859   9.898   3.857
  470    HB3  HIS  61           HB1      HIS  61  82.715  11.217   3.935
  471    HD1  HIS  61           HD1      HIS  61  80.660   9.127   2.247
  472    HD2  HIS  61           HD2      HIS  61  82.222   8.770   6.087
  473    HE1  HIS  61           HE1      HIS  61  79.156   7.528   3.489
  474    H    ALA  62           HN       ALA  62  84.729   8.684   1.408
  475    HA   ALA  62           HA       ALA  62  83.158   6.301   1.159
  476    HB1  ALA  62           HB1      ALA  62  82.965   6.017  -1.159
  477    HB2  ALA  62           HB2      ALA  62  84.198   7.231  -1.513
  478    HB3  ALA  62           HB3      ALA  62  82.599   7.731  -0.965
  479    H    LEU  63           HN       LEU  63  84.568   4.466   0.797
  480    HA   LEU  63           HA       LEU  63  87.431   5.144   1.265
  481    HB2  LEU  63           HB2      LEU  63  86.018   2.459   1.334
  482    HB3  LEU  63           HB1      LEU  63  87.699   2.733   1.738
  483    HG   LEU  63           HG       LEU  63  86.175   2.527   3.713
  484   HD11  LEU  63          HD11      LEU  63  87.270   4.217   4.981
  485   HD12  LEU  63          HD12      LEU  63  87.471   5.239   3.567
  486   HD13  LEU  63          HD13      LEU  63  88.392   3.748   3.707
  487   HD21  LEU  63          HD21      LEU  63  84.588   4.170   4.277
  488   HD22  LEU  63          HD22      LEU  63  84.310   3.922   2.558
  489   HD23  LEU  63          HD23      LEU  63  85.227   5.326   3.113
  490    H    TRP  64           HN       TRP  64  89.040   4.491  -0.143
  491    HA   TRP  64           HA       TRP  64  88.164   3.233  -2.733
  492    HB2  TRP  64           HB2      TRP  64  88.687   5.148  -3.835
  493    HB3  TRP  64           HB1      TRP  64  89.029   5.921  -2.311
  494    HD1  TRP  64           HD1      TRP  64  91.745   4.963  -1.436
  495    HE1  TRP  64           HE1      TRP  64  93.858   5.275  -2.861
  496    HE3  TRP  64           HE3      TRP  64  89.619   5.613  -6.029
  497    HZ2  TRP  64           HZ2      TRP  64  94.565   5.773  -5.588
  498    HZ3  TRP  64           HZ3      TRP  64  91.035   6.025  -8.021
  499    HH2  TRP  64           HH2      TRP  64  93.502   6.108  -7.807
  500    H    TRP  65           HN       TRP  65  89.615   1.739  -3.586
  501    HA   TRP  65           HA       TRP  65  91.818   0.935  -1.731
  502    HB2  TRP  65           HB2      TRP  65  89.924  -0.671  -2.436
  503    HB3  TRP  65           HB1      TRP  65  90.703  -0.704  -4.015
  504    HD1  TRP  65           HD1      TRP  65  93.583  -0.365  -1.999
  505    HE1  TRP  65           HE1      TRP  65  94.615  -2.621  -1.325
  506    HE3  TRP  65           HE3      TRP  65  89.644  -3.468  -2.954
  507    HZ2  TRP  65           HZ2      TRP  65  93.883  -5.368  -1.199
  508    HZ3  TRP  65           HZ3      TRP  65  89.848  -5.911  -2.546
  509    HH2  TRP  65           HH2      TRP  65  91.958  -6.859  -1.668
  510    H    GLU  66           HN       GLU  66  93.442   2.409  -2.525
  511    HA   GLU  66           HA       GLU  66  93.992   2.952  -5.225
  512    HB2  GLU  66           HB2      GLU  66  96.355   3.412  -4.464
  513    HB3  GLU  66           HB1      GLU  66  95.092   4.260  -3.590
  514    HG2  GLU  66           HG2      GLU  66  95.163   2.459  -1.848
  515    HG3  GLU  66           HG1      GLU  66  96.531   1.774  -2.711
  516    H    LYS  67           HN       LYS  67  94.670  -0.018  -3.488
  517    HA   LYS  67           HA       LYS  67  96.769  -0.938  -5.228
  518    HB2  LYS  67           HB2      LYS  67  94.650  -2.466  -3.730
  519    HB3  LYS  67           HB1      LYS  67  95.901  -3.242  -4.665
  520    HG2  LYS  67           HG2      LYS  67  96.237  -2.891  -2.094
  521    HG3  LYS  67           HG1      LYS  67  97.578  -2.685  -3.180
  522    HD2  LYS  67           HD2      LYS  67  97.391  -0.298  -3.083
  523    HD3  LYS  67           HD1      LYS  67  95.863  -0.398  -2.217
  524    HE2  LYS  67           HE2      LYS  67  96.956  -0.474  -0.231
  525    HE3  LYS  67           HE1      LYS  67  97.867  -1.889  -0.753
  526    HZ1  LYS  67           HZ1      LYS  67  99.340  -0.318  -1.984
  527    HZ2  LYS  67           HZ2      LYS  67  99.408  -0.180  -0.292
  528    HZ3  LYS  67           HZ3      LYS  67  98.542   0.961  -1.206
  529    H    LYS  68           HN       LYS  68  93.417  -0.427  -5.418
  530    HA   LYS  68           HA       LYS  68  93.187  -1.731  -8.097
  531    HB2  LYS  68           HB2      LYS  68  90.772  -1.137  -6.405
  532    HB3  LYS  68           HB1      LYS  68  91.020  -2.425  -7.578
  533    HG2  LYS  68           HG2      LYS  68  92.542  -2.375  -4.952
  534    HG3  LYS  68           HG1      LYS  68  90.944  -3.077  -5.081
  535    HD2  LYS  68           HD2      LYS  68  91.655  -4.700  -6.668
  536    HD3  LYS  68           HD1      LYS  68  93.186  -3.869  -6.940
  537    HE2  LYS  68           HE2      LYS  68  94.107  -4.639  -4.954
  538    HE3  LYS  68           HE1      LYS  68  92.551  -4.786  -4.150
  539    HZ1  LYS  68           HZ1      LYS  68  93.993  -6.792  -5.375
  540    HZ2  LYS  68           HZ2      LYS  68  92.677  -6.493  -6.407
  541    HZ3  LYS  68           HZ3      LYS  68  92.409  -6.890  -4.777
  542    H    ARG  69           HN       ARG  69  93.126   1.204  -6.361
  543    HA   ARG  69           HA       ARG  69  92.435   3.373  -6.928
  544    HB2  ARG  69           HB2      ARG  69  92.921   2.137  -9.655
  545    HB3  ARG  69           HB1      ARG  69  92.402   3.806  -9.477
  546    HG2  ARG  69           HG2      ARG  69  94.720   4.062  -9.546
  547    HG3  ARG  69           HG1      ARG  69  94.445   3.978  -7.810
  548    HD2  ARG  69           HD2      ARG  69  96.173   2.444  -8.054
  549    HD3  ARG  69           HD1      ARG  69  94.779   1.382  -8.196
  550    HE   ARG  69           HE       ARG  69  96.501   2.306 -10.445
  551   HH11  ARG  69          HH11      ARG  69  96.371   1.041 -12.294
  552   HH12  ARG  69          HH12      ARG  69  95.177  -0.209 -12.400
  553   HH21  ARG  69          HH21      ARG  69  93.851   0.399  -9.266
  554   HH22  ARG  69          HH22      ARG  69  93.762  -0.570 -10.695
  555    H    THR  70           HN       THR  70  90.427   1.689  -6.158
  556    HA   THR  70           HA       THR  70  88.201   2.190  -8.115
  557    HB   THR  70           HB       THR  70  88.837  -0.185  -7.368
  558    HG1  THR  70           HG1      THR  70  86.838  -0.652  -7.817
  559   HG21  THR  70          HG21      THR  70  87.258   0.451  -4.898
  560   HG22  THR  70          HG22      THR  70  89.012   0.635  -4.910
  561   HG23  THR  70          HG23      THR  70  88.289  -0.942  -5.226
  562    H    TRP  71           HN       TRP  71  86.058   2.049  -6.633
  563    HA   TRP  71           HA       TRP  71  86.360   3.891  -4.313
  564    HB2  TRP  71           HB2      TRP  71  84.046   4.797  -5.097
  565    HB3  TRP  71           HB1      TRP  71  85.495   5.414  -5.868
  566    HD1  TRP  71           HD1      TRP  71  84.405   1.931  -6.907
  567    HE1  TRP  71           HE1      TRP  71  83.423   2.024  -9.243
  568    HE3  TRP  71           HE3      TRP  71  84.164   6.991  -7.569
  569    HZ2  TRP  71           HZ2      TRP  71  82.646   3.960 -11.202
  570    HZ3  TRP  71           HZ3      TRP  71  83.300   7.929  -9.694
  571    HH2  TRP  71           HH2      TRP  71  82.541   6.421 -11.511
  572    H    LEU  72           HN       LEU  72  86.068   2.328  -2.813
  573    HA   LEU  72           HA       LEU  72  84.349   0.109  -3.124
  574    HB2  LEU  72           HB2      LEU  72  85.175   1.399  -0.529
  575    HB3  LEU  72           HB1      LEU  72  84.660  -0.272  -0.763
  576    HG   LEU  72           HG       LEU  72  87.008   0.897  -2.228
  577   HD11  LEU  72          HD11      LEU  72  86.924  -0.385   0.484
  578   HD12  LEU  72          HD12      LEU  72  87.617   1.176   0.037
  579   HD13  LEU  72          HD13      LEU  72  88.393  -0.317  -0.492
  580   HD21  LEU  72          HD21      LEU  72  86.013  -1.895  -1.672
  581   HD22  LEU  72          HD22      LEU  72  87.662  -1.579  -2.209
  582   HD23  LEU  72          HD23      LEU  72  86.305  -1.133  -3.237
  583    H    LEU  73           HN       LEU  73  82.457   0.717  -3.869
  584    HA   LEU  73           HA       LEU  73  80.558   2.052  -1.989
  585    HB2  LEU  73           HB2      LEU  73  79.318   2.855  -4.030
  586    HB3  LEU  73           HB1      LEU  73  80.902   3.589  -3.818
  587    HG   LEU  73           HG       LEU  73  81.610   1.474  -5.396
  588   HD11  LEU  73          HD11      LEU  73  78.968   2.288  -6.609
  589   HD12  LEU  73          HD12      LEU  73  79.051   0.925  -5.503
  590   HD13  LEU  73          HD13      LEU  73  79.990   0.904  -6.997
  591   HD21  LEU  73          HD21      LEU  73  80.442   4.074  -6.441
  592   HD22  LEU  73          HD22      LEU  73  81.593   3.039  -7.282
  593   HD23  LEU  73          HD23      LEU  73  82.075   3.882  -5.814
  594    H    LYS  74           HN       LYS  74  81.471  -0.800  -3.162
  595    HA   LYS  74           HA       LYS  74  78.874  -1.876  -3.998
  596    HB2  LYS  74           HB2      LYS  74  81.656  -2.971  -3.656
  597    HB3  LYS  74           HB1      LYS  74  80.312  -4.101  -3.669
  598    HG2  LYS  74           HG2      LYS  74  81.217  -3.831  -5.932
  599    HG3  LYS  74           HG1      LYS  74  79.569  -3.222  -5.845
  600    HD2  LYS  74           HD2      LYS  74  81.000  -1.665  -7.097
  601    HD3  LYS  74           HD1      LYS  74  80.425  -0.924  -5.609
  602    HE2  LYS  74           HE2      LYS  74  82.960  -0.711  -6.251
  603    HE3  LYS  74           HE1      LYS  74  82.518  -1.044  -4.581
  604    HZ1  LYS  74           HZ1      LYS  74  84.300  -2.485  -5.733
  605    HZ2  LYS  74           HZ2      LYS  74  82.973  -3.270  -6.448
  606    HZ3  LYS  74           HZ3      LYS  74  83.135  -3.238  -4.757
  607    H    THR  75           HN       THR  75  78.830  -0.636  -1.438
  608    HA   THR  75           HA       THR  75  79.224  -2.169   0.833
  609    HB   THR  75           HB       THR  75  77.521  -0.902   1.881
  610    HG1  THR  75           HG1      THR  75  75.824  -0.014   0.718
  611   HG21  THR  75          HG21      THR  75  78.012   0.996  -0.360
  612   HG22  THR  75          HG22      THR  75  79.443   0.338   0.431
  613   HG23  THR  75          HG23      THR  75  78.246   1.221   1.367
  614    H    HIS  76           HN       HIS  76  77.181  -2.946  -1.817
  615    HA   HIS  76           HA       HIS  76  75.316  -4.621  -0.322
  616    HB2  HIS  76           HB2      HIS  76  75.912  -4.308  -3.273
  617    HB3  HIS  76           HB1      HIS  76  74.694  -5.422  -2.651
  618    HD1  HIS  76           HD1      HIS  76  75.516  -1.826  -1.659
  619    HD2  HIS  76           HD2      HIS  76  72.287  -4.113  -2.969
  620    HE1  HIS  76           HE1      HIS  76  73.502  -0.290  -1.654
  621    H    TRP  77           HN       TRP  77  77.966  -5.354   0.336
  622    HA   TRP  77           HA       TRP  77  77.865  -8.164  -0.050
  623    HB2  TRP  77           HB2      TRP  77  79.008  -6.700  -2.255
  624    HB3  TRP  77           HB1      TRP  77  80.277  -7.621  -1.496
  625    HD1  TRP  77           HD1      TRP  77  77.978  -8.000  -4.164
  626    HE1  TRP  77           HE1      TRP  77  77.370 -10.465  -4.615
  627    HE3  TRP  77           HE3      TRP  77  79.641 -10.126   0.168
  628    HZ2  TRP  77           HZ2      TRP  77  77.563 -13.004  -3.308
  629    HZ3  TRP  77           HZ3      TRP  77  79.418 -12.565   0.541
  630    HH2  TRP  77           HH2      TRP  77  78.382 -14.006  -1.191
  631    H    THR  78           HN       THR  78  81.080  -8.203  -0.047
  632    HA   THR  78           HA       THR  78  81.515  -6.763   2.491
  633    HB   THR  78           HB       THR  78  82.327  -9.542   2.899
  634    HG1  THR  78           HG1      THR  78  80.619 -10.572   2.320
  635   HG21  THR  78          HG21      THR  78  82.032  -8.255   4.827
  636   HG22  THR  78          HG22      THR  78  80.591  -9.272   4.799
  637   HG23  THR  78          HG23      THR  78  80.485  -7.594   4.290
  638    H    LEU  79           HN       LEU  79  83.725  -7.087   3.283
  639    HA   LEU  79           HA       LEU  79  85.760  -6.398   1.535
  640    HB2  LEU  79           HB2      LEU  79  85.802  -7.992   4.091
  641    HB3  LEU  79           HB1      LEU  79  87.295  -7.596   3.262
  642    HG   LEU  79           HG       LEU  79  86.921  -5.233   3.580
  643   HD11  LEU  79          HD11      LEU  79  84.517  -5.112   3.195
  644   HD12  LEU  79          HD12      LEU  79  84.866  -4.454   4.794
  645   HD13  LEU  79          HD13      LEU  79  84.223  -6.083   4.638
  646   HD21  LEU  79          HD21      LEU  79  86.772  -5.130   6.062
  647   HD22  LEU  79          HD22      LEU  79  87.808  -6.457   5.528
  648   HD23  LEU  79          HD23      LEU  79  86.164  -6.789   6.078
  649    H    ASP  80           HN       ASP  80  85.192  -9.605   2.881
  650    HA   ASP  80           HA       ASP  80  86.934 -11.183   1.435
  651    HB2  ASP  80           HB2      ASP  80  85.201 -11.794   3.214
  652    HB3  ASP  80           HB1      ASP  80  84.061 -11.974   1.887
  653    H    LYS  81           HN       LYS  81  83.812  -9.921   0.306
  654    HA   LYS  81           HA       LYS  81  83.758 -11.502  -2.040
  655    HB2  LYS  81           HB2      LYS  81  81.668 -10.660  -1.975
  656    HB3  LYS  81           HB1      LYS  81  82.166  -9.395  -0.875
  657    HG2  LYS  81           HG2      LYS  81  82.760  -9.156  -3.818
  658    HG3  LYS  81           HG1      LYS  81  81.171  -8.765  -3.219
  659    HD2  LYS  81           HD2      LYS  81  82.450  -7.274  -1.500
  660    HD3  LYS  81           HD1      LYS  81  83.782  -7.444  -2.591
  661    HE2  LYS  81           HE2      LYS  81  82.145  -6.705  -4.441
  662    HE3  LYS  81           HE1      LYS  81  81.117  -6.199  -3.109
  663    HZ1  LYS  81           HZ1      LYS  81  83.776  -5.316  -2.705
  664    HZ2  LYS  81           HZ2      LYS  81  82.347  -4.401  -2.796
  665    HZ3  LYS  81           HZ3      LYS  81  83.206  -4.785  -4.211
  666    H    TYR  82           HN       TYR  82  85.321  -8.422  -1.329
  667    HA   TYR  82           HA       TYR  82  86.299  -8.335  -4.154
  668    HB2  TYR  82           HB2      TYR  82  85.749  -6.301  -2.256
  669    HB3  TYR  82           HB1      TYR  82  87.498  -6.305  -2.416
  670    HD1  TYR  82           HD1      TYR  82  88.431  -5.025  -4.148
  671    HD2  TYR  82           HD2      TYR  82  84.450  -6.542  -4.600
  672    HE1  TYR  82           HE1      TYR  82  88.233  -3.850  -6.319
  673    HE2  TYR  82           HE2      TYR  82  84.243  -5.369  -6.768
  674    HH   TYR  82           HH       TYR  82  86.996  -3.672  -8.202
  675    H    GLY  83           HN       GLY  83  87.506  -8.818  -0.845
  676    HA2  GLY  83           HA2      GLY  83  89.303 -10.558  -0.628
  677    HA3  GLY  83           HA1      GLY  83  90.074  -9.849  -2.047
  678    H    ILE  84           HN       ILE  84  88.637  -7.542  -0.013
  679    HA   ILE  84           HA       ILE  84  91.106  -6.245   0.573
  680    HB   ILE  84           HB       ILE  84  88.410  -6.028   1.949
  681   HG12  ILE  84          HG12      ILE  84  89.601  -4.130  -0.078
  682   HG13  ILE  84          HG11      ILE  84  88.658  -5.527  -0.574
  683   HG21  ILE  84          HG21      ILE  84  89.193  -3.843   2.721
  684   HG22  ILE  84          HG22      ILE  84  90.743  -4.087   1.921
  685   HG23  ILE  84          HG23      ILE  84  90.289  -5.084   3.297
  686   HD11  ILE  84          HD11      ILE  84  87.488  -3.745   1.542
  687   HD12  ILE  84          HD12      ILE  84  86.679  -4.685   0.284
  688   HD13  ILE  84          HD13      ILE  84  87.483  -3.174  -0.128
  689    H    GLN  85           HN       GLN  85  92.141  -6.039   2.670
  690    HA   GLN  85           HA       GLN  85  91.481  -7.750   4.887
  691    HB2  GLN  85           HB2      GLN  85  92.578  -9.228   2.899
  692    HB3  GLN  85           HB1      GLN  85  94.059  -8.656   3.654
  693    HG2  GLN  85           HG2      GLN  85  93.709 -10.578   4.912
  694    HG3  GLN  85           HG1      GLN  85  92.817  -9.417   5.893
  695   HE21  GLN  85          HE21      GLN  85  90.486  -9.105   4.377
  696   HE22  GLN  85          HE22      GLN  85  89.649 -10.572   4.318
  697    H    ALA  86           HN       ALA  86  93.775  -7.952   6.225
  698    HA   ALA  86           HA       ALA  86  94.413  -5.299   7.016
  699    HB1  ALA  86           HB1      ALA  86  95.731  -7.974   7.440
  700    HB2  ALA  86           HB2      ALA  86  94.802  -7.020   8.599
  701    HB3  ALA  86           HB3      ALA  86  96.419  -6.499   8.123
  702    H    ASP  87           HN       ASP  87  95.733  -7.350   4.533
  703    HA   ASP  87           HA       ASP  87  98.190  -5.785   4.242
  704    HB2  ASP  87           HB2      ASP  87  98.335  -7.170   2.077
  705    HB3  ASP  87           HB1      ASP  87  98.379  -8.066   3.597
  706    H    ALA  88           HN       ALA  88  94.986  -5.321   3.485
  707    HA   ALA  88           HA       ALA  88  95.510  -3.775   0.995
  708    HB1  ALA  88           HB1      ALA  88  93.606  -5.380   1.114
  709    HB2  ALA  88           HB2      ALA  88  93.075  -3.722   0.812
  710    HB3  ALA  88           HB3      ALA  88  92.932  -4.421   2.426
  711    H    LYS  89           HN       LYS  89  96.139  -1.674   1.415
  712    HA   LYS  89           HA       LYS  89  95.031  -0.301   3.821
  713    HB2  LYS  89           HB2      LYS  89  97.061   0.937   1.979
  714    HB3  LYS  89           HB1      LYS  89  96.825   1.183   3.709
  715    HG2  LYS  89           HG2      LYS  89  97.854  -1.384   2.460
  716    HG3  LYS  89           HG1      LYS  89  98.859  -0.143   3.179
  717    HD2  LYS  89           HD2      LYS  89  98.008  -0.533   5.359
  718    HD3  LYS  89           HD1      LYS  89  96.646  -1.465   4.747
  719    HE2  LYS  89           HE2      LYS  89  98.367  -2.950   5.682
  720    HE3  LYS  89           HE1      LYS  89  98.161  -3.209   3.950
  721    HZ1  LYS  89           HZ1      LYS  89 100.131  -1.221   4.747
  722    HZ2  LYS  89           HZ2      LYS  89 100.179  -2.354   3.482
  723    HZ3  LYS  89           HZ3      LYS  89 100.524  -2.838   5.074
  724    H    LEU  90           HN       LEU  90  93.272   0.771   3.559
  725    HA   LEU  90           HA       LEU  90  92.540   1.873   0.886
  726    HB2  LEU  90           HB2      LEU  90  90.683   1.928   3.246
  727    HB3  LEU  90           HB1      LEU  90  90.305   1.772   1.535
  728    HG   LEU  90           HG       LEU  90  91.614  -0.335   3.264
  729   HD11  LEU  90          HD11      LEU  90  88.824   0.039   2.171
  730   HD12  LEU  90          HD12      LEU  90  89.314  -0.242   3.842
  731   HD13  LEU  90          HD13      LEU  90  89.429  -1.541   2.659
  732   HD21  LEU  90          HD21      LEU  90  92.430  -0.486   0.974
  733   HD22  LEU  90          HD22      LEU  90  90.791  -0.324   0.344
  734   HD23  LEU  90          HD23      LEU  90  91.255  -1.774   1.234
  735    H    GLN  91           HN       GLN  91  91.152   3.981   1.204
  736    HA   GLN  91           HA       GLN  91  92.536   5.848   3.083
  737    HB2  GLN  91           HB2      GLN  91  91.689   6.547   0.258
  738    HB3  GLN  91           HB1      GLN  91  92.608   7.552   1.371
  739    HG2  GLN  91           HG2      GLN  91  94.572   6.308   1.096
  740    HG3  GLN  91           HG1      GLN  91  93.718   4.872   0.566
  741   HE21  GLN  91          HE21      GLN  91  92.540   7.728  -0.841
  742   HE22  GLN  91          HE22      GLN  91  93.291   7.561  -2.347
  743    H    PHE  92           HN       PHE  92  91.164   7.864   3.357
  744    HA   PHE  92           HA       PHE  92  88.245   7.330   2.982
  745    HB2  PHE  92           HB2      PHE  92  88.875   6.680   5.250
  746    HB3  PHE  92           HB1      PHE  92  89.648   8.224   5.518
  747    HD1  PHE  92           HD1      PHE  92  88.424   9.525   7.026
  748    HD2  PHE  92           HD2      PHE  92  86.290   7.127   4.174
  749    HE1  PHE  92           HE1      PHE  92  86.291  10.377   7.915
  750    HE2  PHE  92           HE2      PHE  92  84.155   7.973   5.075
  751    HZ   PHE  92           HZ       PHE  92  84.157   9.609   6.948
  752    H    THR  93           HN       THR  93  88.086   8.811   1.356
  753    HA   THR  93           HA       THR  93  88.664  11.669   2.097
  754    HB   THR  93           HB       THR  93  90.372  11.396   0.567
  755    HG1  THR  93           HG1      THR  93  89.667  12.040  -1.472
  756   HG21  THR  93          HG21      THR  93  90.274   9.063   0.206
  757   HG22  THR  93          HG22      THR  93  90.100   9.755  -1.406
  758   HG23  THR  93          HG23      THR  93  88.681   9.159  -0.545
  759    HA   PRO  94           HA       PRO  94  84.569  12.619   0.653
  760    HB2  PRO  94           HB2      PRO  94  84.930  15.135  -0.380
  761    HB3  PRO  94           HB1      PRO  94  84.932  14.794   1.362
  762    HG2  PRO  94           HG2      PRO  94  87.251  15.135  -0.495
  763    HG3  PRO  94           HG1      PRO  94  87.011  15.792   1.136
  764    HD2  PRO  94           HD2      PRO  94  88.553  13.611   0.707
  765    HD3  PRO  94           HD1      PRO  94  87.571  13.781   2.176
  766    H    TYR 541           HT1      TYR 541  43.264  35.748  10.623
  767    HA   TYR 541           HA       TYR 541  43.332  34.241   8.916
  768    HB2  TYR 541           HB2      TYR 541  41.354  35.966   7.399
  769    HB3  TYR 541           HB1      TYR 541  41.903  34.348   6.962
  770    HD1  TYR 541           HD1      TYR 541  39.875  36.311   9.351
  771    HD2  TYR 541           HD2      TYR 541  41.050  32.379   8.081
  772    HE1  TYR 541           HE1      TYR 541  38.069  35.325  10.734
  773    HE2  TYR 541           HE2      TYR 541  39.244  31.392   9.466
  774    HH   TYR 541           HH       TYR 541  36.711  32.830  10.475
  775    H    HIS 542           HN       HIS 542  45.078  36.319   9.460
  776    HA   HIS 542           HA       HIS 542  45.585  37.983   7.159
  777    HB2  HIS 542           HB2      HIS 542  47.326  37.166   9.501
  778    HB3  HIS 542           HB1      HIS 542  47.778  38.373   8.304
  779    HD1  HIS 542           HD1      HIS 542  46.326  40.582   8.220
  780    HD2  HIS 542           HD2      HIS 542  45.460  38.049  11.416
  781    HE1  HIS 542           HE1      HIS 542  44.941  41.936   9.852
  782    H    GLU 543           HN       GLU 543  48.355  36.225   8.233
  783    HA   GLU 543           HA       GLU 543  48.287  34.411   5.872
  784    HB2  GLU 543           HB2      GLU 543  50.685  35.148   5.368
  785    HB3  GLU 543           HB1      GLU 543  49.414  36.293   4.936
  786    HG2  GLU 543           HG2      GLU 543  49.837  37.640   6.864
  787    HG3  GLU 543           HG1      GLU 543  50.857  36.398   7.592
  788    H    ARG 544           HN       ARG 544  48.944  34.869   9.115
  789    HA   ARG 544           HA       ARG 544  50.061  33.635  10.739
  790    HB2  ARG 544           HB2      ARG 544  49.334  31.675   8.591
  791    HB3  ARG 544           HB1      ARG 544  50.245  31.116   9.985
  792    HG2  ARG 544           HG2      ARG 544  48.079  30.757  10.753
  793    HG3  ARG 544           HG1      ARG 544  48.323  32.398  11.334
  794    HD2  ARG 544           HD2      ARG 544  46.286  32.650  10.249
  795    HD3  ARG 544           HD1      ARG 544  47.387  33.021   8.920
  796    HE   ARG 544           HE       ARG 544  47.053  30.290   8.720
  797   HH11  ARG 544          HH11      ARG 544  45.402  29.340   7.503
  798   HH12  ARG 544          HH12      ARG 544  43.944  30.228   7.206
  799   HH21  ARG 544          HH21      ARG 544  44.981  33.033   8.961
  800   HH22  ARG 544          HH22      ARG 544  43.706  32.319   8.030
  801    H    ARG 545           HN       ARG 545  52.165  33.834  11.261
  802    HA   ARG 545           HA       ARG 545  54.302  34.282   9.562
  803    HB2  ARG 545           HB2      ARG 545  54.457  32.735  12.165
  804    HB3  ARG 545           HB1      ARG 545  55.742  33.673  11.417
  805    HG2  ARG 545           HG2      ARG 545  53.111  34.788  12.414
  806    HG3  ARG 545           HG1      ARG 545  54.654  34.911  13.247
  807    HD2  ARG 545           HD2      ARG 545  55.493  35.991  11.011
  808    HD3  ARG 545           HD1      ARG 545  53.774  36.247  10.702
  809    HE   ARG 545           HE       ARG 545  54.144  37.224  13.269
  810   HH11  ARG 545          HH11      ARG 545  54.689  39.378  13.684
  811   HH12  ARG 545          HH12      ARG 545  55.499  40.302  12.464
  812   HH21  ARG 545          HH21      ARG 545  55.581  37.701  10.173
  813   HH22  ARG 545          HH22      ARG 545  56.005  39.352  10.477
  814    H    GLY 546           HN       GLY 546  54.726  31.269  11.303
  815    HA2  GLY 546           HA2      GLY 546  54.480  29.618   8.889
  816    HA3  GLY 546           HA1      GLY 546  56.138  29.855   9.445
  817    H    SER 547           HN       SER 547  56.876  28.573  11.087
  818    HA   SER 547           HA       SER 547  55.047  27.377  13.033
  819    HB2  SER 547           HB2      SER 547  56.194  25.806  10.749
  820    HB3  SER 547           HB1      SER 547  56.091  25.027  12.326
  821    HG   SER 547           HG       SER 547  54.137  25.608  10.538
  822    H    LEU 548           HN       LEU 548  56.247  27.663  14.863
  823    HA   LEU 548           HA       LEU 548  59.029  28.185  14.832
  824    HB2  LEU 548           HB2      LEU 548  56.944  27.732  16.879
  825    HB3  LEU 548           HB1      LEU 548  58.566  27.315  17.416
  826    HG   LEU 548           HG       LEU 548  59.307  29.606  16.573
  827   HD11  LEU 548          HD11      LEU 548  57.332  31.268  16.502
  828   HD12  LEU 548          HD12      LEU 548  56.326  29.851  16.219
  829   HD13  LEU 548          HD13      LEU 548  57.608  30.262  15.088
  830   HD21  LEU 548          HD21      LEU 548  58.688  28.992  18.991
  831   HD22  LEU 548          HD22      LEU 548  57.167  29.825  18.678
  832   HD23  LEU 548          HD23      LEU 548  58.695  30.702  18.563
  833    H    CYS 549           HN       CYS 549  60.823  26.895  14.970
  834    HA   CYS 549           HA       CYS 549  60.403  23.994  14.677
  835    HB2  CYS 549           HB2      CYS 549  62.174  24.775  13.326
  836    HB3  CYS 549           HB1      CYS 549  62.747  25.890  14.552
  837    H    SER 550           HN       SER 550  59.771  23.156  16.600
  838    HA   SER 550           HA       SER 550  60.307  24.109  19.155
  839    HB2  SER 550           HB2      SER 550  58.660  22.441  18.962
  840    HB3  SER 550           HB1      SER 550  59.768  21.286  18.232
  841    HG   SER 550           HG       SER 550  60.341  22.358  20.762
  842    H    GLY 551           HN       GLY 551  62.008  24.271  20.341
  843    HA2  GLY 551           HA2      GLY 551  64.069  23.295  21.335
  844    HA3  GLY 551           HA1      GLY 551  64.434  22.611  19.745
  845    H    CYS 552           HN       CYS 552  63.499  24.875  18.291
  846    HA   CYS 552           HA       CYS 552  65.745  26.793  18.756
  847    HB2  CYS 552           HB2      CYS 552  64.174  25.851  16.370
  848    HB3  CYS 552           HB1      CYS 552  64.937  27.431  16.329
  849    H    GLN 553           HN       GLN 553  62.311  26.366  18.218
  850    HA   GLN 553           HA       GLN 553  60.525  27.774  18.415
  851    HB2  GLN 553           HB2      GLN 553  62.313  29.037  20.473
  852    HB3  GLN 553           HB1      GLN 553  60.604  29.431  20.261
  853    HG2  GLN 553           HG2      GLN 553  61.635  26.632  20.732
  854    HG3  GLN 553           HG1      GLN 553  61.029  27.669  22.009
  855   HE21  GLN 553          HE21      GLN 553  60.099  25.944  19.061
  856   HE22  GLN 553          HE22      GLN 553  58.433  25.908  19.389
  857    H    LYS 554           HN       LYS 554  61.597  28.237  16.264
  858    HA   LYS 554           HA       LYS 554  61.468  31.170  15.874
  859    HB2  LYS 554           HB2      LYS 554  63.571  29.371  14.641
  860    HB3  LYS 554           HB1      LYS 554  63.303  31.046  14.181
  861    HG2  LYS 554           HG2      LYS 554  64.018  30.140  16.982
  862    HG3  LYS 554           HG1      LYS 554  65.186  30.742  15.811
  863    HD2  LYS 554           HD2      LYS 554  63.558  32.815  15.672
  864    HD3  LYS 554           HD1      LYS 554  62.987  32.227  17.232
  865    HE2  LYS 554           HE2      LYS 554  65.467  32.174  17.925
  866    HE3  LYS 554           HE1      LYS 554  65.760  33.159  16.491
  867    HZ1  LYS 554           HZ1      LYS 554  65.285  34.319  18.718
  868    HZ2  LYS 554           HZ2      LYS 554  63.662  33.913  18.419
  869    HZ3  LYS 554           HZ3      LYS 554  64.511  34.895  17.323
  870    HA   PRO 555           HA       PRO 555  58.311  29.486  13.072
  871    HB2  PRO 555           HB2      PRO 555  58.948  31.868  11.425
  872    HB3  PRO 555           HB1      PRO 555  57.388  31.297  12.020
  873    HG2  PRO 555           HG2      PRO 555  58.740  33.426  13.118
  874    HG3  PRO 555           HG1      PRO 555  57.589  32.434  14.019
  875    HD2  PRO 555           HD2      PRO 555  60.520  32.578  14.323
  876    HD3  PRO 555           HD1      PRO 555  59.322  31.839  15.415
  877    H    ILE 556           HN       ILE 556  58.416  28.093  11.475
  878    HA   ILE 556           HA       ILE 556  60.898  27.830   9.870
  879    HB   ILE 556           HB       ILE 556  58.476  26.052  10.310
  880   HG12  ILE 556          HG12      ILE 556  61.317  25.386  11.077
  881   HG13  ILE 556          HG11      ILE 556  60.389  26.439  12.123
  882   HG21  ILE 556          HG21      ILE 556  59.263  25.593   8.104
  883   HG22  ILE 556          HG22      ILE 556  59.942  24.342   9.144
  884   HG23  ILE 556          HG23      ILE 556  60.950  25.685   8.612
  885   HD11  ILE 556          HD11      ILE 556  58.965  23.969  11.265
  886   HD12  ILE 556          HD12      ILE 556  59.036  24.736  12.851
  887   HD13  ILE 556          HD13      ILE 556  60.361  23.715  12.308
  888    H    THR 557           HN       THR 557  60.639  29.380   8.212
  889    HA   THR 557           HA       THR 557  58.060  29.412   6.714
  890    HB   THR 557           HB       THR 557  58.657  31.560   5.981
  891    HG1  THR 557           HG1      THR 557  60.642  32.030   5.505
  892   HG21  THR 557          HG21      THR 557  58.282  31.264   8.485
  893   HG22  THR 557          HG22      THR 557  59.144  32.731   8.011
  894   HG23  THR 557          HG23      THR 557  60.034  31.354   8.663
  895    H    GLY 558           HN       GLY 558  58.299  27.546   5.497
  896    HA2  GLY 558           HA2      GLY 558  59.127  27.615   2.907
  897    HA3  GLY 558           HA1      GLY 558  60.607  27.128   3.746
  898    H    ARG 559           HN       ARG 559  60.718  25.109   4.673
  899    HA   ARG 559           HA       ARG 559  58.432  23.241   4.179
  900    HB2  ARG 559           HB2      ARG 559  61.426  22.957   3.999
  901    HB3  ARG 559           HB1      ARG 559  60.471  21.539   4.430
  902    HG2  ARG 559           HG2      ARG 559  59.673  23.205   2.054
  903    HG3  ARG 559           HG1      ARG 559  60.994  22.060   1.894
  904    HD2  ARG 559           HD2      ARG 559  59.624  20.210   2.351
  905    HD3  ARG 559           HD1      ARG 559  58.368  21.183   3.103
  906    HE   ARG 559           HE       ARG 559  58.590  20.458   0.312
  907   HH11  ARG 559          HH11      ARG 559  57.480  21.529  -1.306
  908   HH12  ARG 559          HH12      ARG 559  56.748  23.063  -0.972
  909   HH21  ARG 559          HH21      ARG 559  57.769  23.138   2.336
  910   HH22  ARG 559          HH22      ARG 559  56.911  23.971   1.083
  911    H    CYS 560           HN       CYS 560  57.953  21.798   5.952
  912    HA   CYS 560           HA       CYS 560  59.454  22.268   8.464
  913    HB2  CYS 560           HB2      CYS 560  57.378  22.657   9.742
  914    HB3  CYS 560           HB1      CYS 560  57.695  23.940   8.570
  915    HG   CYS 560           HG       CYS 560  55.144  22.796   8.542
  916    H    ILE 561           HN       ILE 561  59.838  20.492   9.467
  917    HA   ILE 561           HA       ILE 561  58.374  18.030   8.756
  918    HB   ILE 561           HB       ILE 561  60.804  18.554  10.493
  919   HG12  ILE 561          HG12      ILE 561  60.405  17.440   7.723
  920   HG13  ILE 561          HG11      ILE 561  61.143  18.982   8.118
  921   HG21  ILE 561          HG21      ILE 561  59.486  16.492  11.155
  922   HG22  ILE 561          HG22      ILE 561  61.106  16.147  10.561
  923   HG23  ILE 561          HG23      ILE 561  59.714  15.901   9.507
  924   HD11  ILE 561          HD11      ILE 561  62.846  17.677   9.479
  925   HD12  ILE 561          HD12      ILE 561  62.955  17.467   7.730
  926   HD13  ILE 561          HD13      ILE 561  62.200  16.215   8.727
  927    H    THR 562           HN       THR 562  57.266  16.876  10.275
  928    HA   THR 562           HA       THR 562  56.663  18.264  12.857
  929    HB   THR 562           HB       THR 562  54.736  16.428  11.451
  930    HG1  THR 562           HG1      THR 562  55.380  19.062  10.964
  931   HG21  THR 562          HG21      THR 562  53.143  17.345  12.981
  932   HG22  THR 562          HG22      THR 562  54.251  18.631  13.460
  933   HG23  THR 562          HG23      THR 562  54.576  16.963  13.941
  934    H    ALA 563           HN       ALA 563  56.502  17.016  14.661
  935    HA   ALA 563           HA       ALA 563  57.438  14.187  14.418
  936    HB1  ALA 563           HB1      ALA 563  59.139  15.825  15.262
  937    HB2  ALA 563           HB2      ALA 563  58.746  14.540  16.416
  938    HB3  ALA 563           HB3      ALA 563  58.062  16.156  16.621
  939    H    MET 564           HN       MET 564  57.146  14.635  17.524
  940    HA   MET 564           HA       MET 564  54.689  13.196  17.826
  941    HB2  MET 564           HB2      MET 564  55.929  14.854  20.009
  942    HB3  MET 564           HB1      MET 564  55.166  13.265  20.118
  943    HG2  MET 564           HG2      MET 564  57.109  12.442  18.621
  944    HG3  MET 564           HG1      MET 564  57.886  13.971  19.028
  945    HE1  MET 564           HE1      MET 564  59.176  11.174  19.632
  946    HE2  MET 564           HE2      MET 564  59.844  11.497  21.230
  947    HE3  MET 564           HE3      MET 564  59.895  12.750  19.992
  948    H    ALA 565           HN       ALA 565  54.658  15.778  16.437
  949    HA   ALA 565           HA       ALA 565  52.665  17.127  16.106
  950    HB1  ALA 565           HB1      ALA 565  51.637  16.356  18.306
  951    HB2  ALA 565           HB2      ALA 565  51.449  18.069  17.946
  952    HB3  ALA 565           HB3      ALA 565  52.666  17.550  19.107
  953    H    LYS 566           HN       LYS 566  55.664  17.292  17.549
  954    HA   LYS 566           HA       LYS 566  55.793  20.230  17.756
  955    HB2  LYS 566           HB2      LYS 566  57.641  17.922  18.203
  956    HB3  LYS 566           HB1      LYS 566  58.398  19.453  17.781
  957    HG2  LYS 566           HG2      LYS 566  57.513  20.551  19.675
  958    HG3  LYS 566           HG1      LYS 566  56.326  19.282  19.969
  959    HD2  LYS 566           HD2      LYS 566  59.248  18.556  20.014
  960    HD3  LYS 566           HD1      LYS 566  58.568  19.401  21.398
  961    HE2  LYS 566           HE2      LYS 566  57.106  17.641  21.921
  962    HE3  LYS 566           HE1      LYS 566  57.130  16.997  20.275
  963    HZ1  LYS 566           HZ1      LYS 566  58.429  15.723  21.997
  964    HZ2  LYS 566           HZ2      LYS 566  59.528  17.019  22.019
  965    HZ3  LYS 566           HZ3      LYS 566  59.279  16.137  20.589
  966    H    LYS 567           HN       LYS 567  57.382  21.430  16.384
  967    HA   LYS 567           HA       LYS 567  57.363  20.385  13.578
  968    HB2  LYS 567           HB2      LYS 567  57.955  23.230  14.322
  969    HB3  LYS 567           HB1      LYS 567  57.253  22.607  12.842
  970    HG2  LYS 567           HG2      LYS 567  55.889  22.684  15.557
  971    HG3  LYS 567           HG1      LYS 567  55.550  23.750  14.206
  972    HD2  LYS 567           HD2      LYS 567  55.173  20.728  14.165
  973    HD3  LYS 567           HD1      LYS 567  53.888  21.922  14.349
  974    HE2  LYS 567           HE2      LYS 567  54.825  22.926  12.124
  975    HE3  LYS 567           HE1      LYS 567  55.582  21.345  11.938
  976    HZ1  LYS 567           HZ1      LYS 567  52.703  21.649  12.538
  977    HZ2  LYS 567           HZ2      LYS 567  53.517  20.278  11.951
  978    HZ3  LYS 567           HZ3      LYS 567  53.294  21.631  10.948
  979    H    PHE 568           HN       PHE 568  59.444  21.334  12.348
  980    HA   PHE 568           HA       PHE 568  61.773  21.606  14.115
  981    HB2  PHE 568           HB2      PHE 568  60.943  18.974  13.207
  982    HB3  PHE 568           HB1      PHE 568  62.504  19.340  12.500
  983    HD1  PHE 568           HD1      PHE 568  60.756  18.303  15.472
  984    HD2  PHE 568           HD2      PHE 568  64.366  20.174  14.084
  985    HE1  PHE 568           HE1      PHE 568  61.851  17.800  17.640
  986    HE2  PHE 568           HE2      PHE 568  65.459  19.671  16.252
  987    HZ   PHE 568           HZ       PHE 568  64.203  18.485  18.029
  988    H    HIS 569           HN       HIS 569  63.399  22.635  13.059
  989    HA   HIS 569           HA       HIS 569  63.024  23.772  10.494
  990    HB2  HIS 569           HB2      HIS 569  65.402  23.248  12.230
  991    HB3  HIS 569           HB1      HIS 569  65.683  23.784  10.585
  992    HD2  HIS 569           HD2      HIS 569  63.910  26.294  10.124
  993    HE1  HIS 569           HE1      HIS 569  64.834  27.546  14.042
  994    HA   PRO 570           HA       PRO 570  63.296  19.708   8.413
  995    HB2  PRO 570           HB2      PRO 570  64.017  21.436   6.080
  996    HB3  PRO 570           HB1      PRO 570  62.792  20.162   6.199
  997    HG2  PRO 570           HG2      PRO 570  62.150  22.815   6.203
  998    HG3  PRO 570           HG1      PRO 570  61.189  21.595   7.047
  999    HD2  PRO 570           HD2      PRO 570  62.944  23.691   8.186
 1000    HD3  PRO 570           HD1      PRO 570  61.628  22.777   8.962
 1001    H    GLU 571           HN       GLU 571  65.702  22.116   8.818
 1002    HA   GLU 571           HA       GLU 571  67.867  20.460   7.666
 1003    HB2  GLU 571           HB2      GLU 571  68.279  23.076   9.099
 1004    HB3  GLU 571           HB1      GLU 571  69.206  22.375   7.774
 1005    HG2  GLU 571           HG2      GLU 571  67.131  22.619   6.342
 1006    HG3  GLU 571           HG1      GLU 571  66.438  23.566   7.663
 1007    H    HIS 572           HN       HIS 572  67.129  22.088  10.749
 1008    HA   HIS 572           HA       HIS 572  69.242  20.894  12.228
 1009    HB2  HIS 572           HB2      HIS 572  66.534  21.667  13.359
 1010    HB3  HIS 572           HB1      HIS 572  68.067  21.602  14.226
 1011    HD2  HIS 572           HD2      HIS 572  69.587  23.076  11.456
 1012    HE1  HIS 572           HE1      HIS 572  67.479  26.446  12.850
 1013    H    PHE 573           HN       PHE 573  66.723  19.341  10.751
 1014    HA   PHE 573           HA       PHE 573  67.057  16.962  12.554
 1015    HB2  PHE 573           HB2      PHE 573  64.748  18.213  12.595
 1016    HB3  PHE 573           HB1      PHE 573  64.519  17.470  11.018
 1017    HD1  PHE 573           HD1      PHE 573  63.531  15.342  10.941
 1018    HD2  PHE 573           HD2      PHE 573  65.669  16.548  14.468
 1019    HE1  PHE 573           HE1      PHE 573  62.901  13.216  12.051
 1020    HE2  PHE 573           HE2      PHE 573  65.038  14.421  15.576
 1021    HZ   PHE 573           HZ       PHE 573  63.654  12.755  14.368
 1022    H    VAL 574           HN       VAL 574  68.781  17.192  10.599
 1023    HA   VAL 574           HA       VAL 574  67.763  16.009   8.106
 1024    HB   VAL 574           HB       VAL 574  70.143  16.235   7.368
 1025   HG11  VAL 574          HG11      VAL 574  68.213  18.324   7.962
 1026   HG12  VAL 574          HG12      VAL 574  69.291  18.176   6.590
 1027   HG13  VAL 574          HG13      VAL 574  69.851  18.974   8.036
 1028   HG21  VAL 574          HG21      VAL 574  71.085  16.069   9.707
 1029   HG22  VAL 574          HG22      VAL 574  70.477  17.705  10.012
 1030   HG23  VAL 574          HG23      VAL 574  71.718  17.429   8.777
 1031    H    CYS 575           HN       CYS 575  69.407  14.305   7.170
 1032    HA   CYS 575           HA       CYS 575  69.465  12.007   9.008
 1033    HB2  CYS 575           HB2      CYS 575  69.047  11.013   7.008
 1034    HB3  CYS 575           HB1      CYS 575  69.534  12.464   6.134
 1035    H    ALA 576           HN       ALA 576  71.449  11.039   9.836
 1036    HA   ALA 576           HA       ALA 576  73.781  12.908   9.577
 1037    HB1  ALA 576           HB1      ALA 576  73.833  10.333  11.153
 1038    HB2  ALA 576           HB2      ALA 576  72.881  11.687  11.762
 1039    HB3  ALA 576           HB3      ALA 576  74.619  11.874  11.503
 1040    H    PHE 577           HN       PHE 577  73.812  12.264   7.263
 1041    HA   PHE 577           HA       PHE 577  76.011  10.431   6.736
 1042    HB2  PHE 577           HB2      PHE 577  74.050   8.892   6.362
 1043    HB3  PHE 577           HB1      PHE 577  73.412  10.037   5.196
 1044    HD1  PHE 577           HD1      PHE 577  75.815   7.349   5.749
 1045    HD2  PHE 577           HD2      PHE 577  74.682  10.550   3.122
 1046    HE1  PHE 577           HE1      PHE 577  77.161   6.342   3.938
 1047    HE2  PHE 577           HE2      PHE 577  76.038   9.544   1.310
 1048    HZ   PHE 577           HZ       PHE 577  77.275   7.435   1.718
 1049    H    CYS 578           HN       CYS 578  73.329  12.073   5.245
 1050    HA   CYS 578           HA       CYS 578  75.119  13.975   3.795
 1051    HB2  CYS 578           HB2      CYS 578  73.342  14.188   2.127
 1052    HB3  CYS 578           HB1      CYS 578  73.719  12.486   2.294
 1053    H    LEU 579           HN       LEU 579  75.122  15.062   5.810
 1054    HA   LEU 579           HA       LEU 579  73.079  15.914   7.442
 1055    HB2  LEU 579           HB2      LEU 579  75.397  17.708   6.764
 1056    HB3  LEU 579           HB1      LEU 579  74.633  17.423   8.327
 1057    HG   LEU 579           HG       LEU 579  76.392  15.502   6.769
 1058   HD11  LEU 579          HD11      LEU 579  76.741  16.279   9.633
 1059   HD12  LEU 579          HD12      LEU 579  77.286  17.383   8.372
 1060   HD13  LEU 579          HD13      LEU 579  77.942  15.751   8.468
 1061   HD21  LEU 579          HD21      LEU 579  74.526  15.049   9.101
 1062   HD22  LEU 579          HD22      LEU 579  75.961  14.045   8.892
 1063   HD23  LEU 579          HD23      LEU 579  74.717  14.067   7.649
 1064    H    LYS 580           HN       LYS 580  72.654  16.547   4.254
 1065    HA   LYS 580           HA       LYS 580  72.011  19.438   4.635
 1066    HB2  LYS 580           HB2      LYS 580  72.146  19.689   2.351
 1067    HB3  LYS 580           HB1      LYS 580  73.187  18.291   2.543
 1068    HG2  LYS 580           HG2      LYS 580  70.229  18.080   1.826
 1069    HG3  LYS 580           HG1      LYS 580  71.527  18.131   0.647
 1070    HD2  LYS 580           HD2      LYS 580  72.384  16.063   1.270
 1071    HD3  LYS 580           HD1      LYS 580  71.655  16.119   2.872
 1072    HE2  LYS 580           HE2      LYS 580  70.598  14.559   1.065
 1073    HE3  LYS 580           HE1      LYS 580  69.541  15.540   2.080
 1074    HZ1  LYS 580           HZ1      LYS 580  70.503  16.317  -0.620
 1075    HZ2  LYS 580           HZ2      LYS 580  69.412  17.187   0.350
 1076    HZ3  LYS 580           HZ3      LYS 580  68.968  15.675  -0.286
 1077    H    GLN 581           HN       GLN 581  70.189  16.374   3.941
 1078    HA   GLN 581           HA       GLN 581  67.855  17.762   4.998
 1079    HB2  GLN 581           HB2      GLN 581  67.983  18.527   2.632
 1080    HB3  GLN 581           HB1      GLN 581  67.627  16.872   2.141
 1081    HG2  GLN 581           HG2      GLN 581  65.517  17.971   2.218
 1082    HG3  GLN 581           HG1      GLN 581  65.583  17.043   3.703
 1083   HE21  GLN 581          HE21      GLN 581  66.297  18.284   5.694
 1084   HE22  GLN 581          HE22      GLN 581  65.921  19.929   5.775
 1085    H    LEU 582           HN       LEU 582  66.276  16.546   5.751
 1086    HA   LEU 582           HA       LEU 582  66.166  13.664   5.035
 1087    HB2  LEU 582           HB2      LEU 582  67.369  14.076   7.217
 1088    HB3  LEU 582           HB1      LEU 582  65.864  14.707   7.858
 1089    HG   LEU 582           HG       LEU 582  64.789  12.520   7.462
 1090   HD11  LEU 582          HD11      LEU 582  67.317  12.019   6.003
 1091   HD12  LEU 582          HD12      LEU 582  65.723  11.348   5.722
 1092   HD13  LEU 582          HD13      LEU 582  66.754  10.666   6.978
 1093   HD21  LEU 582          HD21      LEU 582  65.625  12.617   9.629
 1094   HD22  LEU 582          HD22      LEU 582  67.303  12.711   9.104
 1095   HD23  LEU 582          HD23      LEU 582  66.440  11.175   9.026
 1096    H    ASN 583           HN       ASN 583  64.010  12.733   5.868
 1097    HA   ASN 583           HA       ASN 583  61.844  14.765   6.045
 1098    HB2  ASN 583           HB2      ASN 583  62.208  12.759   3.813
 1099    HB3  ASN 583           HB1      ASN 583  60.597  13.311   4.261
 1100   HD21  ASN 583          HD21      ASN 583  61.422  13.949   1.732
 1101   HD22  ASN 583          HD22      ASN 583  61.809  15.594   1.626
 1102    H    LYS 584           HN       LYS 584  60.405  14.118   7.534
 1103    HA   LYS 584           HA       LYS 584  60.634  11.839   9.136
 1104    HB2  LYS 584           HB2      LYS 584  58.200  12.240   9.650
 1105    HB3  LYS 584           HB1      LYS 584  59.219  13.670   9.823
 1106    HG2  LYS 584           HG2      LYS 584  58.606  14.406   7.550
 1107    HG3  LYS 584           HG1      LYS 584  57.598  12.978   7.350
 1108    HD2  LYS 584           HD2      LYS 584  57.188  15.276   9.286
 1109    HD3  LYS 584           HD1      LYS 584  56.163  14.827   7.926
 1110    HE2  LYS 584           HE2      LYS 584  55.933  12.539   9.176
 1111    HE3  LYS 584           HE1      LYS 584  56.484  13.456  10.582
 1112    HZ1  LYS 584           HZ1      LYS 584  54.045  13.837   8.966
 1113    HZ2  LYS 584           HZ2      LYS 584  54.678  15.109   9.899
 1114    HZ3  LYS 584           HZ3      LYS 584  54.191  13.663  10.647
 1115    H    GLY 585           HN       GLY 585  59.327  12.141   5.956
 1116    HA2  GLY 585           HA2      GLY 585  57.778   9.656   6.088
 1117    HA3  GLY 585           HA1      GLY 585  58.017  10.662   4.663
 1118    H    THR 586           HN       THR 586  60.962  10.647   5.387
 1119    HA   THR 586           HA       THR 586  61.660   7.865   4.538
 1120    HB   THR 586           HB       THR 586  62.953   8.601   2.741
 1121    HG1  THR 586           HG1      THR 586  62.994  11.096   4.086
 1122   HG21  THR 586          HG21      THR 586  60.510   9.167   2.432
 1123   HG22  THR 586          HG22      THR 586  61.603  10.147   1.453
 1124   HG23  THR 586          HG23      THR 586  60.889  10.819   2.923
 1125    H    PHE 587           HN       PHE 587  61.753   9.366   7.115
 1126    HA   PHE 587           HA       PHE 587  64.664   9.760   7.493
 1127    HB2  PHE 587           HB2      PHE 587  64.197  10.765   9.534
 1128    HB3  PHE 587           HB1      PHE 587  62.810  11.212   8.565
 1129    HD1  PHE 587           HD1      PHE 587  61.053   8.897   8.610
 1130    HD2  PHE 587           HD2      PHE 587  63.530  10.464  11.753
 1131    HE1  PHE 587           HE1      PHE 587  59.560   7.874  10.297
 1132    HE2  PHE 587           HE2      PHE 587  62.035   9.435  13.438
 1133    HZ   PHE 587           HZ       PHE 587  60.051   8.140  12.712
 1134    H    LYS 588           HN       LYS 588  65.763   7.981   7.577
 1135    HA   LYS 588           HA       LYS 588  64.809   5.603   9.076
 1136    HB2  LYS 588           HB2      LYS 588  66.147   5.953   6.623
 1137    HB3  LYS 588           HB1      LYS 588  67.411   5.443   7.697
 1138    HG2  LYS 588           HG2      LYS 588  66.308   3.555   6.483
 1139    HG3  LYS 588           HG1      LYS 588  66.295   3.391   8.225
 1140    HD2  LYS 588           HD2      LYS 588  64.140   2.842   6.814
 1141    HD3  LYS 588           HD1      LYS 588  63.993   3.643   8.356
 1142    HE2  LYS 588           HE2      LYS 588  63.413   5.691   7.373
 1143    HE3  LYS 588           HE1      LYS 588  64.234   5.305   5.878
 1144    HZ1  LYS 588           HZ1      LYS 588  62.091   4.982   5.262
 1145    HZ2  LYS 588           HZ2      LYS 588  61.598   4.479   6.808
 1146    HZ3  LYS 588           HZ3      LYS 588  62.464   3.418   5.803
 1147    H    GLU 589           HN       GLU 589  66.596   4.544  10.463
 1148    HA   GLU 589           HA       GLU 589  68.558   6.475  11.540
 1149    HB2  GLU 589           HB2      GLU 589  66.806   7.181  12.913
 1150    HB3  GLU 589           HB1      GLU 589  66.108   5.571  13.039
 1151    HG2  GLU 589           HG2      GLU 589  67.833   4.857  14.545
 1152    HG3  GLU 589           HG1      GLU 589  68.810   6.294  14.224
 1153    H    GLN 590           HN       GLN 590  70.005   5.561  12.995
 1154    HA   GLN 590           HA       GLN 590  70.036   2.688  13.494
 1155    HB2  GLN 590           HB2      GLN 590  71.057   3.187  11.113
 1156    HB3  GLN 590           HB1      GLN 590  72.420   3.816  12.020
 1157    HG2  GLN 590           HG2      GLN 590  73.155   1.642  11.980
 1158    HG3  GLN 590           HG1      GLN 590  72.036   1.436  13.324
 1159   HE21  GLN 590          HE21      GLN 590  72.706   0.522  10.044
 1160   HE22  GLN 590          HE22      GLN 590  71.317  -0.423   9.798
 1161    H    ASN 591           HN       ASN 591  71.461   2.274  15.255
 1162    HA   ASN 591           HA       ASN 591  72.424   2.913  17.286
 1163    HB2  ASN 591           HB2      ASN 591  74.415   4.714  16.616
 1164    HB3  ASN 591           HB1      ASN 591  74.572   2.974  16.512
 1165   HD21  ASN 591          HD21      ASN 591  73.403   2.171  14.313
 1166   HD22  ASN 591          HD22      ASN 591  73.904   3.011  12.930
 1167    H    ASP 592           HN       ASP 592  70.156   4.635  16.232
 1168    HA   ASP 592           HA       ASP 592  68.939   6.373  17.264
 1169    HB2  ASP 592           HB2      ASP 592  71.400   7.356  18.683
 1170    HB3  ASP 592           HB1      ASP 592  69.714   7.458  19.183
 1171    H    LYS 593           HN       LYS 593  71.604   6.660  15.298
 1172    HA   LYS 593           HA       LYS 593  71.584   9.585  15.095
 1173    HB2  LYS 593           HB2      LYS 593  73.013   7.506  13.462
 1174    HB3  LYS 593           HB1      LYS 593  73.336   9.231  13.468
 1175    HG2  LYS 593           HG2      LYS 593  73.589   8.777  16.113
 1176    HG3  LYS 593           HG1      LYS 593  73.998   7.165  15.534
 1177    HD2  LYS 593           HD2      LYS 593  75.787   8.056  14.149
 1178    HD3  LYS 593           HD1      LYS 593  75.321   9.709  14.549
 1179    HE2  LYS 593           HE2      LYS 593  76.238   7.652  16.577
 1180    HE3  LYS 593           HE1      LYS 593  77.268   8.908  15.889
 1181    HZ1  LYS 593           HZ1      LYS 593  76.548  10.086  17.637
 1182    HZ2  LYS 593           HZ2      LYS 593  75.175   9.116  17.878
 1183    HZ3  LYS 593           HZ3      LYS 593  75.160  10.336  16.695
 1184    HA   PRO 594           HA       PRO 594  68.129   9.310  12.121
 1185    HB2  PRO 594           HB2      PRO 594  69.365  11.841  11.140
 1186    HB3  PRO 594           HB1      PRO 594  67.682  11.513  11.556
 1187    HG2  PRO 594           HG2      PRO 594  69.319  12.969  13.143
 1188    HG3  PRO 594           HG1      PRO 594  68.047  11.933  13.810
 1189    HD2  PRO 594           HD2      PRO 594  70.999  11.522  13.843
 1190    HD3  PRO 594           HD1      PRO 594  69.752  10.863  14.927
 1191    H    TYR 595           HN       TYR 595  67.958   9.147   9.697
 1192    HA   TYR 595           HA       TYR 595  70.374   9.133   8.075
 1193    HB2  TYR 595           HB2      TYR 595  69.371   6.605   9.329
 1194    HB3  TYR 595           HB1      TYR 595  70.005   6.513   7.698
 1195    HD1  TYR 595           HD1      TYR 595  72.293   7.955   7.429
 1196    HD2  TYR 595           HD2      TYR 595  70.900   6.075  11.019
 1197    HE1  TYR 595           HE1      TYR 595  74.632   7.819   8.273
 1198    HE2  TYR 595           HE2      TYR 595  73.232   5.953  11.854
 1199    HH   TYR 595           HH       TYR 595  75.442   7.386  11.354
 1200    H    CYS 596           HN       CYS 596  69.779   9.125   5.875
 1201    HA   CYS 596           HA       CYS 596  66.910   8.928   5.235
 1202    HB2  CYS 596           HB2      CYS 596  69.205   8.912   3.248
 1203    HB3  CYS 596           HB1      CYS 596  67.524   9.320   2.946
 1204    H    GLN 597           HN       GLN 597  66.132   7.154   3.793
 1205    HA   GLN 597           HA       GLN 597  67.164   4.650   4.678
 1206    HB2  GLN 597           HB2      GLN 597  64.955   4.467   3.926
 1207    HB3  GLN 597           HB1      GLN 597  65.231   5.524   2.573
 1208    HG2  GLN 597           HG2      GLN 597  65.025   3.471   1.491
 1209    HG3  GLN 597           HG1      GLN 597  66.760   3.543   1.724
 1210   HE21  GLN 597          HE21      GLN 597  66.669   3.032   4.605
 1211   HE22  GLN 597          HE22      GLN 597  66.231   1.426   4.805
 1212    H    ASN 598           HN       ASN 598  67.424   6.253   1.517
 1213    HA   ASN 598           HA       ASN 598  69.222   4.575   0.242
 1214    HB2  ASN 598           HB2      ASN 598  69.676   7.543   0.099
 1215    HB3  ASN 598           HB1      ASN 598  69.660   6.356  -1.200
 1216   HD21  ASN 598          HD21      ASN 598  67.297   5.086  -0.952
 1217   HD22  ASN 598          HD22      ASN 598  65.999   6.165  -1.063
 1218    H    CYS 599           HN       CYS 599  69.828   6.704   2.936
 1219    HA   CYS 599           HA       CYS 599  72.741   6.454   2.721
 1220    HB2  CYS 599           HB2      CYS 599  70.917   7.682   4.807
 1221    HB3  CYS 599           HB1      CYS 599  72.674   7.691   4.910
 1222    H    PHE 600           HN       PHE 600  70.314   5.557   5.219
 1223    HA   PHE 600           HA       PHE 600  72.008   3.874   6.728
 1224    HB2  PHE 600           HB2      PHE 600  70.015   4.208   7.853
 1225    HB3  PHE 600           HB1      PHE 600  69.067   4.227   6.376
 1226    HD1  PHE 600           HD1      PHE 600  70.307   2.203   9.137
 1227    HD2  PHE 600           HD2      PHE 600  68.411   2.061   5.291
 1228    HE1  PHE 600           HE1      PHE 600  69.562  -0.120   9.588
 1229    HE2  PHE 600           HE2      PHE 600  67.675  -0.263   5.735
 1230    HZ   PHE 600           HZ       PHE 600  68.250  -1.354   7.886
 1231    H    LEU 601           HN       LEU 601  69.822   3.020   4.031
 1232    HA   LEU 601           HA       LEU 601  70.459   0.268   3.950
 1233    HB2  LEU 601           HB2      LEU 601  69.058   0.291   2.145
 1234    HB3  LEU 601           HB1      LEU 601  68.848   1.996   2.512
 1235    HG   LEU 601           HG       LEU 601  70.782   2.480   0.937
 1236   HD11  LEU 601          HD11      LEU 601  70.701   0.183  -0.727
 1237   HD12  LEU 601          HD12      LEU 601  70.915  -0.434   0.905
 1238   HD13  LEU 601          HD13      LEU 601  72.053   0.735   0.252
 1239   HD21  LEU 601          HD21      LEU 601  68.249   2.475   0.351
 1240   HD22  LEU 601          HD22      LEU 601  68.591   0.975  -0.497
 1241   HD23  LEU 601          HD23      LEU 601  69.397   2.466  -0.981
 1242    H    LYS 602           HN       LYS 602  72.082   3.061   2.530
 1243    HA   LYS 602           HA       LYS 602  74.015   1.780   0.964
 1244    HB2  LYS 602           HB2      LYS 602  73.654   4.398   1.957
 1245    HB3  LYS 602           HB1      LYS 602  75.242   3.956   2.523
 1246    HG2  LYS 602           HG2      LYS 602  74.291   3.848  -0.339
 1247    HG3  LYS 602           HG1      LYS 602  75.353   5.063   0.345
 1248    HD2  LYS 602           HD2      LYS 602  76.815   2.976   1.010
 1249    HD3  LYS 602           HD1      LYS 602  75.911   2.171  -0.263
 1250    HE2  LYS 602           HE2      LYS 602  77.725   3.024  -1.467
 1251    HE3  LYS 602           HE1      LYS 602  76.540   4.312  -1.670
 1252    HZ1  LYS 602           HZ1      LYS 602  78.906   4.228   0.076
 1253    HZ2  LYS 602           HZ2      LYS 602  77.589   5.219   0.488
 1254    HZ3  LYS 602           HZ3      LYS 602  78.401   5.448  -0.987
 1255    H    LEU 603           HN       LEU 603  73.781   1.947   4.448
 1256    HA   LEU 603           HA       LEU 603  76.513   0.875   4.808
 1257    HB2  LEU 603           HB2      LEU 603  74.662   1.243   7.127
 1258    HB3  LEU 603           HB1      LEU 603  76.378   1.618   6.988
 1259    HG   LEU 603           HG       LEU 603  74.108   3.188   5.708
 1260   HD11  LEU 603          HD11      LEU 603  74.482   3.329   8.240
 1261   HD12  LEU 603          HD12      LEU 603  74.495   4.844   7.339
 1262   HD13  LEU 603          HD13      LEU 603  76.016   4.110   7.848
 1263   HD21  LEU 603          HD21      LEU 603  77.066   3.860   5.843
 1264   HD22  LEU 603          HD22      LEU 603  75.809   4.751   4.989
 1265   HD23  LEU 603          HD23      LEU 603  76.302   3.163   4.418
 1266    H    PHE 604           HN       PHE 604  73.252  -0.130   5.975
 1267    HA   PHE 604           HA       PHE 604  74.350  -2.844   6.449
 1268    HB2  PHE 604           HB2      PHE 604  71.885  -1.346   7.276
 1269    HB3  PHE 604           HB1      PHE 604  71.796  -3.107   7.236
 1270    HD1  PHE 604           HD1      PHE 604  73.695  -0.229   8.659
 1271    HD2  PHE 604           HD2      PHE 604  72.855  -4.435   8.906
 1272    HE1  PHE 604           HE1      PHE 604  74.902  -0.344  10.821
 1273    HE2  PHE 604           HE2      PHE 604  74.061  -4.548  11.070
 1274    HZ   PHE 604           HZ       PHE 604  75.085  -2.503  12.027
 1275    H    CYS 605           HN       CYS 605  73.750  -1.676   3.676
 1276    HA   CYS 605           HA       CYS 605  72.701  -4.148   2.582
 1277    HB2  CYS 605           HB2      CYS 605  70.916  -1.754   2.827
 1278    HB3  CYS 605           HB1      CYS 605  70.805  -2.715   1.351
 1279    HG   CYS 605           HG       CYS 605  69.848  -4.639   2.638
  Start of MODEL   17
    1    H    MET   1           HT1      MET   1  91.305 -23.990   8.574
    2    HA   MET   1           HA       MET   1  90.118 -24.476  10.730
    3    HB2  MET   1           HB2      MET   1  92.153 -25.704   9.532
    4    HB3  MET   1           HB1      MET   1  93.047 -25.163  10.944
    5    HG2  MET   1           HG2      MET   1  90.734 -27.082  10.780
    6    HG3  MET   1           HG1      MET   1  92.263 -27.265  11.631
    7    HE1  MET   1           HE1      MET   1  89.054 -27.721  12.943
    8    HE2  MET   1           HE2      MET   1  89.825 -27.515  14.514
    9    HE3  MET   1           HE3      MET   1  90.686 -28.346  13.220
   10    H    ALA   2           HN       ALA   2  92.671 -24.716  12.622
   11    HA   ALA   2           HA       ALA   2  92.748 -21.971  13.721
   12    HB1  ALA   2           HB1      ALA   2  90.723 -23.232  14.689
   13    HB2  ALA   2           HB2      ALA   2  91.858 -22.554  15.856
   14    HB3  ALA   2           HB3      ALA   2  91.900 -24.279  15.484
   15    H    LEU   3           HN       LEU   3  93.508 -25.370  14.423
   16    HA   LEU   3           HA       LEU   3  95.763 -25.121  16.014
   17    HB2  LEU   3           HB2      LEU   3  95.113 -27.029  13.767
   18    HB3  LEU   3           HB1      LEU   3  96.569 -27.220  14.741
   19    HG   LEU   3           HG       LEU   3  93.764 -27.061  15.880
   20   HD11  LEU   3          HD11      LEU   3  93.854 -29.081  14.622
   21   HD12  LEU   3          HD12      LEU   3  94.186 -29.555  16.289
   22   HD13  LEU   3          HD13      LEU   3  95.511 -29.413  15.132
   23   HD21  LEU   3          HD21      LEU   3  95.094 -26.537  17.696
   24   HD22  LEU   3          HD22      LEU   3  96.512 -27.357  17.046
   25   HD23  LEU   3          HD23      LEU   3  95.215 -28.290  17.790
   26    H    ASP   4           HN       ASP   4  96.240 -26.011  12.699
   27    HA   ASP   4           HA       ASP   4  97.791 -25.422  11.113
   28    HB2  ASP   4           HB2      ASP   4  96.668 -23.311  11.006
   29    HB3  ASP   4           HB1      ASP   4  97.444 -22.761  12.483
   30    H    GLY   5           HN       GLY   5  98.478 -25.493  14.353
   31    HA2  GLY   5           HA2      GLY   5 100.686 -26.548  14.910
   32    HA3  GLY   5           HA1      GLY   5 101.416 -25.349  13.845
   33    H    ILE   6           HN       ILE   6  99.147 -23.603  14.935
   34    HA   ILE   6           HA       ILE   6 100.536 -22.720  17.444
   35    HB   ILE   6           HB       ILE   6  99.361 -20.436  16.514
   36   HG12  ILE   6          HG12      ILE   6  98.632 -21.909  14.477
   37   HG13  ILE   6          HG11      ILE   6  99.266 -20.316  14.172
   38   HG21  ILE   6          HG21      ILE   6 102.063 -21.590  15.903
   39   HG22  ILE   6          HG22      ILE   6 101.626 -20.369  17.098
   40   HG23  ILE   6          HG23      ILE   6 101.608 -19.968  15.381
   41   HD11  ILE   6          HD11      ILE   6 101.142 -21.108  13.140
   42   HD12  ILE   6          HD12      ILE   6 100.157 -22.551  12.915
   43   HD13  ILE   6          HD13      ILE   6 101.308 -22.474  14.241
   44    H    ARG   7           HN       ARG   7  97.732 -20.966  16.570
   45    HA   ARG   7           HA       ARG   7  95.767 -22.717  17.700
   46    HB2  ARG   7           HB2      ARG   7  95.337 -21.265  19.718
   47    HB3  ARG   7           HB1      ARG   7  96.781 -22.260  19.784
   48    HG2  ARG   7           HG2      ARG   7  97.328 -19.620  18.595
   49    HG3  ARG   7           HG1      ARG   7  96.686 -19.497  20.228
   50    HD2  ARG   7           HD2      ARG   7  98.421 -21.022  21.054
   51    HD3  ARG   7           HD1      ARG   7  99.042 -21.207  19.419
   52    HE   ARG   7           HE       ARG   7 100.047 -19.063  19.594
   53   HH11  ARG   7          HH11      ARG   7 100.678 -17.270  20.820
   54   HH12  ARG   7          HH12      ARG   7  99.899 -16.956  22.335
   55   HH21  ARG   7          HH21      ARG   7  97.800 -19.708  22.128
   56   HH22  ARG   7          HH22      ARG   7  98.271 -18.336  23.074
   57    H    MET   8           HN       MET   8  95.486 -19.411  18.646
   58    HA   MET   8           HA       MET   8  94.269 -18.602  16.098
   59    HB2  MET   8           HB2      MET   8  92.204 -17.998  17.962
   60    HB3  MET   8           HB1      MET   8  92.151 -19.144  16.640
   61    HG2  MET   8           HG2      MET   8  92.868 -20.955  18.006
   62    HG3  MET   8           HG1      MET   8  93.334 -19.913  19.330
   63    HE1  MET   8           HE1      MET   8  91.728 -22.310  19.979
   64    HE2  MET   8           HE2      MET   8  90.972 -22.426  18.392
   65    HE3  MET   8           HE3      MET   8  89.966 -22.272  19.830
   66    HA   PRO   9           HA       PRO   9  94.180 -14.639  19.068
   67    HB2  PRO   9           HB2      PRO   9  96.140 -15.833  21.018
   68    HB3  PRO   9           HB1      PRO   9  94.951 -14.537  21.281
   69    HG2  PRO   9           HG2      PRO   9  94.429 -16.967  22.117
   70    HG3  PRO   9           HG1      PRO   9  93.174 -16.013  21.302
   71    HD2  PRO   9           HD2      PRO   9  94.741 -18.325  20.242
   72    HD3  PRO   9           HD1      PRO   9  93.084 -17.832  19.915
   73    H    ASP  10           HN       ASP  10  96.934 -16.787  18.938
   74    HA   ASP  10           HA       ASP  10  98.641 -14.609  17.779
   75    HB2  ASP  10           HB2      ASP  10  99.418 -15.898  19.837
   76    HB3  ASP  10           HB1      ASP  10  99.562 -17.306  18.784
   77    H    GLY  11           HN       GLY  11  97.389 -17.838  17.225
   78    HA2  GLY  11           HA2      GLY  11  98.877 -18.184  14.751
   79    HA3  GLY  11           HA1      GLY  11  97.581 -19.229  15.335
   80    H    CYS  12           HN       CYS  12  96.543 -16.102  15.507
   81    HA   CYS  12           HA       CYS  12  95.747 -15.706  12.734
   82    HB2  CYS  12           HB2      CYS  12  94.099 -17.370  13.185
   83    HB3  CYS  12           HB1      CYS  12  93.767 -16.710  14.784
   84    HG   CYS  12           HG       CYS  12  91.988 -15.956  12.830
   85    H    TYR  13           HN       TYR  13  94.015 -14.901  15.738
   86    HA   TYR  13           HA       TYR  13  95.179 -12.304  16.058
   87    HB2  TYR  13           HB2      TYR  13  93.362 -12.476  13.892
   88    HB3  TYR  13           HB1      TYR  13  92.437 -11.709  15.176
   89    HD1  TYR  13           HD1      TYR  13  94.615 -11.080  12.492
   90    HD2  TYR  13           HD2      TYR  13  93.833  -9.842  16.531
   91    HE1  TYR  13           HE1      TYR  13  95.776  -8.933  12.058
   92    HE2  TYR  13           HE2      TYR  13  94.994  -7.694  16.095
   93    HH   TYR  13           HH       TYR  13  96.371  -6.610  14.653
   94    H    ALA  14           HN       ALA  14  91.913 -13.733  16.235
   95    HA   ALA  14           HA       ALA  14  91.886 -14.249  19.005
   96    HB1  ALA  14           HB1      ALA  14  92.068 -11.976  19.601
   97    HB2  ALA  14           HB2      ALA  14  90.324 -12.230  19.609
   98    HB3  ALA  14           HB3      ALA  14  91.096 -11.447  18.230
   99    H    ASP  15           HN       ASP  15  89.909 -12.850  16.422
  100    HA   ASP  15           HA       ASP  15  88.072 -15.159  16.647
  101    HB2  ASP  15           HB2      ASP  15  87.263 -13.219  18.126
  102    HB3  ASP  15           HB1      ASP  15  86.978 -12.342  16.622
  103    H    GLY  16           HN       GLY  16  89.935 -13.240  14.791
  104    HA2  GLY  16           HA2      GLY  16  90.096 -13.493  12.388
  105    HA3  GLY  16           HA1      GLY  16  88.367 -13.841  12.331
  106    H    THR  17           HN       THR  17  89.570 -11.229  14.287
  107    HA   THR  17           HA       THR  17  88.098  -9.308  12.567
  108    HB   THR  17           HB       THR  17  88.585  -7.795  14.612
  109    HG1  THR  17           HG1      THR  17  89.732 -10.192  15.315
  110   HG21  THR  17          HG21      THR  17  86.378  -8.590  14.345
  111   HG22  THR  17          HG22      THR  17  86.825  -9.054  15.985
  112   HG23  THR  17          HG23      THR  17  86.847 -10.256  14.693
  113    H    TRP  18           HN       TRP  18  89.242  -8.095  11.195
  114    HA   TRP  18           HA       TRP  18  92.049  -7.322  11.891
  115    HB2  TRP  18           HB2      TRP  18  92.282  -7.302   9.274
  116    HB3  TRP  18           HB1      TRP  18  92.493  -8.806  10.148
  117    HD1  TRP  18           HD1      TRP  18  89.954 -10.216  10.386
  118    HE1  TRP  18           HE1      TRP  18  88.339 -10.681   8.394
  119    HE3  TRP  18           HE3      TRP  18  91.436  -6.599   7.146
  120    HZ2  TRP  18           HZ2      TRP  18  87.831  -9.689   5.816
  121    HZ3  TRP  18           HZ3      TRP  18  90.380  -6.411   4.933
  122    HH2  TRP  18           HH2      TRP  18  88.566  -7.920   4.265
  123    H    GLU  19           HN       GLU  19  92.339  -5.142  11.830
  124    HA   GLU  19           HA       GLU  19  90.065  -3.484  11.030
  125    HB2  GLU  19           HB2      GLU  19  92.133  -1.706  11.665
  126    HB3  GLU  19           HB1      GLU  19  90.885  -2.266  12.772
  127    HG2  GLU  19           HG2      GLU  19  93.153  -2.607  13.687
  128    HG3  GLU  19           HG1      GLU  19  92.292  -4.128  13.460
  129    H    LEU  20           HN       LEU  20  89.883  -2.253   9.239
  130    HA   LEU  20           HA       LEU  20  91.851  -2.694   7.112
  131    HB2  LEU  20           HB2      LEU  20  89.078  -2.221   7.185
  132    HB3  LEU  20           HB1      LEU  20  89.720  -0.723   6.544
  133    HG   LEU  20           HG       LEU  20  89.298  -2.036   4.636
  134   HD11  LEU  20          HD11      LEU  20  92.155  -2.893   4.945
  135   HD12  LEU  20          HD12      LEU  20  91.784  -1.167   4.948
  136   HD13  LEU  20          HD13      LEU  20  91.333  -2.175   3.570
  137   HD21  LEU  20          HD21      LEU  20  89.737  -4.339   4.406
  138   HD22  LEU  20          HD22      LEU  20  89.026  -4.168   6.008
  139   HD23  LEU  20          HD23      LEU  20  90.775  -4.370   5.832
  140    H    SER  21           HN       SER  21  93.425  -1.172   6.576
  141    HA   SER  21           HA       SER  21  93.643   1.199   8.284
  142    HB2  SER  21           HB2      SER  21  95.531  -0.296   7.111
  143    HB3  SER  21           HB1      SER  21  95.314   0.886   5.823
  144    HG   SER  21           HG       SER  21  96.877   1.576   7.323
  145    H    VAL  22           HN       VAL  22  93.319   3.334   7.632
  146    HA   VAL  22           HA       VAL  22  92.304   3.769   4.873
  147    HB   VAL  22           HB       VAL  22  90.791   4.387   7.413
  148   HG11  VAL  22          HG11      VAL  22  89.214   5.646   5.850
  149   HG12  VAL  22          HG12      VAL  22  90.530   5.666   4.676
  150   HG13  VAL  22          HG13      VAL  22  90.720   6.479   6.231
  151   HG21  VAL  22          HG21      VAL  22  88.977   3.297   6.140
  152   HG22  VAL  22          HG22      VAL  22  90.386   2.241   6.257
  153   HG23  VAL  22          HG23      VAL  22  90.061   3.119   4.756
  154    H    HIS  23           HN       HIS  23  93.723   5.152   4.090
  155    HA   HIS  23           HA       HIS  23  94.993   7.220   5.745
  156    HB2  HIS  23           HB2      HIS  23  95.145   6.326   2.875
  157    HB3  HIS  23           HB1      HIS  23  95.886   7.849   3.364
  158    HD1  HIS  23           HD1      HIS  23  95.842   4.329   4.874
  159    HD2  HIS  23           HD2      HIS  23  98.533   7.376   3.949
  160    HE1  HIS  23           HE1      HIS  23  98.127   3.510   5.596
  161    H    VAL  24           HN       VAL  24  93.573   8.891   6.286
  162    HA   VAL  24           HA       VAL  24  91.457   9.675   4.467
  163    HB   VAL  24           HB       VAL  24  92.530  11.324   6.760
  164   HG11  VAL  24          HG11      VAL  24  90.297  12.191   6.824
  165   HG12  VAL  24          HG12      VAL  24  89.722  10.939   5.735
  166   HG13  VAL  24          HG13      VAL  24  90.774  12.198   5.125
  167   HG21  VAL  24          HG21      VAL  24  90.748  10.031   8.082
  168   HG22  VAL  24          HG22      VAL  24  92.230   9.151   7.711
  169   HG23  VAL  24          HG23      VAL  24  90.770   8.857   6.764
  170    H    THR  25           HN       THR  25  91.945  10.669   2.589
  171    HA   THR  25           HA       THR  25  94.366  12.247   2.260
  172    HB   THR  25           HB       THR  25  93.852  12.241  -0.005
  173    HG1  THR  25           HG1      THR  25  92.086  13.308  -0.360
  174   HG21  THR  25          HG21      THR  25  92.959  10.123  -0.600
  175   HG22  THR  25          HG22      THR  25  91.901  10.085   0.810
  176   HG23  THR  25          HG23      THR  25  93.640   9.884   1.009
  177    H    ASP  26           HN       ASP  26  94.172  14.572   1.437
  178    HA   ASP  26           HA       ASP  26  93.371  16.770   1.696
  179    HB2  ASP  26           HB2      ASP  26  91.068  15.457   1.239
  180    HB3  ASP  26           HB1      ASP  26  90.789  15.832   2.937
  181    H    LEU  27           HN       LEU  27  92.531  14.479   4.265
  182    HA   LEU  27           HA       LEU  27  93.207  16.471   6.355
  183    HB2  LEU  27           HB2      LEU  27  91.755  13.878   6.226
  184    HB3  LEU  27           HB1      LEU  27  92.576  14.217   7.737
  185    HG   LEU  27           HG       LEU  27  90.773  16.270   6.439
  186   HD11  LEU  27          HD11      LEU  27  89.980  13.993   8.272
  187   HD12  LEU  27          HD12      LEU  27  89.361  14.329   6.654
  188   HD13  LEU  27          HD13      LEU  27  88.973  15.414   7.990
  189   HD21  LEU  27          HD21      LEU  27  92.470  16.479   8.572
  190   HD22  LEU  27          HD22      LEU  27  90.999  15.962   9.397
  191   HD23  LEU  27          HD23      LEU  27  90.989  17.420   8.408
  192    H    ASN  28           HN       ASN  28  94.282  13.537   4.806
  193    HA   ASN  28           HA       ASN  28  96.381  12.524   4.740
  194    HB2  ASN  28           HB2      ASN  28  97.140  14.985   4.898
  195    HB3  ASN  28           HB1      ASN  28  97.453  14.650   6.595
  196   HD21  ASN  28          HD21      ASN  28  98.008  11.739   5.637
  197   HD22  ASN  28          HD22      ASN  28  99.619  11.811   5.116
  198    H    ARG  29           HN       ARG  29  94.357  12.293   7.125
  199    HA   ARG  29           HA       ARG  29  96.198  11.393   9.230
  200    HB2  ARG  29           HB2      ARG  29  93.184  11.292   9.016
  201    HB3  ARG  29           HB1      ARG  29  94.120  10.880  10.456
  202    HG2  ARG  29           HG2      ARG  29  94.927  13.114  10.691
  203    HG3  ARG  29           HG1      ARG  29  94.345  13.568   9.097
  204    HD2  ARG  29           HD2      ARG  29  92.453  14.316  10.118
  205    HD3  ARG  29           HD1      ARG  29  92.050  12.636  10.459
  206    HE   ARG  29           HE       ARG  29  93.116  14.579  12.371
  207   HH11  ARG  29          HH11      ARG  29  93.296  13.831  14.493
  208   HH12  ARG  29          HH12      ARG  29  93.162  12.134  14.815
  209   HH21  ARG  29          HH21      ARG  29  92.670  11.275  11.490
  210   HH22  ARG  29          HH22      ARG  29  92.807  10.686  13.114
  211    H    ASP  30           HN       ASP  30  95.327   9.194  10.186
  212    HA   ASP  30           HA       ASP  30  94.771   7.237   8.034
  213    HB2  ASP  30           HB2      ASP  30  97.121   7.155   9.932
  214    HB3  ASP  30           HB1      ASP  30  96.501   5.716   9.118
  215    H    VAL  31           HN       VAL  31  92.991   6.250   8.688
  216    HA   VAL  31           HA       VAL  31  92.638   5.740  11.633
  217    HB   VAL  31           HB       VAL  31  90.462   5.931   9.540
  218   HG11  VAL  31          HG11      VAL  31  89.816   4.695  11.515
  219   HG12  VAL  31          HG12      VAL  31  89.094   6.301  11.629
  220   HG13  VAL  31          HG13      VAL  31  90.530   5.913  12.571
  221   HG21  VAL  31          HG21      VAL  31  91.676   8.096   9.727
  222   HG22  VAL  31          HG22      VAL  31  91.469   8.053  11.478
  223   HG23  VAL  31          HG23      VAL  31  90.062   8.210  10.428
  224    H    THR  32           HN       THR  32  91.588   3.758  12.207
  225    HA   THR  32           HA       THR  32  91.697   1.606  10.141
  226    HB   THR  32           HB       THR  32  92.447   0.486  12.680
  227    HG1  THR  32           HG1      THR  32  94.164   2.597  11.955
  228   HG21  THR  32          HG21      THR  32  94.351  -0.305  11.542
  229   HG22  THR  32          HG22      THR  32  94.396   1.090  10.463
  230   HG23  THR  32          HG23      THR  32  93.149  -0.142  10.262
  231    H    LEU  33           HN       LEU  33  89.906   0.313  10.197
  232    HA   LEU  33           HA       LEU  33  87.993   0.644  12.479
  233    HB2  LEU  33           HB2      LEU  33  87.686   0.423   9.510
  234    HB3  LEU  33           HB1      LEU  33  86.398  -0.214  10.513
  235    HG   LEU  33           HG       LEU  33  86.121   2.200   9.772
  236   HD11  LEU  33          HD11      LEU  33  85.026   2.801  11.737
  237   HD12  LEU  33          HD12      LEU  33  86.261   2.107  12.782
  238   HD13  LEU  33          HD13      LEU  33  85.137   1.056  11.923
  239   HD21  LEU  33          HD21      LEU  33  87.486   3.893  10.673
  240   HD22  LEU  33          HD22      LEU  33  88.638   2.648  10.213
  241   HD23  LEU  33          HD23      LEU  33  88.158   2.839  11.893
  242    H    ARG  34           HN       ARG  34  88.066  -1.110  13.729
  243    HA   ARG  34           HA       ARG  34  89.023  -3.677  13.012
  244    HB2  ARG  34           HB2      ARG  34  88.720  -2.776  15.360
  245    HB3  ARG  34           HB1      ARG  34  86.993  -3.058  15.163
  246    HG2  ARG  34           HG2      ARG  34  87.932  -4.991  16.275
  247    HG3  ARG  34           HG1      ARG  34  87.496  -5.452  14.631
  248    HD2  ARG  34           HD2      ARG  34  89.683  -5.696  13.966
  249    HD3  ARG  34           HD1      ARG  34  90.286  -4.457  15.064
  250    HE   ARG  34           HE       ARG  34  89.940  -7.298  15.696
  251   HH11  ARG  34          HH11      ARG  34  90.663  -7.904  17.753
  252   HH12  ARG  34          HH12      ARG  34  91.014  -6.680  18.927
  253   HH21  ARG  34          HH21      ARG  34  90.199  -4.050  16.820
  254   HH22  ARG  34          HH22      ARG  34  90.752  -4.499  18.398
  255    H    VAL  35           HN       VAL  35  88.106  -4.802  11.383
  256    HA   VAL  35           HA       VAL  35  85.146  -5.236  11.450
  257    HB   VAL  35           HB       VAL  35  85.230  -5.206   8.931
  258   HG11  VAL  35          HG11      VAL  35  85.904  -2.707  10.509
  259   HG12  VAL  35          HG12      VAL  35  84.297  -3.304  10.081
  260   HG13  VAL  35          HG13      VAL  35  85.365  -2.672   8.828
  261   HG21  VAL  35          HG21      VAL  35  87.139  -3.987   7.909
  262   HG22  VAL  35          HG22      VAL  35  87.649  -5.499   8.659
  263   HG23  VAL  35          HG23      VAL  35  87.945  -3.967   9.475
  264    H    THR  36           HN       THR  36  84.882  -6.934   9.391
  265    HA   THR  36           HA       THR  36  86.880  -9.106   9.670
  266    HB   THR  36           HB       THR  36  84.896 -10.707   9.936
  267    HG1  THR  36           HG1      THR  36  83.426  -8.822  11.215
  268   HG21  THR  36          HG21      THR  36  84.601 -10.072  12.436
  269   HG22  THR  36          HG22      THR  36  85.788  -8.819  12.098
  270   HG23  THR  36          HG23      THR  36  86.207 -10.512  11.867
  271    H    GLY  37           HN       GLY  37  86.103 -10.897   8.010
  272    HA2  GLY  37           HA2      GLY  37  85.618  -9.496   5.495
  273    HA3  GLY  37           HA1      GLY  37  85.981 -11.211   5.676
  274    H    GLU  38           HN       GLU  38  83.480  -9.238   7.171
  275    HA   GLU  38           HA       GLU  38  81.384 -10.579   5.563
  276    HB2  GLU  38           HB2      GLU  38  80.080 -11.028   7.684
  277    HB3  GLU  38           HB1      GLU  38  81.496 -12.051   7.453
  278    HG2  GLU  38           HG2      GLU  38  82.753 -10.905   9.066
  279    HG3  GLU  38           HG1      GLU  38  81.709  -9.483   9.012
  280    H    VAL  39           HN       VAL  39  82.701  -7.778   6.697
  281    HA   VAL  39           HA       VAL  39  80.161  -6.451   7.377
  282    HB   VAL  39           HB       VAL  39  81.431  -4.598   8.032
  283   HG11  VAL  39          HG11      VAL  39  83.025  -5.507   9.540
  284   HG12  VAL  39          HG12      VAL  39  83.351  -6.874   8.473
  285   HG13  VAL  39          HG13      VAL  39  81.806  -6.757   9.311
  286   HG21  VAL  39          HG21      VAL  39  83.830  -4.288   7.396
  287   HG22  VAL  39          HG22      VAL  39  82.761  -4.220   6.009
  288   HG23  VAL  39          HG23      VAL  39  83.697  -5.685   6.333
  289    H    HIS  40           HN       HIS  40  79.140  -4.932   6.064
  290    HA   HIS  40           HA       HIS  40  79.765  -5.135   3.200
  291    HB2  HIS  40           HB2      HIS  40  77.767  -3.093   4.031
  292    HB3  HIS  40           HB1      HIS  40  77.622  -4.400   2.855
  293    HD1  HIS  40           HD1      HIS  40  77.515  -3.826   6.610
  294    HD2  HIS  40           HD2      HIS  40  76.291  -6.655   3.803
  295    HE1  HIS  40           HE1      HIS  40  76.104  -5.514   7.863
  296    H    ILE  41           HN       ILE  41  80.674  -3.469   1.942
  297    HA   ILE  41           HA       ILE  41  82.595  -1.766   3.026
  298    HB   ILE  41           HB       ILE  41  80.908  -1.014   0.629
  299   HG12  ILE  41          HG12      ILE  41  83.227  -2.970   0.819
  300   HG13  ILE  41          HG11      ILE  41  81.556  -3.352   0.395
  301   HG21  ILE  41          HG21      ILE  41  82.807   0.190  -0.101
  302   HG22  ILE  41          HG22      ILE  41  83.874  -0.629   1.041
  303   HG23  ILE  41          HG23      ILE  41  82.704   0.554   1.622
  304   HD11  ILE  41          HD11      ILE  41  82.017  -1.448  -1.453
  305   HD12  ILE  41          HD12      ILE  41  82.392  -3.147  -1.730
  306   HD13  ILE  41          HD13      ILE  41  83.667  -2.037  -1.238
  307    H    GLY  42           HN       GLY  42  79.340  -0.726   2.000
  308    HA2  GLY  42           HA2      GLY  42  79.442   1.879   3.062
  309    HA3  GLY  42           HA1      GLY  42  77.950   0.965   2.861
  310    H    GLY  43           HN       GLY  43  79.483  -1.111   4.599
  311    HA2  GLY  43           HA2      GLY  43  78.213  -0.365   7.103
  312    HA3  GLY  43           HA1      GLY  43  79.256  -1.766   6.843
  313    H    VAL  44           HN       VAL  44  81.386  -0.071   5.704
  314    HA   VAL  44           HA       VAL  44  82.706   0.655   8.224
  315    HB   VAL  44           HB       VAL  44  83.479   0.398   5.321
  316   HG11  VAL  44          HG11      VAL  44  84.523   2.508   5.797
  317   HG12  VAL  44          HG12      VAL  44  85.782   1.289   5.989
  318   HG13  VAL  44          HG13      VAL  44  85.004   1.983   7.411
  319   HG21  VAL  44          HG21      VAL  44  84.795  -0.556   7.883
  320   HG22  VAL  44          HG22      VAL  44  85.194  -1.063   6.242
  321   HG23  VAL  44          HG23      VAL  44  83.635  -1.497   6.945
  322    H    MET  45           HN       MET  45  81.280   2.299   5.414
  323    HA   MET  45           HA       MET  45  82.166   4.943   5.840
  324    HB2  MET  45           HB2      MET  45  79.492   3.834   4.957
  325    HB3  MET  45           HB1      MET  45  79.768   5.569   5.046
  326    HG2  MET  45           HG2      MET  45  81.880   5.033   3.570
  327    HG3  MET  45           HG1      MET  45  81.008   3.555   3.185
  328    HE1  MET  45           HE1      MET  45  78.246   3.883   3.060
  329    HE2  MET  45           HE2      MET  45  78.878   3.486   1.460
  330    HE3  MET  45           HE3      MET  45  77.689   4.778   1.644
  331    H    LEU  46           HN       LEU  46  79.680   3.060   7.468
  332    HA   LEU  46           HA       LEU  46  78.699   5.221   9.121
  333    HB2  LEU  46           HB2      LEU  46  77.898   2.633   8.529
  334    HB3  LEU  46           HB1      LEU  46  78.411   2.470  10.202
  335    HG   LEU  46           HG       LEU  46  76.483   4.614   9.236
  336   HD11  LEU  46          HD11      LEU  46  74.667   3.272   9.862
  337   HD12  LEU  46          HD12      LEU  46  75.667   2.187  10.828
  338   HD13  LEU  46          HD13      LEU  46  75.725   2.110   9.069
  339   HD21  LEU  46          HD21      LEU  46  77.495   5.305  11.274
  340   HD22  LEU  46          HD22      LEU  46  77.456   3.675  11.943
  341   HD23  LEU  46          HD23      LEU  46  75.960   4.588  11.760
  342    H    LYS  47           HN       LYS  47  80.600   2.345  10.112
  343    HA   LYS  47           HA       LYS  47  81.265   3.269  12.671
  344    HB2  LYS  47           HB2      LYS  47  83.140   1.678  10.921
  345    HB3  LYS  47           HB1      LYS  47  83.041   1.670  12.683
  346    HG2  LYS  47           HG2      LYS  47  80.589   0.886  12.326
  347    HG3  LYS  47           HG1      LYS  47  81.109   0.511  10.683
  348    HD2  LYS  47           HD2      LYS  47  83.102  -0.730  11.904
  349    HD3  LYS  47           HD1      LYS  47  82.001  -0.724  13.280
  350    HE2  LYS  47           HE2      LYS  47  80.259  -1.679  11.578
  351    HE3  LYS  47           HE1      LYS  47  81.681  -2.077  10.610
  352    HZ1  LYS  47           HZ1      LYS  47  80.871  -3.824  12.228
  353    HZ2  LYS  47           HZ2      LYS  47  81.467  -2.823  13.464
  354    HZ3  LYS  47           HZ3      LYS  47  82.522  -3.445  12.287
  355    H    LEU  48           HN       LEU  48  83.392   3.568   9.774
  356    HA   LEU  48           HA       LEU  48  85.460   4.964  10.919
  357    HB2  LEU  48           HB2      LEU  48  85.562   4.326   8.589
  358    HB3  LEU  48           HB1      LEU  48  84.212   5.378   8.189
  359    HG   LEU  48           HG       LEU  48  85.633   7.362   8.786
  360   HD11  LEU  48          HD11      LEU  48  87.182   6.190  10.343
  361   HD12  LEU  48          HD12      LEU  48  88.033   7.069   9.084
  362   HD13  LEU  48          HD13      LEU  48  87.859   5.322   8.967
  363   HD21  LEU  48          HD21      LEU  48  87.268   7.026   6.839
  364   HD22  LEU  48          HD22      LEU  48  85.555   6.809   6.472
  365   HD23  LEU  48          HD23      LEU  48  86.595   5.402   6.700
  366    H    VAL  49           HN       VAL  49  82.294   6.276  10.106
  367    HA   VAL  49           HA       VAL  49  83.089   9.026  10.752
  368    HB   VAL  49           HB       VAL  49  80.458   7.668  10.153
  369   HG11  VAL  49          HG11      VAL  49  79.471   9.991  10.249
  370   HG12  VAL  49          HG12      VAL  49  80.919  10.510  11.094
  371   HG13  VAL  49          HG13      VAL  49  79.851   9.303  11.813
  372   HG21  VAL  49          HG21      VAL  49  82.032   8.254   8.299
  373   HG22  VAL  49          HG22      VAL  49  81.929   9.943   8.795
  374   HG23  VAL  49          HG23      VAL  49  80.495   9.112   8.193
  375    H    GLU  50           HN       GLU  50  81.203   6.439  12.295
  376    HA   GLU  50           HA       GLU  50  80.213   7.648  14.558
  377    HB2  GLU  50           HB2      GLU  50  81.567   4.966  14.245
  378    HB3  GLU  50           HB1      GLU  50  80.788   5.448  15.744
  379    HG2  GLU  50           HG2      GLU  50  79.386   5.482  13.051
  380    HG3  GLU  50           HG1      GLU  50  79.312   4.121  14.172
  381    H    LYS  51           HN       LYS  51  83.568   6.838  13.922
  382    HA   LYS  51           HA       LYS  51  84.444   7.589  16.603
  383    HB2  LYS  51           HB2      LYS  51  86.157   7.179  14.177
  384    HB3  LYS  51           HB1      LYS  51  86.600   6.961  15.873
  385    HG2  LYS  51           HG2      LYS  51  84.656   5.219  15.920
  386    HG3  LYS  51           HG1      LYS  51  84.810   5.258  14.171
  387    HD2  LYS  51           HD2      LYS  51  87.090   4.675  16.061
  388    HD3  LYS  51           HD1      LYS  51  86.135   3.448  15.247
  389    HE2  LYS  51           HE2      LYS  51  86.817   4.330  13.068
  390    HE3  LYS  51           HE1      LYS  51  87.722   5.608  13.858
  391    HZ1  LYS  51           HZ1      LYS  51  89.143   3.750  13.213
  392    HZ2  LYS  51           HZ2      LYS  51  88.236   2.711  14.205
  393    HZ3  LYS  51           HZ3      LYS  51  89.134   3.979  14.894
  394    H    LEU  52           HN       LEU  52  84.548   9.024  13.338
  395    HA   LEU  52           HA       LEU  52  86.190  11.220  13.818
  396    HB2  LEU  52           HB2      LEU  52  84.914  10.432  11.658
  397    HB3  LEU  52           HB1      LEU  52  83.649  11.514  12.228
  398    HG   LEU  52           HG       LEU  52  85.456  13.301  12.424
  399   HD11  LEU  52          HD11      LEU  52  87.530  12.272  12.301
  400   HD12  LEU  52          HD12      LEU  52  87.338  12.784  10.631
  401   HD13  LEU  52          HD13      LEU  52  87.008  11.113  11.081
  402   HD21  LEU  52          HD21      LEU  52  85.219  13.944  10.107
  403   HD22  LEU  52          HD22      LEU  52  83.738  13.103  10.560
  404   HD23  LEU  52          HD23      LEU  52  84.971  12.269   9.616
  405    H    ASP  53           HN       ASP  53  82.663  11.225  14.025
  406    HA   ASP  53           HA       ASP  53  81.193  12.321  15.447
  407    HB2  ASP  53           HB2      ASP  53  82.998  11.473  17.089
  408    HB3  ASP  53           HB1      ASP  53  83.523  13.145  17.149
  409    H    VAL  54           HN       VAL  54  81.022  13.792  13.659
  410    HA   VAL  54           HA       VAL  54  81.294  16.530  14.461
  411    HB   VAL  54           HB       VAL  54  83.626  16.236  13.948
  412   HG11  VAL  54          HG11      VAL  54  82.708  15.139  11.284
  413   HG12  VAL  54          HG12      VAL  54  83.335  14.173  12.622
  414   HG13  VAL  54          HG13      VAL  54  84.380  15.340  11.809
  415   HG21  VAL  54          HG21      VAL  54  83.924  17.901  12.230
  416   HG22  VAL  54          HG22      VAL  54  82.432  18.305  13.078
  417   HG23  VAL  54          HG23      VAL  54  82.364  17.513  11.505
  418    H    LYS  55           HN       LYS  55  79.947  17.835  13.174
  419    HA   LYS  55           HA       LYS  55  78.200  16.400  11.393
  420    HB2  LYS  55           HB2      LYS  55  77.368  18.299  12.689
  421    HB3  LYS  55           HB1      LYS  55  78.424  19.374  11.777
  422    HG2  LYS  55           HG2      LYS  55  77.057  19.374   9.942
  423    HG3  LYS  55           HG1      LYS  55  76.769  17.650  10.027
  424    HD2  LYS  55           HD2      LYS  55  74.922  17.881  11.440
  425    HD3  LYS  55           HD1      LYS  55  75.455  19.417  12.048
  426    HE2  LYS  55           HE2      LYS  55  74.894  20.528   9.970
  427    HE3  LYS  55           HE1      LYS  55  74.529  18.980   9.210
  428    HZ1  LYS  55           HZ1      LYS  55  72.545  18.845  10.228
  429    HZ2  LYS  55           HZ2      LYS  55  72.695  20.533  10.346
  430    HZ3  LYS  55           HZ3      LYS  55  73.098  19.547  11.669
  431    H    LYS  56           HN       LYS  56  80.879  16.146  10.537
  432    HA   LYS  56           HA       LYS  56  81.297  17.970   8.287
  433    HB2  LYS  56           HB2      LYS  56  83.212  16.884   9.424
  434    HB3  LYS  56           HB1      LYS  56  82.615  15.304   8.929
  435    HG2  LYS  56           HG2      LYS  56  82.855  15.955   6.558
  436    HG3  LYS  56           HG1      LYS  56  83.443  17.541   7.049
  437    HD2  LYS  56           HD2      LYS  56  84.818  15.047   8.050
  438    HD3  LYS  56           HD1      LYS  56  85.173  15.657   6.437
  439    HE2  LYS  56           HE2      LYS  56  85.488  17.184   9.041
  440    HE3  LYS  56           HE1      LYS  56  86.787  16.579   8.017
  441    HZ1  LYS  56           HZ1      LYS  56  84.938  18.813   7.541
  442    HZ2  LYS  56           HZ2      LYS  56  85.597  17.982   6.214
  443    HZ3  LYS  56           HZ3      LYS  56  86.619  18.746   7.335
  444    H    ASP  57           HN       ASP  57  81.129  17.282   6.048
  445    HA   ASP  57           HA       ASP  57  78.832  15.518   5.601
  446    HB2  ASP  57           HB2      ASP  57  79.511  16.184   3.105
  447    HB3  ASP  57           HB1      ASP  57  78.677  17.322   4.157
  448    H    TRP  58           HN       TRP  58  79.643  13.508   6.134
  449    HA   TRP  58           HA       TRP  58  82.091  12.483   4.916
  450    HB2  TRP  58           HB2      TRP  58  80.063  10.635   6.077
  451    HB3  TRP  58           HB1      TRP  58  81.793  10.661   6.301
  452    HD1  TRP  58           HD1      TRP  58  82.551  13.042   7.853
  453    HE1  TRP  58           HE1      TRP  58  81.445  13.707  10.104
  454    HE3  TRP  58           HE3      TRP  58  78.129  10.545   7.422
  455    HZ2  TRP  58           HZ2      TRP  58  78.991  13.228  11.511
  456    HZ3  TRP  58           HZ3      TRP  58  76.429  10.657   9.221
  457    HH2  TRP  58           HH2      TRP  58  76.857  11.982  11.263
  458    H    SER  59           HN       SER  59  78.635  11.983   4.578
  459    HA   SER  59           HA       SER  59  78.339   9.930   2.822
  460    HB2  SER  59           HB2      SER  59  76.429  11.202   1.845
  461    HB3  SER  59           HB1      SER  59  76.474  11.251   3.604
  462    HG   SER  59           HG       SER  59  76.504  13.331   3.366
  463    H    ASP  60           HN       ASP  60  78.961  13.273   1.693
  464    HA   ASP  60           HA       ASP  60  79.223  12.708  -1.043
  465    HB2  ASP  60           HB2      ASP  60  79.211  14.988  -0.269
  466    HB3  ASP  60           HB1      ASP  60  80.658  14.720   0.704
  467    H    HIS  61           HN       HIS  61  81.103  11.485   1.467
  468    HA   HIS  61           HA       HIS  61  83.530  11.140  -0.198
  469    HB2  HIS  61           HB2      HIS  61  84.700  10.988   1.769
  470    HB3  HIS  61           HB1      HIS  61  83.285  11.759   2.451
  471    HD1  HIS  61           HD1      HIS  61  82.057  10.457   4.245
  472    HD2  HIS  61           HD2      HIS  61  84.723   8.048   2.136
  473    HE1  HIS  61           HE1      HIS  61  82.090   8.221   5.425
  474    H    ALA  62           HN       ALA  62  84.591   8.963   0.121
  475    HA   ALA  62           HA       ALA  62  82.981   6.618   0.540
  476    HB1  ALA  62           HB1      ALA  62  82.658   5.839  -1.664
  477    HB2  ALA  62           HB2      ALA  62  83.812   6.992  -2.341
  478    HB3  ALA  62           HB3      ALA  62  82.235   7.547  -1.778
  479    H    LEU  63           HN       LEU  63  84.360   4.645   0.101
  480    HA   LEU  63           HA       LEU  63  87.217   5.360   0.545
  481    HB2  LEU  63           HB2      LEU  63  85.888   2.638   0.706
  482    HB3  LEU  63           HB1      LEU  63  87.495   3.058   1.273
  483    HG   LEU  63           HG       LEU  63  86.034   2.995   3.172
  484   HD11  LEU  63          HD11      LEU  63  86.277   5.939   2.601
  485   HD12  LEU  63          HD12      LEU  63  87.708   4.940   2.854
  486   HD13  LEU  63          HD13      LEU  63  86.501   5.089   4.128
  487   HD21  LEU  63          HD21      LEU  63  83.963   3.610   1.548
  488   HD22  LEU  63          HD22      LEU  63  84.251   5.208   2.236
  489   HD23  LEU  63          HD23      LEU  63  83.899   3.845   3.291
  490    H    TRP  64           HN       TRP  64  88.873   4.613  -0.776
  491    HA   TRP  64           HA       TRP  64  88.071   3.295  -3.364
  492    HB2  TRP  64           HB2      TRP  64  88.722   5.161  -4.499
  493    HB3  TRP  64           HB1      TRP  64  88.932   5.974  -2.973
  494    HD1  TRP  64           HD1      TRP  64  91.560   4.970  -1.846
  495    HE1  TRP  64           HE1      TRP  64  93.791   5.270  -3.085
  496    HE3  TRP  64           HE3      TRP  64  89.845   5.685  -6.604
  497    HZ2  TRP  64           HZ2      TRP  64  94.737   5.785  -5.732
  498    HZ3  TRP  64           HZ3      TRP  64  91.434   6.101  -8.460
  499    HH2  TRP  64           HH2      TRP  64  93.876   6.153  -8.031
  500    H    TRP  65           HN       TRP  65  89.644   1.855  -4.229
  501    HA   TRP  65           HA       TRP  65  91.684   0.955  -2.236
  502    HB2  TRP  65           HB2      TRP  65  89.816  -0.597  -3.134
  503    HB3  TRP  65           HB1      TRP  65  90.725  -0.606  -4.639
  504    HD1  TRP  65           HD1      TRP  65  93.431  -0.396  -2.364
  505    HE1  TRP  65           HE1      TRP  65  94.340  -2.700  -1.678
  506    HE3  TRP  65           HE3      TRP  65  89.520  -3.354  -3.796
  507    HZ2  TRP  65           HZ2      TRP  65  93.518  -5.435  -1.705
  508    HZ3  TRP  65           HZ3      TRP  65  89.621  -5.802  -3.459
  509    HH2  TRP  65           HH2      TRP  65  91.607  -6.849  -2.417
  510    H    GLU  66           HN       GLU  66  93.376   2.437  -2.880
  511    HA   GLU  66           HA       GLU  66  94.097   3.017  -5.537
  512    HB2  GLU  66           HB2      GLU  66  96.402   3.473  -4.618
  513    HB3  GLU  66           HB1      GLU  66  95.083   4.314  -3.824
  514    HG2  GLU  66           HG2      GLU  66  95.043   2.463  -2.111
  515    HG3  GLU  66           HG1      GLU  66  96.505   1.850  -2.867
  516    H    LYS  67           HN       LYS  67  94.624   0.031  -3.795
  517    HA   LYS  67           HA       LYS  67  96.833  -0.890  -5.402
  518    HB2  LYS  67           HB2      LYS  67  94.637  -2.441  -4.045
  519    HB3  LYS  67           HB1      LYS  67  95.985  -3.185  -4.864
  520    HG2  LYS  67           HG2      LYS  67  96.057  -2.767  -2.251
  521    HG3  LYS  67           HG1      LYS  67  97.494  -2.632  -3.217
  522    HD2  LYS  67           HD2      LYS  67  97.289  -0.218  -3.269
  523    HD3  LYS  67           HD1      LYS  67  95.745  -0.302  -2.416
  524    HE2  LYS  67           HE2      LYS  67  97.710   0.244  -0.940
  525    HE3  LYS  67           HE1      LYS  67  96.804  -1.186  -0.444
  526    HZ1  LYS  67           HZ1      LYS  67  98.426  -2.576  -1.539
  527    HZ2  LYS  67           HZ2      LYS  67  99.204  -1.560  -0.421
  528    HZ3  LYS  67           HZ3      LYS  67  99.281  -1.216  -2.083
  529    H    LYS  68           HN       LYS  68  93.545  -0.272  -5.857
  530    HA   LYS  68           HA       LYS  68  93.481  -1.620  -8.525
  531    HB2  LYS  68           HB2      LYS  68  90.964  -1.070  -6.972
  532    HB3  LYS  68           HB1      LYS  68  91.282  -2.322  -8.168
  533    HG2  LYS  68           HG2      LYS  68  92.633  -2.328  -5.451
  534    HG3  LYS  68           HG1      LYS  68  91.067  -3.060  -5.725
  535    HD2  LYS  68           HD2      LYS  68  91.934  -4.605  -7.320
  536    HD3  LYS  68           HD1      LYS  68  93.465  -3.737  -7.427
  537    HE2  LYS  68           HE2      LYS  68  94.224  -4.559  -5.388
  538    HE3  LYS  68           HE1      LYS  68  92.603  -4.800  -4.750
  539    HZ1  LYS  68           HZ1      LYS  68  92.313  -6.639  -6.285
  540    HZ2  LYS  68           HZ2      LYS  68  93.666  -6.897  -5.289
  541    HZ3  LYS  68           HZ3      LYS  68  93.875  -6.403  -6.901
  542    H    ARG  69           HN       ARG  69  93.253   1.305  -6.780
  543    HA   ARG  69           HA       ARG  69  92.563   3.459  -7.388
  544    HB2  ARG  69           HB2      ARG  69  93.134   2.272 -10.128
  545    HB3  ARG  69           HB1      ARG  69  92.675   3.949  -9.890
  546    HG2  ARG  69           HG2      ARG  69  94.997   4.134  -9.879
  547    HG3  ARG  69           HG1      ARG  69  94.677   3.955  -8.156
  548    HD2  ARG  69           HD2      ARG  69  96.471   2.443  -8.748
  549    HD3  ARG  69           HD1      ARG  69  95.029   1.487  -8.425
  550    HE   ARG  69           HE       ARG  69  94.994   0.850 -10.698
  551   HH11  ARG  69          HH11      ARG  69  95.849   0.846 -12.788
  552   HH12  ARG  69          HH12      ARG  69  97.030   2.034 -13.229
  553   HH21  ARG  69          HH21      ARG  69  97.040   3.562 -10.116
  554   HH22  ARG  69          HH22      ARG  69  97.704   3.572 -11.715
  555    H    THR  70           HN       THR  70  90.553   1.734  -6.717
  556    HA   THR  70           HA       THR  70  88.409   2.184  -8.775
  557    HB   THR  70           HB       THR  70  89.048  -0.178  -7.976
  558    HG1  THR  70           HG1      THR  70  86.611   1.010  -8.272
  559   HG21  THR  70          HG21      THR  70  88.485  -0.918  -5.852
  560   HG22  THR  70          HG22      THR  70  87.305   0.371  -5.611
  561   HG23  THR  70          HG23      THR  70  89.028   0.723  -5.502
  562    H    TRP  71           HN       TRP  71  86.211   1.959  -7.322
  563    HA   TRP  71           HA       TRP  71  86.399   3.888  -5.060
  564    HB2  TRP  71           HB2      TRP  71  84.059   4.663  -5.897
  565    HB3  TRP  71           HB1      TRP  71  85.488   5.311  -6.679
  566    HD1  TRP  71           HD1      TRP  71  84.587   1.754  -7.630
  567    HE1  TRP  71           HE1      TRP  71  83.599   1.742  -9.969
  568    HE3  TRP  71           HE3      TRP  71  84.048   6.774  -8.396
  569    HZ2  TRP  71           HZ2      TRP  71  82.706   3.589 -11.964
  570    HZ3  TRP  71           HZ3      TRP  71  83.127   7.618 -10.536
  571    HH2  TRP  71           HH2      TRP  71  82.455   6.033 -12.321
  572    H    LEU  72           HN       LEU  72  86.135   2.393  -3.497
  573    HA   LEU  72           HA       LEU  72  84.590   0.043  -3.694
  574    HB2  LEU  72           HB2      LEU  72  85.291   1.633  -1.233
  575    HB3  LEU  72           HB1      LEU  72  84.817  -0.056  -1.251
  576    HG   LEU  72           HG       LEU  72  87.159   0.994  -2.835
  577   HD11  LEU  72          HD11      LEU  72  87.532   1.461  -0.456
  578   HD12  LEU  72          HD12      LEU  72  88.616   0.198  -1.041
  579   HD13  LEU  72          HD13      LEU  72  87.201  -0.231  -0.077
  580   HD21  LEU  72          HD21      LEU  72  86.700  -1.099  -3.719
  581   HD22  LEU  72          HD22      LEU  72  86.061  -1.727  -2.197
  582   HD23  LEU  72          HD23      LEU  72  87.801  -1.550  -2.415
  583    H    LEU  73           HN       LEU  73  82.681   0.770  -4.692
  584    HA   LEU  73           HA       LEU  73  80.646   1.923  -2.816
  585    HB2  LEU  73           HB2      LEU  73  79.408   2.645  -4.873
  586    HB3  LEU  73           HB1      LEU  73  80.959   3.451  -4.676
  587    HG   LEU  73           HG       LEU  73  81.757   1.325  -6.201
  588   HD11  LEU  73          HD11      LEU  73  80.160   0.699  -7.830
  589   HD12  LEU  73          HD12      LEU  73  79.066   2.015  -7.401
  590   HD13  LEU  73          HD13      LEU  73  79.248   0.638  -6.323
  591   HD21  LEU  73          HD21      LEU  73  80.483   3.828  -7.351
  592   HD22  LEU  73          HD22      LEU  73  81.725   2.835  -8.110
  593   HD23  LEU  73          HD23      LEU  73  82.100   3.762  -6.663
  594    H    LYS  74           HN       LYS  74  81.767  -0.864  -3.967
  595    HA   LYS  74           HA       LYS  74  79.279  -2.097  -4.886
  596    HB2  LYS  74           HB2      LYS  74  82.104  -3.010  -4.413
  597    HB3  LYS  74           HB1      LYS  74  80.842  -4.233  -4.441
  598    HG2  LYS  74           HG2      LYS  74  81.806  -3.941  -6.683
  599    HG3  LYS  74           HG1      LYS  74  80.115  -3.458  -6.662
  600    HD2  LYS  74           HD2      LYS  74  81.460  -1.823  -7.906
  601    HD3  LYS  74           HD1      LYS  74  80.792  -1.092  -6.452
  602    HE2  LYS  74           HE2      LYS  74  83.322  -0.712  -7.032
  603    HE3  LYS  74           HE1      LYS  74  82.861  -1.040  -5.366
  604    HZ1  LYS  74           HZ1      LYS  74  83.698  -3.143  -7.280
  605    HZ2  LYS  74           HZ2      LYS  74  83.474  -3.304  -5.603
  606    HZ3  LYS  74           HZ3      LYS  74  84.764  -2.377  -6.206
  607    H    THR  75           HN       THR  75  78.557  -0.998  -2.574
  608    HA   THR  75           HA       THR  75  79.041  -2.226  -0.118
  609    HB   THR  75           HB       THR  75  76.258  -1.500  -1.064
  610    HG1  THR  75           HG1      THR  75  77.693   0.155  -1.607
  611   HG21  THR  75          HG21      THR  75  76.809  -2.556   1.265
  612   HG22  THR  75          HG22      THR  75  75.777  -1.127   1.200
  613   HG23  THR  75          HG23      THR  75  77.478  -0.964   1.633
  614    H    HIS  76           HN       HIS  76  77.390  -3.508  -2.894
  615    HA   HIS  76           HA       HIS  76  75.898  -5.590  -1.649
  616    HB2  HIS  76           HB2      HIS  76  77.200  -5.418  -4.380
  617    HB3  HIS  76           HB1      HIS  76  76.134  -6.736  -3.894
  618    HD1  HIS  76           HD1      HIS  76  75.257  -3.439  -2.495
  619    HD2  HIS  76           HD2      HIS  76  74.259  -5.661  -5.878
  620    HE1  HIS  76           HE1      HIS  76  73.189  -2.358  -3.477
  621    H    TRP  77           HN       TRP  77  76.466  -7.880  -1.553
  622    HA   TRP  77           HA       TRP  77  77.822  -9.634  -0.868
  623    HB2  TRP  77           HB2      TRP  77  79.952  -8.238  -2.453
  624    HB3  TRP  77           HB1      TRP  77  79.847  -9.957  -2.088
  625    HD1  TRP  77           HD1      TRP  77  78.812  -7.358  -4.519
  626    HE1  TRP  77           HE1      TRP  77  77.325  -8.381  -6.332
  627    HE3  TRP  77           HE3      TRP  77  77.895 -11.937  -2.447
  628    HZ2  TRP  77           HZ2      TRP  77  75.915 -10.813  -6.865
  629    HZ3  TRP  77           HZ3      TRP  77  76.474 -13.587  -3.634
  630    HH2  TRP  77           HH2      TRP  77  75.484 -13.031  -5.839
  631    H    THR  78           HN       THR  78  80.881  -9.052  -0.760
  632    HA   THR  78           HA       THR  78  80.983  -7.164   1.510
  633    HB   THR  78           HB       THR  78  82.127  -9.678   2.480
  634    HG1  THR  78           HG1      THR  78  79.362  -9.857   2.249
  635   HG21  THR  78          HG21      THR  78  80.161  -9.243   4.204
  636   HG22  THR  78          HG22      THR  78  80.095  -7.665   3.439
  637   HG23  THR  78          HG23      THR  78  81.592  -8.218   4.200
  638    H    LEU  79           HN       LEU  79  83.326  -8.028   2.666
  639    HA   LEU  79           HA       LEU  79  85.334  -7.022   0.822
  640    HB2  LEU  79           HB2      LEU  79  85.486  -8.347   3.533
  641    HB3  LEU  79           HB1      LEU  79  86.901  -7.761   2.684
  642    HG   LEU  79           HG       LEU  79  86.092  -5.476   2.778
  643   HD11  LEU  79          HD11      LEU  79  83.604  -6.772   3.883
  644   HD12  LEU  79          HD12      LEU  79  83.736  -5.701   2.484
  645   HD13  LEU  79          HD13      LEU  79  83.942  -5.058   4.111
  646   HD21  LEU  79          HD21      LEU  79  85.948  -7.047   5.371
  647   HD22  LEU  79          HD22      LEU  79  85.787  -5.287   5.347
  648   HD23  LEU  79          HD23      LEU  79  87.268  -6.043   4.764
  649    H    ASP  80           HN       ASP  80  84.847 -10.042   2.558
  650    HA   ASP  80           HA       ASP  80  86.746 -11.729   1.526
  651    HB2  ASP  80           HB2      ASP  80  84.973 -12.285   3.179
  652    HB3  ASP  80           HB1      ASP  80  83.825 -12.413   1.848
  653    H    LYS  81           HN       LYS  81  83.572 -11.117   0.016
  654    HA   LYS  81           HA       LYS  81  83.989 -12.825  -2.158
  655    HB2  LYS  81           HB2      LYS  81  81.825 -12.249  -2.429
  656    HB3  LYS  81           HB1      LYS  81  82.040 -10.874  -1.364
  657    HG2  LYS  81           HG2      LYS  81  82.930 -10.713  -4.239
  658    HG3  LYS  81           HG1      LYS  81  81.251 -10.485  -3.832
  659    HD2  LYS  81           HD2      LYS  81  82.051  -8.767  -2.136
  660    HD3  LYS  81           HD1      LYS  81  83.603  -8.856  -2.902
  661    HE2  LYS  81           HE2      LYS  81  82.720  -8.129  -5.012
  662    HE3  LYS  81           HE1      LYS  81  81.069  -8.250  -4.412
  663    HZ1  LYS  81           HZ1      LYS  81  83.037  -6.497  -3.092
  664    HZ2  LYS  81           HZ2      LYS  81  81.341  -6.421  -3.041
  665    HZ3  LYS  81           HZ3      LYS  81  82.172  -5.964  -4.450
  666    H    TYR  82           HN       TYR  82  85.162  -9.628  -1.556
  667    HA   TYR  82           HA       TYR  82  86.171  -9.294  -4.293
  668    HB2  TYR  82           HB2      TYR  82  85.469  -7.518  -2.388
  669    HB3  TYR  82           HB1      TYR  82  87.181  -7.624  -2.019
  670    HD1  TYR  82           HD1      TYR  82  88.454  -7.942  -4.646
  671    HD2  TYR  82           HD2      TYR  82  85.108  -5.496  -3.512
  672    HE1  TYR  82           HE1      TYR  82  88.942  -6.406  -6.522
  673    HE2  TYR  82           HE2      TYR  82  85.601  -3.959  -5.392
  674    HH   TYR  82           HH       TYR  82  86.776  -3.734  -7.320
  675    H    GLY  83           HN       GLY  83  87.575  -9.829  -1.061
  676    HA2  GLY  83           HA2      GLY  83  89.371 -11.588  -0.902
  677    HA3  GLY  83           HA1      GLY  83  90.049 -10.927  -2.391
  678    H    ILE  84           HN       ILE  84  88.743  -8.494  -0.518
  679    HA   ILE  84           HA       ILE  84  91.221  -7.176  -0.030
  680    HB   ILE  84           HB       ILE  84  88.491  -6.868   1.260
  681   HG12  ILE  84          HG12      ILE  84  89.715  -4.929  -0.692
  682   HG13  ILE  84          HG11      ILE  84  89.012  -6.424  -1.305
  683   HG21  ILE  84          HG21      ILE  84  90.938  -5.115   1.392
  684   HG22  ILE  84          HG22      ILE  84  90.120  -5.896   2.737
  685   HG23  ILE  84          HG23      ILE  84  89.329  -4.586   1.873
  686   HD11  ILE  84          HD11      ILE  84  87.475  -4.338  -1.114
  687   HD12  ILE  84          HD12      ILE  84  87.484  -4.673   0.617
  688   HD13  ILE  84          HD13      ILE  84  86.858  -5.874  -0.510
  689    H    GLN  85           HN       GLN  85  92.161  -6.737   2.184
  690    HA   GLN  85           HA       GLN  85  91.437  -8.638   4.296
  691    HB2  GLN  85           HB2      GLN  85  93.204  -9.654   2.528
  692    HB3  GLN  85           HB1      GLN  85  94.326  -8.819   3.593
  693    HG2  GLN  85           HG2      GLN  85  94.192 -10.847   4.736
  694    HG3  GLN  85           HG1      GLN  85  92.832 -10.016   5.509
  695   HE21  GLN  85          HE21      GLN  85  90.890 -10.146   3.535
  696   HE22  GLN  85          HE22      GLN  85  90.486 -11.757   3.225
  697    H    ALA  86           HN       ALA  86  93.788  -8.405   5.816
  698    HA   ALA  86           HA       ALA  86  93.515  -5.735   6.917
  699    HB1  ALA  86           HB1      ALA  86  94.902  -6.537   8.632
  700    HB2  ALA  86           HB2      ALA  86  95.758  -7.640   7.544
  701    HB3  ALA  86           HB3      ALA  86  94.112  -8.005   8.054
  702    H    ASP  87           HN       ASP  87  95.667  -7.225   4.645
  703    HA   ASP  87           HA       ASP  87  97.738  -5.167   4.927
  704    HB2  ASP  87           HB2      ASP  87  98.415  -7.390   4.381
  705    HB3  ASP  87           HB1      ASP  87  97.303  -7.472   3.030
  706    H    ALA  88           HN       ALA  88  94.748  -5.103   3.669
  707    HA   ALA  88           HA       ALA  88  95.409  -3.661   1.160
  708    HB1  ALA  88           HB1      ALA  88  93.411  -5.349   1.675
  709    HB2  ALA  88           HB2      ALA  88  93.169  -3.978   0.587
  710    HB3  ALA  88           HB3      ALA  88  92.626  -3.882   2.264
  711    H    LYS  89           HN       LYS  89  95.984  -1.515   1.442
  712    HA   LYS  89           HA       LYS  89  94.734   0.019   3.676
  713    HB2  LYS  89           HB2      LYS  89  96.855   1.130   1.854
  714    HB3  LYS  89           HB1      LYS  89  96.508   1.533   3.533
  715    HG2  LYS  89           HG2      LYS  89  97.627  -1.131   2.613
  716    HG3  LYS  89           HG1      LYS  89  98.585   0.194   3.238
  717    HD2  LYS  89           HD2      LYS  89  97.644   0.032   5.404
  718    HD3  LYS  89           HD1      LYS  89  96.308  -0.963   4.836
  719    HE2  LYS  89           HE2      LYS  89  97.965  -2.347   5.997
  720    HE3  LYS  89           HE1      LYS  89  97.863  -2.773   4.288
  721    HZ1  LYS  89           HZ1      LYS  89  99.925  -1.084   5.592
  722    HZ2  LYS  89           HZ2      LYS  89  99.778  -1.267   3.910
  723    HZ3  LYS  89           HZ3      LYS  89 100.150  -2.608   4.884
  724    H    LEU  90           HN       LEU  90  93.005   1.108   3.269
  725    HA   LEU  90           HA       LEU  90  92.437   2.082   0.505
  726    HB2  LEU  90           HB2      LEU  90  90.361   2.211   2.664
  727    HB3  LEU  90           HB1      LEU  90  90.169   1.892   0.944
  728    HG   LEU  90           HG       LEU  90  91.385  -0.015   2.944
  729   HD11  LEU  90          HD11      LEU  90  89.251  -1.323   2.364
  730   HD12  LEU  90          HD12      LEU  90  88.640   0.197   1.713
  731   HD13  LEU  90          HD13      LEU  90  89.063   0.077   3.420
  732   HD21  LEU  90          HD21      LEU  90  92.277  -0.294   0.665
  733   HD22  LEU  90          HD22      LEU  90  90.638  -0.334   0.018
  734   HD23  LEU  90          HD23      LEU  90  91.208  -1.638   1.064
  735    H    GLN  91           HN       GLN  91  91.004   4.183   0.699
  736    HA   GLN  91           HA       GLN  91  92.245   6.072   2.655
  737    HB2  GLN  91           HB2      GLN  91  91.625   6.758  -0.227
  738    HB3  GLN  91           HB1      GLN  91  92.503   7.742   0.936
  739    HG2  GLN  91           HG2      GLN  91  94.454   6.473   0.741
  740    HG3  GLN  91           HG1      GLN  91  93.603   5.033   0.226
  741   HE21  GLN  91          HE21      GLN  91  92.519   7.850  -1.342
  742   HE22  GLN  91          HE22      GLN  91  93.333   7.612  -2.806
  743    H    PHE  92           HN       PHE  92  90.860   7.944   3.047
  744    HA   PHE  92           HA       PHE  92  87.980   7.518   2.304
  745    HB2  PHE  92           HB2      PHE  92  87.856   7.034   4.570
  746    HB3  PHE  92           HB1      PHE  92  89.303   7.942   4.943
  747    HD1  PHE  92           HD1      PHE  92  86.363   9.421   3.119
  748    HD2  PHE  92           HD2      PHE  92  88.448   9.045   6.864
  749    HE1  PHE  92           HE1      PHE  92  85.032  11.282   4.075
  750    HE2  PHE  92           HE2      PHE  92  87.097  10.892   7.800
  751    HZ   PHE  92           HZ       PHE  92  85.388  12.009   6.402
  752    H    THR  93           HN       THR  93  88.090   8.933   0.604
  753    HA   THR  93           HA       THR  93  88.900  11.764   1.204
  754    HB   THR  93           HB       THR  93  90.252  11.013  -0.570
  755    HG1  THR  93           HG1      THR  93  89.556  12.786  -1.483
  756   HG21  THR  93          HG21      THR  93  89.304   9.723  -2.497
  757   HG22  THR  93          HG22      THR  93  87.768   9.652  -1.635
  758   HG23  THR  93          HG23      THR  93  89.196   8.868  -0.959
  759    HA   PRO  94           HA       PRO  94  84.649  12.987   0.620
  760    HB2  PRO  94           HB2      PRO  94  84.976  15.560  -0.283
  761    HB3  PRO  94           HB1      PRO  94  85.242  15.082   1.407
  762    HG2  PRO  94           HG2      PRO  94  87.244  15.484  -0.777
  763    HG3  PRO  94           HG1      PRO  94  87.311  15.998   0.920
  764    HD2  PRO  94           HD2      PRO  94  88.632  13.792   0.039
  765    HD3  PRO  94           HD1      PRO  94  87.947  13.886   1.676
  766    H    TYR 541           HT1      TYR 541  45.477  38.331  15.163
  767    HA   TYR 541           HA       TYR 541  45.837  40.389  13.774
  768    HB2  TYR 541           HB2      TYR 541  45.412  41.559  16.340
  769    HB3  TYR 541           HB1      TYR 541  47.112  41.829  15.976
  770    HD1  TYR 541           HD1      TYR 541  47.760  43.027  13.864
  771    HD2  TYR 541           HD2      TYR 541  43.674  42.697  15.149
  772    HE1  TYR 541           HE1      TYR 541  47.128  44.869  12.329
  773    HE2  TYR 541           HE2      TYR 541  43.043  44.540  13.614
  774    HH   TYR 541           HH       TYR 541  43.743  45.810  11.884
  775    H    HIS 542           HN       HIS 542  46.969  37.910  15.426
  776    HA   HIS 542           HA       HIS 542  49.748  38.382  15.810
  777    HB2  HIS 542           HB2      HIS 542  48.336  35.815  15.022
  778    HB3  HIS 542           HB1      HIS 542  49.949  35.935  15.714
  779    HD1  HIS 542           HD1      HIS 542  46.326  36.199  16.600
  780    HD2  HIS 542           HD2      HIS 542  50.018  36.611  18.493
  781    HE1  HIS 542           HE1      HIS 542  45.851  36.284  19.086
  782    H    GLU 543           HN       GLU 543  50.454  36.003  13.985
  783    HA   GLU 543           HA       GLU 543  50.129  36.880  11.270
  784    HB2  GLU 543           HB2      GLU 543  52.515  37.608  10.905
  785    HB3  GLU 543           HB1      GLU 543  51.562  38.731  11.874
  786    HG2  GLU 543           HG2      GLU 543  52.508  37.814  13.932
  787    HG3  GLU 543           HG1      GLU 543  53.399  36.602  13.010
  788    H    ARG 544           HN       ARG 544  51.780  34.966  13.664
  789    HA   ARG 544           HA       ARG 544  53.031  32.983  13.495
  790    HB2  ARG 544           HB2      ARG 544  50.609  32.681  11.742
  791    HB3  ARG 544           HB1      ARG 544  51.698  31.329  12.032
  792    HG2  ARG 544           HG2      ARG 544  49.899  31.236  13.667
  793    HG3  ARG 544           HG1      ARG 544  51.389  31.670  14.490
  794    HD2  ARG 544           HD2      ARG 544  50.747  33.889  14.790
  795    HD3  ARG 544           HD1      ARG 544  49.612  33.865  13.450
  796    HE   ARG 544           HE       ARG 544  49.052  33.293  16.226
  797   HH11  ARG 544          HH11      ARG 544  47.206  32.214  16.884
  798   HH12  ARG 544          HH12      ARG 544  46.254  31.357  15.719
  799   HH21  ARG 544          HH21      ARG 544  48.301  32.171  13.046
  800   HH22  ARG 544          HH22      ARG 544  46.873  31.332  13.552
  801    H    ARG 545           HN       ARG 545  54.967  33.770  12.486
  802    HA   ARG 545           HA       ARG 545  55.310  34.252   9.723
  803    HB2  ARG 545           HB2      ARG 545  57.323  33.147  11.697
  804    HB3  ARG 545           HB1      ARG 545  57.694  33.956  10.181
  805    HG2  ARG 545           HG2      ARG 545  57.140  36.061  10.990
  806    HG3  ARG 545           HG1      ARG 545  55.948  35.427  12.120
  807    HD2  ARG 545           HD2      ARG 545  58.091  36.357  13.153
  808    HD3  ARG 545           HD1      ARG 545  57.608  34.736  13.661
  809    HE   ARG 545           HE       ARG 545  59.297  34.263  11.525
  810   HH11  ARG 545          HH11      ARG 545  61.530  33.999  11.765
  811   HH12  ARG 545          HH12      ARG 545  62.332  34.715  13.123
  812   HH21  ARG 545          HH21      ARG 545  59.438  36.095  14.443
  813   HH22  ARG 545          HH22      ARG 545  61.148  35.901  14.638
  814    H    GLY 546           HN       GLY 546  56.825  31.461  11.291
  815    HA2  GLY 546           HA2      GLY 546  55.990  29.770   8.943
  816    HA3  GLY 546           HA1      GLY 546  57.572  29.647   9.705
  817    H    SER 547           HN       SER 547  57.750  28.579  11.734
  818    HA   SER 547           HA       SER 547  55.481  27.607  13.225
  819    HB2  SER 547           HB2      SER 547  56.614  25.941  11.013
  820    HB3  SER 547           HB1      SER 547  56.172  25.115  12.504
  821    HG   SER 547           HG       SER 547  54.532  26.756  10.862
  822    H    LEU 548           HN       LEU 548  56.417  27.414  15.262
  823    HA   LEU 548           HA       LEU 548  59.221  27.479  15.621
  824    HB2  LEU 548           HB2      LEU 548  56.860  27.103  17.364
  825    HB3  LEU 548           HB1      LEU 548  58.338  26.383  17.996
  826    HG   LEU 548           HG       LEU 548  59.482  28.617  17.560
  827   HD11  LEU 548          HD11      LEU 548  58.077  29.702  16.011
  828   HD12  LEU 548          HD12      LEU 548  57.776  30.559  17.516
  829   HD13  LEU 548          HD13      LEU 548  56.624  29.357  16.940
  830   HD21  LEU 548          HD21      LEU 548  58.536  27.828  19.790
  831   HD22  LEU 548          HD22      LEU 548  57.137  28.843  19.440
  832   HD23  LEU 548          HD23      LEU 548  58.738  29.569  19.600
  833    H    CYS 549           HN       CYS 549  60.776  25.947  15.801
  834    HA   CYS 549           HA       CYS 549  60.051  23.190  15.054
  835    HB2  CYS 549           HB2      CYS 549  62.042  23.880  14.014
  836    HB3  CYS 549           HB1      CYS 549  62.553  24.817  15.398
  837    H    SER 550           HN       SER 550  59.075  22.226  16.763
  838    HA   SER 550           HA       SER 550  59.346  22.815  19.462
  839    HB2  SER 550           HB2      SER 550  57.537  21.457  18.830
  840    HB3  SER 550           HB1      SER 550  58.582  20.224  18.129
  841    HG   SER 550           HG       SER 550  58.310  20.945  20.862
  842    H    GLY 551           HN       GLY 551  60.787  22.536  20.939
  843    HA2  GLY 551           HA2      GLY 551  62.514  21.273  22.123
  844    HA3  GLY 551           HA1      GLY 551  62.947  20.504  20.590
  845    H    CYS 552           HN       CYS 552  62.542  23.070  19.203
  846    HA   CYS 552           HA       CYS 552  65.134  24.394  19.899
  847    HB2  CYS 552           HB2      CYS 552  64.543  23.071  17.685
  848    HB3  CYS 552           HB1      CYS 552  63.740  24.568  17.250
  849    H    GLN 553           HN       GLN 553  61.732  24.670  19.212
  850    HA   GLN 553           HA       GLN 553  60.239  26.400  19.239
  851    HB2  GLN 553           HB2      GLN 553  61.929  27.098  21.617
  852    HB3  GLN 553           HB1      GLN 553  60.339  27.787  21.279
  853    HG2  GLN 553           HG2      GLN 553  60.859  24.819  21.460
  854    HG3  GLN 553           HG1      GLN 553  60.300  25.782  22.813
  855   HE21  GLN 553          HE21      GLN 553  59.416  24.649  19.575
  856   HE22  GLN 553          HE22      GLN 553  57.739  24.843  19.769
  857    H    LYS 554           HN       LYS 554  61.580  26.967  17.285
  858    HA   LYS 554           HA       LYS 554  61.833  29.909  17.324
  859    HB2  LYS 554           HB2      LYS 554  63.896  28.084  16.108
  860    HB3  LYS 554           HB1      LYS 554  63.825  29.808  15.808
  861    HG2  LYS 554           HG2      LYS 554  64.118  28.563  18.550
  862    HG3  LYS 554           HG1      LYS 554  65.463  29.163  17.593
  863    HD2  LYS 554           HD2      LYS 554  64.038  31.386  17.505
  864    HD3  LYS 554           HD1      LYS 554  63.241  30.697  18.919
  865    HE2  LYS 554           HE2      LYS 554  65.389  30.500  20.074
  866    HE3  LYS 554           HE1      LYS 554  66.231  31.111  18.650
  867    HZ1  LYS 554           HZ1      LYS 554  65.957  33.092  19.608
  868    HZ2  LYS 554           HZ2      LYS 554  64.746  32.539  20.662
  869    HZ3  LYS 554           HZ3      LYS 554  64.351  32.993  19.073
  870    HA   PRO 555           HA       PRO 555  58.909  29.077  13.984
  871    HB2  PRO 555           HB2      PRO 555  60.074  31.506  12.746
  872    HB3  PRO 555           HB1      PRO 555  58.385  31.111  13.078
  873    HG2  PRO 555           HG2      PRO 555  59.852  32.873  14.596
  874    HG3  PRO 555           HG1      PRO 555  58.474  31.963  15.222
  875    HD2  PRO 555           HD2      PRO 555  61.336  31.635  15.865
  876    HD3  PRO 555           HD1      PRO 555  59.920  30.966  16.710
  877    H    ILE 556           HN       ILE 556  59.038  27.850  12.254
  878    HA   ILE 556           HA       ILE 556  61.649  27.420  10.913
  879    HB   ILE 556           HB       ILE 556  58.981  25.968  10.823
  880   HG12  ILE 556          HG12      ILE 556  61.580  24.810  11.823
  881   HG13  ILE 556          HG11      ILE 556  60.671  25.861  12.886
  882   HG21  ILE 556          HG21      ILE 556  61.594  25.467   9.395
  883   HG22  ILE 556          HG22      ILE 556  59.989  25.665   8.690
  884   HG23  ILE 556          HG23      ILE 556  60.373  24.222   9.625
  885   HD11  ILE 556          HD11      ILE 556  59.068  23.739  11.540
  886   HD12  ILE 556          HD12      ILE 556  59.006  24.313  13.206
  887   HD13  ILE 556          HD13      ILE 556  60.251  23.173  12.716
  888    H    THR 557           HN       THR 557  61.813  29.177   9.465
  889    HA   THR 557           HA       THR 557  59.481  29.765   7.704
  890    HB   THR 557           HB       THR 557  60.439  31.876   7.355
  891    HG1  THR 557           HG1      THR 557  62.870  30.773   8.317
  892   HG21  THR 557          HG21      THR 557  59.765  31.310   9.759
  893   HG22  THR 557          HG22      THR 557  60.830  32.704   9.558
  894   HG23  THR 557          HG23      THR 557  61.490  31.157  10.094
  895    H    GLY 558           HN       GLY 558  59.631  28.027   6.282
  896    HA2  GLY 558           HA2      GLY 558  60.763  28.270   3.830
  897    HA3  GLY 558           HA1      GLY 558  62.078  27.522   4.749
  898    H    ARG 559           HN       ARG 559  61.888  25.409   5.383
  899    HA   ARG 559           HA       ARG 559  59.506  23.885   4.416
  900    HB2  ARG 559           HB2      ARG 559  62.456  23.312   4.540
  901    HB3  ARG 559           HB1      ARG 559  61.353  21.953   4.748
  902    HG2  ARG 559           HG2      ARG 559  60.945  23.866   2.461
  903    HG3  ARG 559           HG1      ARG 559  62.176  22.617   2.330
  904    HD2  ARG 559           HD2      ARG 559  60.481  20.895   2.855
  905    HD3  ARG 559           HD1      ARG 559  59.236  22.131   2.951
  906    HE   ARG 559           HE       ARG 559  60.228  20.843   0.569
  907   HH11  ARG 559          HH11      ARG 559  59.980  21.707  -1.482
  908   HH12  ARG 559          HH12      ARG 559  59.503  23.363  -1.661
  909   HH21  ARG 559          HH21      ARG 559  59.315  23.962   1.741
  910   HH22  ARG 559          HH22      ARG 559  59.131  24.634   0.157
  911    H    CYS 560           HN       CYS 560  58.645  22.308   5.907
  912    HA   CYS 560           HA       CYS 560  59.812  22.319   8.630
  913    HB2  CYS 560           HB2      CYS 560  57.633  22.794   9.678
  914    HB3  CYS 560           HB1      CYS 560  58.217  24.156   8.719
  915    HG   CYS 560           HG       CYS 560  55.649  23.542   8.159
  916    H    ILE 561           HN       ILE 561  59.887  20.412   9.440
  917    HA   ILE 561           HA       ILE 561  58.308  18.221   8.249
  918    HB   ILE 561           HB       ILE 561  60.502  18.272  10.343
  919   HG12  ILE 561          HG12      ILE 561  60.418  17.560   7.418
  920   HG13  ILE 561          HG11      ILE 561  61.228  18.951   8.121
  921   HG21  ILE 561          HG21      ILE 561  59.381  15.875   8.862
  922   HG22  ILE 561          HG22      ILE 561  58.902  16.295  10.511
  923   HG23  ILE 561          HG23      ILE 561  60.577  15.870  10.158
  924   HD11  ILE 561          HD11      ILE 561  62.929  17.302   7.767
  925   HD12  ILE 561          HD12      ILE 561  61.928  16.031   8.481
  926   HD13  ILE 561          HD13      ILE 561  62.588  17.315   9.496
  927    H    THR 562           HN       THR 562  56.884  17.050   9.462
  928    HA   THR 562           HA       THR 562  56.099  18.195  12.112
  929    HB   THR 562           HB       THR 562  54.159  16.845  10.252
  930    HG1  THR 562           HG1      THR 562  55.093  19.471  10.332
  931   HG21  THR 562          HG21      THR 562  53.697  17.037  12.723
  932   HG22  THR 562          HG22      THR 562  52.509  17.847  11.698
  933   HG23  THR 562          HG23      THR 562  53.747  18.791  12.527
  934    H    ALA 563           HN       ALA 563  55.537  16.789  13.691
  935    HA   ALA 563           HA       ALA 563  56.164  13.907  13.190
  936    HB1  ALA 563           HB1      ALA 563  56.660  15.482  15.717
  937    HB2  ALA 563           HB2      ALA 563  57.884  15.230  14.468
  938    HB3  ALA 563           HB3      ALA 563  57.217  13.847  15.350
  939    H    MET 564           HN       MET 564  55.466  14.017  16.263
  940    HA   MET 564           HA       MET 564  52.852  12.872  16.032
  941    HB2  MET 564           HB2      MET 564  53.943  14.083  18.561
  942    HB3  MET 564           HB1      MET 564  52.985  12.613  18.360
  943    HG2  MET 564           HG2      MET 564  55.026  11.741  16.990
  944    HG3  MET 564           HG1      MET 564  55.901  13.060  17.766
  945    HE1  MET 564           HE1      MET 564  55.233  13.512  20.447
  946    HE2  MET 564           HE2      MET 564  56.866  13.017  20.006
  947    HE3  MET 564           HE3      MET 564  56.078  12.289  21.405
  948    H    ALA 565           HN       ALA 565  53.303  15.578  15.016
  949    HA   ALA 565           HA       ALA 565  51.537  17.192  14.600
  950    HB1  ALA 565           HB1      ALA 565  51.133  17.262  17.604
  951    HB2  ALA 565           HB2      ALA 565  50.114  16.307  16.519
  952    HB3  ALA 565           HB3      ALA 565  50.166  18.060  16.368
  953    H    LYS 566           HN       LYS 566  54.290  16.818  16.456
  954    HA   LYS 566           HA       LYS 566  54.690  19.675  17.048
  955    HB2  LYS 566           HB2      LYS 566  56.185  17.125  17.459
  956    HB3  LYS 566           HB1      LYS 566  57.175  18.570  17.300
  957    HG2  LYS 566           HG2      LYS 566  56.162  19.614  19.166
  958    HG3  LYS 566           HG1      LYS 566  54.816  18.477  19.182
  959    HD2  LYS 566           HD2      LYS 566  57.612  17.408  19.516
  960    HD3  LYS 566           HD1      LYS 566  56.842  18.204  20.883
  961    HE2  LYS 566           HE2      LYS 566  55.129  16.601  21.021
  962    HE3  LYS 566           HE1      LYS 566  55.345  16.079  19.345
  963    HZ1  LYS 566           HZ1      LYS 566  56.279  14.680  21.340
  964    HZ2  LYS 566           HZ2      LYS 566  57.586  15.756  21.210
  965    HZ3  LYS 566           HZ3      LYS 566  57.134  14.799  19.881
  966    H    LYS 567           HN       LYS 567  56.528  20.850  16.050
  967    HA   LYS 567           HA       LYS 567  56.809  20.151  13.154
  968    HB2  LYS 567           HB2      LYS 567  57.625  22.787  14.327
  969    HB3  LYS 567           HB1      LYS 567  57.008  22.440  12.723
  970    HG2  LYS 567           HG2      LYS 567  55.394  22.376  15.299
  971    HG3  LYS 567           HG1      LYS 567  55.319  23.626  14.071
  972    HD2  LYS 567           HD2      LYS 567  54.621  20.701  13.571
  973    HD3  LYS 567           HD1      LYS 567  53.450  21.983  13.880
  974    HE2  LYS 567           HE2      LYS 567  54.585  23.216  11.894
  975    HE3  LYS 567           HE1      LYS 567  55.258  21.635  11.502
  976    HZ1  LYS 567           HZ1      LYS 567  53.182  21.985  10.347
  977    HZ2  LYS 567           HZ2      LYS 567  52.378  22.274  11.816
  978    HZ3  LYS 567           HZ3      LYS 567  53.010  20.734  11.479
  979    H    PHE 568           HN       PHE 568  59.128  20.962  12.326
  980    HA   PHE 568           HA       PHE 568  61.215  20.691  14.381
  981    HB2  PHE 568           HB2      PHE 568  60.271  18.360  12.858
  982    HB3  PHE 568           HB1      PHE 568  61.988  18.611  12.619
  983    HD1  PHE 568           HD1      PHE 568  59.508  17.234  14.782
  984    HD2  PHE 568           HD2      PHE 568  63.403  19.047  14.786
  985    HE1  PHE 568           HE1      PHE 568  59.968  16.241  17.008
  986    HE2  PHE 568           HE2      PHE 568  63.862  18.054  17.011
  987    HZ   PHE 568           HZ       PHE 568  62.145  16.651  18.122
  988    H    HIS 569           HN       HIS 569  63.046  21.678  13.704
  989    HA   HIS 569           HA       HIS 569  63.162  23.172  11.299
  990    HB2  HIS 569           HB2      HIS 569  65.168  22.213  13.290
  991    HB3  HIS 569           HB1      HIS 569  65.786  22.816  11.768
  992    HD2  HIS 569           HD2      HIS 569  64.360  25.558  11.274
  993    HE1  HIS 569           HE1      HIS 569  65.065  26.415  15.340
  994    HA   PRO 570           HA       PRO 570  63.412  19.378   8.748
  995    HB2  PRO 570           HB2      PRO 570  64.572  21.287   6.759
  996    HB3  PRO 570           HB1      PRO 570  63.234  20.142   6.570
  997    HG2  PRO 570           HG2      PRO 570  62.845  22.836   6.827
  998    HG3  PRO 570           HG1      PRO 570  61.667  21.636   7.370
  999    HD2  PRO 570           HD2      PRO 570  63.418  23.384   9.001
 1000    HD3  PRO 570           HD1      PRO 570  61.928  22.530   9.467
 1001    H    GLU 571           HN       GLU 571  65.861  21.529   9.780
 1002    HA   GLU 571           HA       GLU 571  68.094  19.915   8.720
 1003    HB2  GLU 571           HB2      GLU 571  68.406  22.257  10.583
 1004    HB3  GLU 571           HB1      GLU 571  69.478  21.708   9.297
 1005    HG2  GLU 571           HG2      GLU 571  67.638  22.304   7.660
 1006    HG3  GLU 571           HG1      GLU 571  66.804  23.075   9.013
 1007    H    HIS 572           HN       HIS 572  66.971  21.113  11.880
 1008    HA   HIS 572           HA       HIS 572  68.793  19.552  13.424
 1009    HB2  HIS 572           HB2      HIS 572  66.039  20.466  14.307
 1010    HB3  HIS 572           HB1      HIS 572  67.421  20.121  15.343
 1011    HD2  HIS 572           HD2      HIS 572  69.462  21.714  13.007
 1012    HE1  HIS 572           HE1      HIS 572  67.582  25.140  14.565
 1013    H    PHE 573           HN       PHE 573  66.399  18.462  11.429
 1014    HA   PHE 573           HA       PHE 573  66.303  15.834  12.880
 1015    HB2  PHE 573           HB2      PHE 573  64.108  17.225  12.844
 1016    HB3  PHE 573           HB1      PHE 573  64.067  16.838  11.131
 1017    HD1  PHE 573           HD1      PHE 573  64.412  15.231  14.490
 1018    HD2  PHE 573           HD2      PHE 573  63.168  14.782  10.403
 1019    HE1  PHE 573           HE1      PHE 573  63.478  12.996  15.020
 1020    HE2  PHE 573           HE2      PHE 573  62.233  12.547  10.933
 1021    HZ   PHE 573           HZ       PHE 573  62.388  11.654  13.242
 1022    H    VAL 574           HN       VAL 574  68.306  16.206  11.218
 1023    HA   VAL 574           HA       VAL 574  67.594  15.482   8.458
 1024    HB   VAL 574           HB       VAL 574  70.082  15.631   8.114
 1025   HG11  VAL 574          HG11      VAL 574  68.177  17.752   8.727
 1026   HG12  VAL 574          HG12      VAL 574  69.401  17.689   7.474
 1027   HG13  VAL 574          HG13      VAL 574  69.829  18.272   9.063
 1028   HG21  VAL 574          HG21      VAL 574  70.034  16.721  10.952
 1029   HG22  VAL 574          HG22      VAL 574  71.449  16.527   9.911
 1030   HG23  VAL 574          HG23      VAL 574  70.608  15.105  10.528
 1031    H    CYS 575           HN       CYS 575  69.269  13.823   7.485
 1032    HA   CYS 575           HA       CYS 575  68.980  11.266   8.925
 1033    HB2  CYS 575           HB2      CYS 575  68.769  10.635   6.752
 1034    HB3  CYS 575           HB1      CYS 575  69.455  12.156   6.191
 1035    H    ALA 576           HN       ALA 576  70.758  10.081   9.850
 1036    HA   ALA 576           HA       ALA 576  73.206  11.786  10.150
 1037    HB1  ALA 576           HB1      ALA 576  73.783   9.624  11.638
 1038    HB2  ALA 576           HB2      ALA 576  72.033   9.395  11.555
 1039    HB3  ALA 576           HB3      ALA 576  72.695  10.879  12.235
 1040    H    PHE 577           HN       PHE 577  73.586  11.445   7.823
 1041    HA   PHE 577           HA       PHE 577  75.691   9.473   7.360
 1042    HB2  PHE 577           HB2      PHE 577  73.680   8.261   6.434
 1043    HB3  PHE 577           HB1      PHE 577  73.370   9.637   5.390
 1044    HD1  PHE 577           HD1      PHE 577  75.959   7.027   6.179
 1045    HD2  PHE 577           HD2      PHE 577  74.473   9.868   3.315
 1046    HE1  PHE 577           HE1      PHE 577  77.498   6.117   4.478
 1047    HE2  PHE 577           HE2      PHE 577  76.016   8.940   1.611
 1048    HZ   PHE 577           HZ       PHE 577  77.529   7.071   2.193
 1049    H    CYS 578           HN       CYS 578  73.447  11.733   6.041
 1050    HA   CYS 578           HA       CYS 578  75.577  13.652   5.243
 1051    HB2  CYS 578           HB2      CYS 578  74.214  14.243   3.275
 1052    HB3  CYS 578           HB1      CYS 578  74.621  12.540   3.209
 1053    H    LEU 579           HN       LEU 579  75.059  14.458   7.386
 1054    HA   LEU 579           HA       LEU 579  72.592  15.093   8.473
 1055    HB2  LEU 579           HB2      LEU 579  75.209  16.536   8.709
 1056    HB3  LEU 579           HB1      LEU 579  73.819  16.820   9.752
 1057    HG   LEU 579           HG       LEU 579  74.773  13.983   9.381
 1058   HD11  LEU 579          HD11      LEU 579  76.006  15.898  11.362
 1059   HD12  LEU 579          HD12      LEU 579  76.807  15.331   9.896
 1060   HD13  LEU 579          HD13      LEU 579  76.382  14.197  11.169
 1061   HD21  LEU 579          HD21      LEU 579  74.053  13.892  11.801
 1062   HD22  LEU 579          HD22      LEU 579  72.762  14.291  10.674
 1063   HD23  LEU 579          HD23      LEU 579  73.508  15.560  11.644
 1064    H    LYS 580           HN       LYS 580  73.070  16.237   5.448
 1065    HA   LYS 580           HA       LYS 580  72.436  19.061   6.084
 1066    HB2  LYS 580           HB2      LYS 580  72.944  19.563   3.895
 1067    HB3  LYS 580           HB1      LYS 580  73.859  18.077   4.063
 1068    HG2  LYS 580           HG2      LYS 580  71.047  18.187   2.887
 1069    HG3  LYS 580           HG1      LYS 580  72.520  18.251   1.936
 1070    HD2  LYS 580           HD2      LYS 580  73.119  16.060   2.432
 1071    HD3  LYS 580           HD1      LYS 580  72.153  16.015   3.902
 1072    HE2  LYS 580           HE2      LYS 580  71.268  14.722   1.847
 1073    HE3  LYS 580           HE1      LYS 580  70.141  15.757   2.722
 1074    HZ1  LYS 580           HZ1      LYS 580  70.167  17.336   1.077
 1075    HZ2  LYS 580           HZ2      LYS 580  70.326  15.919   0.153
 1076    HZ3  LYS 580           HZ3      LYS 580  71.690  16.875   0.490
 1077    H    GLN 581           HN       GLN 581  70.570  16.241   4.759
 1078    HA   GLN 581           HA       GLN 581  68.197  17.644   5.667
 1079    HB2  GLN 581           HB2      GLN 581  68.704  18.716   3.475
 1080    HB3  GLN 581           HB1      GLN 581  68.296  17.182   2.707
 1081    HG2  GLN 581           HG2      GLN 581  66.278  18.445   2.698
 1082    HG3  GLN 581           HG1      GLN 581  66.087  17.317   4.025
 1083   HE21  GLN 581          HE21      GLN 581  66.612  18.200   6.253
 1084   HE22  GLN 581          HE22      GLN 581  66.354  19.847   6.533
 1085    H    LEU 582           HN       LEU 582  66.479  16.472   6.045
 1086    HA   LEU 582           HA       LEU 582  66.258  13.742   4.889
 1087    HB2  LEU 582           HB2      LEU 582  67.236  13.738   7.225
 1088    HB3  LEU 582           HB1      LEU 582  65.699  14.369   7.791
 1089    HG   LEU 582           HG       LEU 582  64.566  12.355   6.924
 1090   HD11  LEU 582          HD11      LEU 582  67.234  11.890   5.718
 1091   HD12  LEU 582          HD12      LEU 582  65.654  11.384   5.149
 1092   HD13  LEU 582          HD13      LEU 582  66.477  10.454   6.400
 1093   HD21  LEU 582          HD21      LEU 582  65.842  10.691   8.466
 1094   HD22  LEU 582          HD22      LEU 582  65.167  12.154   9.180
 1095   HD23  LEU 582          HD23      LEU 582  66.885  12.066   8.823
 1096    H    ASN 583           HN       ASN 583  63.977  12.881   5.329
 1097    HA   ASN 583           HA       ASN 583  61.935  15.036   5.598
 1098    HB2  ASN 583           HB2      ASN 583  62.382  13.265   3.187
 1099    HB3  ASN 583           HB1      ASN 583  60.780  13.902   3.549
 1100   HD21  ASN 583          HD21      ASN 583  61.811  14.779   1.203
 1101   HD22  ASN 583          HD22      ASN 583  62.375  16.370   1.331
 1102    H    LYS 584           HN       LYS 584  60.005  14.271   6.461
 1103    HA   LYS 584           HA       LYS 584  60.065  11.843   7.962
 1104    HB2  LYS 584           HB2      LYS 584  57.607  12.317   8.250
 1105    HB3  LYS 584           HB1      LYS 584  58.666  13.667   8.666
 1106    HG2  LYS 584           HG2      LYS 584  58.027  14.934   6.826
 1107    HG3  LYS 584           HG1      LYS 584  57.705  13.522   5.818
 1108    HD2  LYS 584           HD2      LYS 584  55.620  14.703   6.424
 1109    HD3  LYS 584           HD1      LYS 584  55.660  13.067   7.075
 1110    HE2  LYS 584           HE2      LYS 584  56.144  13.832   9.270
 1111    HE3  LYS 584           HE1      LYS 584  56.578  15.441   8.695
 1112    HZ1  LYS 584           HZ1      LYS 584  53.894  14.528   8.056
 1113    HZ2  LYS 584           HZ2      LYS 584  54.435  16.065   8.540
 1114    HZ3  LYS 584           HZ3      LYS 584  54.195  14.843   9.696
 1115    H    GLY 585           HN       GLY 585  59.321  12.496   4.695
 1116    HA2  GLY 585           HA2      GLY 585  57.646  10.098   4.340
 1117    HA3  GLY 585           HA1      GLY 585  58.074  11.268   3.095
 1118    H    THR 586           HN       THR 586  60.912  11.021   4.224
 1119    HA   THR 586           HA       THR 586  61.626   8.375   3.020
 1120    HB   THR 586           HB       THR 586  63.215   9.314   1.588
 1121    HG1  THR 586           HG1      THR 586  64.297  10.573   3.074
 1122   HG21  THR 586          HG21      THR 586  62.093  11.079   0.366
 1123   HG22  THR 586          HG22      THR 586  61.165  11.540   1.795
 1124   HG23  THR 586          HG23      THR 586  60.856   9.995   1.004
 1125    H    PHE 587           HN       PHE 587  61.435   9.451   5.832
 1126    HA   PHE 587           HA       PHE 587  64.306   9.522   6.603
 1127    HB2  PHE 587           HB2      PHE 587  63.503  10.779   8.293
 1128    HB3  PHE 587           HB1      PHE 587  61.869  10.451   7.776
 1129    HD1  PHE 587           HD1      PHE 587  60.464   8.897   8.946
 1130    HD2  PHE 587           HD2      PHE 587  64.627   9.258   9.939
 1131    HE1  PHE 587           HE1      PHE 587  60.098   7.525  10.978
 1132    HE2  PHE 587           HE2      PHE 587  64.262   7.887  11.972
 1133    HZ   PHE 587           HZ       PHE 587  61.996   7.020  12.492
 1134    H    LYS 588           HN       LYS 588  65.299   7.726   6.650
 1135    HA   LYS 588           HA       LYS 588  64.012   5.191   7.530
 1136    HB2  LYS 588           HB2      LYS 588  65.663   5.831   5.338
 1137    HB3  LYS 588           HB1      LYS 588  66.754   5.065   6.449
 1138    HG2  LYS 588           HG2      LYS 588  65.712   3.480   4.821
 1139    HG3  LYS 588           HG1      LYS 588  65.467   3.044   6.497
 1140    HD2  LYS 588           HD2      LYS 588  63.481   2.895   4.770
 1141    HD3  LYS 588           HD1      LYS 588  63.184   3.443   6.401
 1142    HE2  LYS 588           HE2      LYS 588  62.847   5.661   5.721
 1143    HE3  LYS 588           HE1      LYS 588  63.836   5.470   4.291
 1144    HZ1  LYS 588           HZ1      LYS 588  61.300   5.548   4.051
 1145    HZ2  LYS 588           HZ2      LYS 588  61.356   3.933   4.575
 1146    HZ3  LYS 588           HZ3      LYS 588  62.172   4.399   3.159
 1147    H    GLU 589           HN       GLU 589  65.587   3.789   8.896
 1148    HA   GLU 589           HA       GLU 589  67.468   5.409  10.502
 1149    HB2  GLU 589           HB2      GLU 589  65.590   5.939  11.783
 1150    HB3  GLU 589           HB1      GLU 589  64.841   4.367  11.540
 1151    HG2  GLU 589           HG2      GLU 589  66.361   3.321  13.072
 1152    HG3  GLU 589           HG1      GLU 589  67.404   4.746  13.123
 1153    H    GLN 590           HN       GLN 590  68.714   4.198  11.910
 1154    HA   GLN 590           HA       GLN 590  68.614   1.300  11.973
 1155    HB2  GLN 590           HB2      GLN 590  69.839   2.095   9.751
 1156    HB3  GLN 590           HB1      GLN 590  71.166   2.448  10.841
 1157    HG2  GLN 590           HG2      GLN 590  71.722   0.249  10.460
 1158    HG3  GLN 590           HG1      GLN 590  70.526  -0.051  11.718
 1159   HE21  GLN 590          HE21      GLN 590  71.331  -1.628   9.184
 1160   HE22  GLN 590          HE22      GLN 590  69.854  -1.928   8.402
 1161    H    ASN 591           HN       ASN 591  69.913   0.587  13.743
 1162    HA   ASN 591           HA       ASN 591  70.788   0.901  15.886
 1163    HB2  ASN 591           HB2      ASN 591  72.770   2.868  15.511
 1164    HB3  ASN 591           HB1      ASN 591  72.995   1.137  15.374
 1165   HD21  ASN 591          HD21      ASN 591  71.817   0.476  13.018
 1166   HD22  ASN 591          HD22      ASN 591  72.492   1.335  11.722
 1167    H    ASP 592           HN       ASP 592  68.586   2.769  14.927
 1168    HA   ASP 592           HA       ASP 592  67.275   4.345  16.083
 1169    HB2  ASP 592           HB2      ASP 592  69.567   5.016  17.909
 1170    HB3  ASP 592           HB1      ASP 592  67.837   5.044  18.241
 1171    H    LYS 593           HN       LYS 593  70.106   4.890  14.465
 1172    HA   LYS 593           HA       LYS 593  70.144   7.813  14.771
 1173    HB2  LYS 593           HB2      LYS 593  71.717   6.082  12.894
 1174    HB3  LYS 593           HB1      LYS 593  72.099   7.716  13.413
 1175    HG2  LYS 593           HG2      LYS 593  72.080   6.688  15.818
 1176    HG3  LYS 593           HG1      LYS 593  72.252   5.149  14.978
 1177    HD2  LYS 593           HD2      LYS 593  74.293   5.917  13.889
 1178    HD3  LYS 593           HD1      LYS 593  74.102   7.524  14.594
 1179    HE2  LYS 593           HE2      LYS 593  74.505   4.947  16.146
 1180    HE3  LYS 593           HE1      LYS 593  75.725   6.193  15.888
 1181    HZ1  LYS 593           HZ1      LYS 593  74.902   6.813  17.906
 1182    HZ2  LYS 593           HZ2      LYS 593  73.332   6.254  17.579
 1183    HZ3  LYS 593           HZ3      LYS 593  73.877   7.711  16.896
 1184    HA   PRO 594           HA       PRO 594  67.061   8.188  11.418
 1185    HB2  PRO 594           HB2      PRO 594  68.504  10.760  10.968
 1186    HB3  PRO 594           HB1      PRO 594  66.774  10.472  11.150
 1187    HG2  PRO 594           HG2      PRO 594  68.277  11.585  13.105
 1188    HG3  PRO 594           HG1      PRO 594  66.897  10.536  13.466
 1189    HD2  PRO 594           HD2      PRO 594  69.808   9.958  13.750
 1190    HD3  PRO 594           HD1      PRO 594  68.421   9.221  14.585
 1191    H    TYR 595           HN       TYR 595  67.173   8.450   8.965
 1192    HA   TYR 595           HA       TYR 595  69.784   8.516   7.672
 1193    HB2  TYR 595           HB2      TYR 595  68.499   5.892   8.339
 1194    HB3  TYR 595           HB1      TYR 595  69.364   6.027   6.823
 1195    HD1  TYR 595           HD1      TYR 595  71.725   7.328   7.120
 1196    HD2  TYR 595           HD2      TYR 595  69.734   5.000  10.116
 1197    HE1  TYR 595           HE1      TYR 595  73.902   6.898   8.244
 1198    HE2  TYR 595           HE2      TYR 595  71.904   4.585  11.235
 1199    HH   TYR 595           HH       TYR 595  74.947   5.757   9.838
 1200    H    CYS 596           HN       CYS 596  69.479   8.936   5.461
 1201    HA   CYS 596           HA       CYS 596  66.728   8.993   4.423
 1202    HB2  CYS 596           HB2      CYS 596  69.236   9.090   2.722
 1203    HB3  CYS 596           HB1      CYS 596  67.646   9.727   2.346
 1204    H    GLN 597           HN       GLN 597  66.037   7.443   2.726
 1205    HA   GLN 597           HA       GLN 597  66.877   4.798   3.352
 1206    HB2  GLN 597           HB2      GLN 597  64.768   4.833   2.340
 1207    HB3  GLN 597           HB1      GLN 597  65.239   6.046   1.181
 1208    HG2  GLN 597           HG2      GLN 597  65.094   4.169  -0.191
 1209    HG3  GLN 597           HG1      GLN 597  66.788   4.109   0.250
 1210   HE21  GLN 597          HE21      GLN 597  66.303   3.231   3.008
 1211   HE22  GLN 597          HE22      GLN 597  65.789   1.636   2.924
 1212    H    ASN 598           HN       ASN 598  67.535   6.753   0.463
 1213    HA   ASN 598           HA       ASN 598  69.425   5.177  -0.802
 1214    HB2  ASN 598           HB2      ASN 598  69.941   8.126  -0.533
 1215    HB3  ASN 598           HB1      ASN 598  70.065   7.101  -1.957
 1216   HD21  ASN 598          HD21      ASN 598  67.654   5.860  -2.082
 1217   HD22  ASN 598          HD22      ASN 598  66.401   6.986  -2.242
 1218    H    CYS 599           HN       CYS 599  69.776   6.928   2.192
 1219    HA   CYS 599           HA       CYS 599  72.695   6.628   2.229
 1220    HB2  CYS 599           HB2      CYS 599  70.687   7.653   4.250
 1221    HB3  CYS 599           HB1      CYS 599  72.416   7.558   4.563
 1222    H    PHE 600           HN       PHE 600  70.113   5.552   4.493
 1223    HA   PHE 600           HA       PHE 600  71.636   3.638   5.854
 1224    HB2  PHE 600           HB2      PHE 600  69.611   3.733   6.914
 1225    HB3  PHE 600           HB1      PHE 600  68.780   4.229   5.450
 1226    HD1  PHE 600           HD1      PHE 600  67.847   2.575   3.906
 1227    HD2  PHE 600           HD2      PHE 600  69.780   1.375   7.542
 1228    HE1  PHE 600           HE1      PHE 600  66.860   0.311   3.680
 1229    HE2  PHE 600           HE2      PHE 600  68.793  -0.890   7.320
 1230    HZ   PHE 600           HZ       PHE 600  67.334  -1.422   5.389
 1231    H    LEU 601           HN       LEU 601  69.543   3.079   2.999
 1232    HA   LEU 601           HA       LEU 601  70.148   0.374   2.627
 1233    HB2  LEU 601           HB2      LEU 601  68.881   0.661   0.752
 1234    HB3  LEU 601           HB1      LEU 601  68.760   2.347   1.229
 1235    HG   LEU 601           HG       LEU 601  70.834   2.805  -0.142
 1236   HD11  LEU 601          HD11      LEU 601  72.070   1.059  -0.869
 1237   HD12  LEU 601          HD12      LEU 601  70.754   0.590  -1.939
 1238   HD13  LEU 601          HD13      LEU 601  70.861  -0.095  -0.320
 1239   HD21  LEU 601          HD21      LEU 601  68.439   3.078  -0.952
 1240   HD22  LEU 601          HD22      LEU 601  68.617   1.523  -1.756
 1241   HD23  LEU 601          HD23      LEU 601  69.640   2.881  -2.223
 1242    H    LYS 602           HN       LYS 602  71.979   3.228   1.613
 1243    HA   LYS 602           HA       LYS 602  74.010   1.955   0.136
 1244    HB2  LYS 602           HB2      LYS 602  73.590   4.534   1.209
 1245    HB3  LYS 602           HB1      LYS 602  75.122   4.043   1.895
 1246    HG2  LYS 602           HG2      LYS 602  74.480   3.896  -1.058
 1247    HG3  LYS 602           HG1      LYS 602  75.278   5.266  -0.311
 1248    HD2  LYS 602           HD2      LYS 602  77.274   4.192  -0.540
 1249    HD3  LYS 602           HD1      LYS 602  76.703   2.953   0.575
 1250    HE2  LYS 602           HE2      LYS 602  77.504   2.127  -1.690
 1251    HE3  LYS 602           HE1      LYS 602  75.897   1.595  -1.208
 1252    HZ1  LYS 602           HZ1      LYS 602  74.931   2.776  -2.835
 1253    HZ2  LYS 602           HZ2      LYS 602  76.468   2.742  -3.558
 1254    HZ3  LYS 602           HZ3      LYS 602  75.978   4.097  -2.658
 1255    H    LEU 603           HN       LEU 603  73.372   1.883   3.555
 1256    HA   LEU 603           HA       LEU 603  76.045   0.774   4.180
 1257    HB2  LEU 603           HB2      LEU 603  73.834   1.022   6.198
 1258    HB3  LEU 603           HB1      LEU 603  75.573   1.215   6.416
 1259    HG   LEU 603           HG       LEU 603  73.728   3.124   4.952
 1260   HD11  LEU 603          HD11      LEU 603  75.376   3.705   7.405
 1261   HD12  LEU 603          HD12      LEU 603  73.758   3.014   7.539
 1262   HD13  LEU 603          HD13      LEU 603  73.985   4.585   6.774
 1263   HD21  LEU 603          HD21      LEU 603  75.774   4.564   4.836
 1264   HD22  LEU 603          HD22      LEU 603  75.923   3.095   3.879
 1265   HD23  LEU 603          HD23      LEU 603  76.721   3.208   5.445
 1266    H    PHE 604           HN       PHE 604  72.651  -0.276   4.791
 1267    HA   PHE 604           HA       PHE 604  73.666  -3.090   4.962
 1268    HB2  PHE 604           HB2      PHE 604  71.216  -1.689   6.038
 1269    HB3  PHE 604           HB1      PHE 604  71.284  -3.448   5.930
 1270    HD1  PHE 604           HD1      PHE 604  72.678  -0.458   7.581
 1271    HD2  PHE 604           HD2      PHE 604  72.851  -4.742   7.283
 1272    HE1  PHE 604           HE1      PHE 604  73.992  -0.553   9.680
 1273    HE2  PHE 604           HE2      PHE 604  74.166  -4.834   9.383
 1274    HZ   PHE 604           HZ       PHE 604  74.736  -2.740  10.581
 1275    H    CYS 605           HN       CYS 605  71.475  -1.028   3.125
 1276    HA   CYS 605           HA       CYS 605  70.049  -1.540   1.320
 1277    HB2  CYS 605           HB2      CYS 605  71.194  -2.479  -0.500
 1278    HB3  CYS 605           HB1      CYS 605  72.505  -1.866   0.502
 1279    HG   CYS 605           HG       CYS 605  72.752  -4.381   1.439
  Start of MODEL   18
    1    H    MET   1           HT1      MET   1  93.995 -21.972   8.235
    2    HA   MET   1           HA       MET   1  93.747 -23.675  10.040
    3    HB2  MET   1           HB2      MET   1  95.688 -23.432   8.373
    4    HB3  MET   1           HB1      MET   1  96.580 -22.671   9.688
    5    HG2  MET   1           HG2      MET   1  95.932 -24.767  11.071
    6    HG3  MET   1           HG1      MET   1  95.538 -25.497   9.516
    7    HE1  MET   1           HE1      MET   1  97.424 -27.227  10.709
    8    HE2  MET   1           HE2      MET   1  98.739 -27.324   9.540
    9    HE3  MET   1           HE3      MET   1  97.074 -27.214   8.975
   10    H    ALA   2           HN       ALA   2  96.613 -22.937  11.451
   11    HA   ALA   2           HA       ALA   2  95.639 -21.210  13.610
   12    HB1  ALA   2           HB1      ALA   2  94.749 -23.572  14.070
   13    HB2  ALA   2           HB2      ALA   2  95.696 -22.829  15.359
   14    HB3  ALA   2           HB3      ALA   2  96.433 -24.041  14.309
   15    H    LEU   3           HN       LEU   3  98.079 -23.635  12.729
   16    HA   LEU   3           HA       LEU   3 100.260 -22.892  14.242
   17    HB2  LEU   3           HB2      LEU   3 100.068 -23.664  11.330
   18    HB3  LEU   3           HB1      LEU   3 101.625 -23.440  12.123
   19    HG   LEU   3           HG       LEU   3  99.461 -25.303  13.142
   20   HD11  LEU   3          HD11      LEU   3 101.057 -27.091  12.252
   21   HD12  LEU   3          HD12      LEU   3 101.837 -25.798  11.340
   22   HD13  LEU   3          HD13      LEU   3 100.144 -26.192  11.039
   23   HD21  LEU   3          HD21      LEU   3 102.239 -24.583  14.021
   24   HD22  LEU   3          HD22      LEU   3 101.739 -26.263  14.199
   25   HD23  LEU   3          HD23      LEU   3 100.821 -24.986  14.986
   26    H    ASP   4           HN       ASP   4 100.160 -21.833  10.938
   27    HA   ASP   4           HA       ASP   4 100.780 -19.887   9.889
   28    HB2  ASP   4           HB2      ASP   4  98.892 -18.841  10.891
   29    HB3  ASP   4           HB1      ASP   4  99.680 -18.770  12.459
   30    H    GLY   5           HN       GLY   5 102.308 -21.049  12.584
   31    HA2  GLY   5           HA2      GLY   5 104.806 -20.955  12.484
   32    HA3  GLY   5           HA1      GLY   5 104.636 -19.228  12.181
   33    H    ILE   6           HN       ILE   6 102.234 -19.567  14.077
   34    HA   ILE   6           HA       ILE   6 103.777 -19.275  16.632
   35    HB   ILE   6           HB       ILE   6 101.458 -17.838  17.039
   36   HG12  ILE   6          HG12      ILE   6 100.982 -18.344  14.528
   37   HG13  ILE   6          HG11      ILE   6 100.768 -16.705  15.098
   38   HG21  ILE   6          HG21      ILE   6 102.877 -15.814  16.380
   39   HG22  ILE   6          HG22      ILE   6 104.136 -16.982  15.979
   40   HG23  ILE   6          HG23      ILE   6 103.519 -16.881  17.629
   41   HD11  ILE   6          HD11      ILE   6 102.219 -17.377  12.888
   42   HD12  ILE   6          HD12      ILE   6 103.496 -17.307  14.097
   43   HD13  ILE   6          HD13      ILE   6 102.473 -15.902  13.816
   44    H    ARG   7           HN       ARG   7 100.346 -19.146  16.960
   45    HA   ARG   7           HA       ARG   7 100.002 -22.026  17.191
   46    HB2  ARG   7           HB2      ARG   7  99.362 -21.805  19.649
   47    HB3  ARG   7           HB1      ARG   7 101.067 -21.776  19.258
   48    HG2  ARG   7           HG2      ARG   7  99.764 -19.107  19.291
   49    HG3  ARG   7           HG1      ARG   7  99.853 -19.921  20.855
   50    HD2  ARG   7           HD2      ARG   7 102.306 -20.247  20.481
   51    HD3  ARG   7           HD1      ARG   7 102.155 -19.294  19.010
   52    HE   ARG   7           HE       ARG   7 101.051 -17.756  21.105
   53   HH11  ARG   7          HH11      ARG   7 102.305 -16.156  22.094
   54   HH12  ARG   7          HH12      ARG   7 104.031 -16.238  21.986
   55   HH21  ARG   7          HH21      ARG   7 104.040 -19.157  20.115
   56   HH22  ARG   7          HH22      ARG   7 105.014 -17.937  20.865
   57    H    MET   8           HN       MET   8  98.191 -19.859  19.309
   58    HA   MET   8           HA       MET   8  95.971 -19.849  17.298
   59    HB2  MET   8           HB2      MET   8  94.934 -20.168  20.021
   60    HB3  MET   8           HB1      MET   8  94.583 -21.087  18.572
   61    HG2  MET   8           HG2      MET   8  96.795 -22.277  18.886
   62    HG3  MET   8           HG1      MET   8  96.905 -21.522  20.468
   63    HE1  MET   8           HE1      MET   8  96.054 -24.866  19.003
   64    HE2  MET   8           HE2      MET   8  95.946 -25.375  20.687
   65    HE3  MET   8           HE3      MET   8  97.234 -24.282  20.185
   66    HA   PRO   9           HA       PRO   9  95.061 -16.139  20.335
   67    HB2  PRO   9           HB2      PRO   9  97.851 -15.797  21.400
   68    HB3  PRO   9           HB1      PRO   9  96.296 -15.449  22.190
   69    HG2  PRO   9           HG2      PRO   9  97.613 -17.595  22.879
   70    HG3  PRO   9           HG1      PRO   9  95.865 -17.704  22.576
   71    HD2  PRO   9           HD2      PRO   9  98.116 -18.500  20.758
   72    HD3  PRO   9           HD1      PRO   9  96.647 -19.388  21.152
   73    H    ASP  10           HN       ASP  10  98.165 -16.692  18.856
   74    HA   ASP  10           HA       ASP  10  97.964 -14.108  17.342
   75    HB2  ASP  10           HB2      ASP  10 100.003 -14.532  18.882
   76    HB3  ASP  10           HB1      ASP  10 100.484 -15.745  17.697
   77    H    GLY  11           HN       GLY  11  98.265 -17.555  17.259
   78    HA2  GLY  11           HA2      GLY  11  98.783 -17.673  14.377
   79    HA3  GLY  11           HA1      GLY  11  98.486 -19.040  15.445
   80    H    CYS  12           HN       CYS  12  96.131 -16.749  16.022
   81    HA   CYS  12           HA       CYS  12  94.357 -17.347  13.790
   82    HB2  CYS  12           HB2      CYS  12  94.087 -19.466  14.871
   83    HB3  CYS  12           HB1      CYS  12  93.975 -18.713  16.461
   84    HG   CYS  12           HG       CYS  12  91.526 -18.806  16.014
   85    H    TYR  13           HN       TYR  13  94.544 -16.331  17.185
   86    HA   TYR  13           HA       TYR  13  93.942 -14.258  18.110
   87    HB2  TYR  13           HB2      TYR  13  93.896 -13.427  15.594
   88    HB3  TYR  13           HB1      TYR  13  92.149 -13.571  15.781
   89    HD1  TYR  13           HD1      TYR  13  95.156 -11.736  16.801
   90    HD2  TYR  13           HD2      TYR  13  90.939 -12.223  17.457
   91    HE1  TYR  13           HE1      TYR  13  95.098  -9.583  18.032
   92    HE2  TYR  13           HE2      TYR  13  90.881 -10.070  18.686
   93    HH   TYR  13           HH       TYR  13  92.080  -8.392  19.509
   94    H    ALA  14           HN       ALA  14  91.045 -14.946  16.162
   95    HA   ALA  14           HA       ALA  14  89.625 -16.633  17.831
   96    HB1  ALA  14           HB1      ALA  14  89.659 -15.409  19.795
   97    HB2  ALA  14           HB2      ALA  14  88.263 -14.631  19.052
   98    HB3  ALA  14           HB3      ALA  14  89.856 -13.878  18.945
   99    H    ASP  15           HN       ASP  15  89.447 -13.573  16.096
  100    HA   ASP  15           HA       ASP  15  87.060 -14.624  14.640
  101    HB2  ASP  15           HB2      ASP  15  86.480 -12.886  16.438
  102    HB3  ASP  15           HB1      ASP  15  87.353 -11.722  15.439
  103    H    GLY  16           HN       GLY  16  90.181 -13.607  14.475
  104    HA2  GLY  16           HA2      GLY  16  91.536 -12.963  12.662
  105    HA3  GLY  16           HA1      GLY  16  90.184 -13.410  11.619
  106    H    THR  17           HN       THR  17  90.336 -10.938  14.160
  107    HA   THR  17           HA       THR  17  89.012  -9.028  12.419
  108    HB   THR  17           HB       THR  17  88.450  -8.668  14.672
  109    HG1  THR  17           HG1      THR  17  90.642  -6.967  14.173
  110   HG21  THR  17          HG21      THR  17  91.386  -9.109  15.206
  111   HG22  THR  17          HG22      THR  17  90.031 -10.091  15.763
  112   HG23  THR  17          HG23      THR  17  90.281  -8.477  16.427
  113    H    TRP  18           HN       TRP  18  89.936  -7.688  11.088
  114    HA   TRP  18           HA       TRP  18  92.756  -6.816  11.496
  115    HB2  TRP  18           HB2      TRP  18  92.485  -6.760   8.754
  116    HB3  TRP  18           HB1      TRP  18  93.267  -8.059   9.640
  117    HD1  TRP  18           HD1      TRP  18  89.760  -7.148   8.284
  118    HE1  TRP  18           HE1      TRP  18  88.553  -9.347   7.671
  119    HE3  TRP  18           HE3      TRP  18  93.230 -10.539   9.880
  120    HZ2  TRP  18           HZ2      TRP  18  88.999 -12.165   7.845
  121    HZ3  TRP  18           HZ3      TRP  18  92.813 -12.971   9.644
  122    HH2  TRP  18           HH2      TRP  18  90.704 -13.787   8.629
  123    H    GLU  19           HN       GLU  19  92.706  -4.644  11.729
  124    HA   GLU  19           HA       GLU  19  90.308  -3.162  11.057
  125    HB2  GLU  19           HB2      GLU  19  92.264  -1.217  11.538
  126    HB3  GLU  19           HB1      GLU  19  91.170  -1.891  12.739
  127    HG2  GLU  19           HG2      GLU  19  93.548  -2.019  13.424
  128    HG3  GLU  19           HG1      GLU  19  92.775  -3.600  13.311
  129    H    LEU  20           HN       LEU  20  89.834  -2.183   9.177
  130    HA   LEU  20           HA       LEU  20  91.819  -2.323   7.018
  131    HB2  LEU  20           HB2      LEU  20  88.942  -2.216   7.190
  132    HB3  LEU  20           HB1      LEU  20  89.459  -0.835   6.233
  133    HG   LEU  20           HG       LEU  20  89.093  -2.713   4.752
  134   HD11  LEU  20          HD11      LEU  20  91.373  -1.193   4.754
  135   HD12  LEU  20          HD12      LEU  20  90.943  -2.340   3.487
  136   HD13  LEU  20          HD13      LEU  20  92.053  -2.823   4.766
  137   HD21  LEU  20          HD21      LEU  20  91.282  -4.353   5.990
  138   HD22  LEU  20          HD22      LEU  20  89.845  -4.878   5.122
  139   HD23  LEU  20          HD23      LEU  20  89.712  -4.361   6.794
  140    H    SER  21           HN       SER  21  92.990  -0.605   6.303
  141    HA   SER  21           HA       SER  21  93.007   1.794   7.961
  142    HB2  SER  21           HB2      SER  21  94.982   0.572   6.683
  143    HB3  SER  21           HB1      SER  21  94.478   1.617   5.358
  144    HG   SER  21           HG       SER  21  94.860   3.390   6.635
  145    H    VAL  22           HN       VAL  22  92.403   3.854   7.340
  146    HA   VAL  22           HA       VAL  22  91.076   4.154   4.693
  147    HB   VAL  22           HB       VAL  22  89.824   4.708   7.388
  148   HG11  VAL  22          HG11      VAL  22  88.001   5.856   6.042
  149   HG12  VAL  22          HG12      VAL  22  89.131   5.913   4.687
  150   HG13  VAL  22          HG13      VAL  22  89.493   6.781   6.182
  151   HG21  VAL  22          HG21      VAL  22  89.402   2.534   6.306
  152   HG22  VAL  22          HG22      VAL  22  88.873   3.374   4.839
  153   HG23  VAL  22          HG23      VAL  22  87.935   3.522   6.328
  154    H    HIS  23           HN       HIS  23  92.401   5.574   3.795
  155    HA   HIS  23           HA       HIS  23  93.633   7.768   5.290
  156    HB2  HIS  23           HB2      HIS  23  93.607   6.731   2.482
  157    HB3  HIS  23           HB1      HIS  23  94.112   8.406   2.725
  158    HD1  HIS  23           HD1      HIS  23  94.916   4.988   4.253
  159    HD2  HIS  23           HD2      HIS  23  96.810   8.570   3.269
  160    HE1  HIS  23           HE1      HIS  23  97.371   4.674   4.794
  161    H    VAL  24           HN       VAL  24  92.070   9.266   6.008
  162    HA   VAL  24           HA       VAL  24  89.739   9.844   4.378
  163    HB   VAL  24           HB       VAL  24  90.766  11.670   6.555
  164   HG11  VAL  24          HG11      VAL  24  87.990  10.732   5.757
  165   HG12  VAL  24          HG12      VAL  24  88.714  12.261   5.259
  166   HG13  VAL  24          HG13      VAL  24  88.364  11.962   6.962
  167   HG21  VAL  24          HG21      VAL  24  89.595  10.185   8.183
  168   HG22  VAL  24          HG22      VAL  24  90.992   9.399   7.449
  169   HG23  VAL  24          HG23      VAL  24  89.365   9.000   6.898
  170    H    THR  25           HN       THR  25  89.936  10.914   2.497
  171    HA   THR  25           HA       THR  25  92.242  12.618   1.970
  172    HB   THR  25           HB       THR  25  91.366  12.750  -0.270
  173    HG1  THR  25           HG1      THR  25  89.073  12.751   0.934
  174   HG21  THR  25          HG21      THR  25  91.025  10.344  -0.787
  175   HG22  THR  25          HG22      THR  25  90.769  10.027   0.927
  176   HG23  THR  25          HG23      THR  25  92.343  10.578   0.361
  177    H    ASP  26           HN       ASP  26  88.776  13.107   2.602
  178    HA   ASP  26           HA       ASP  26  88.849  15.961   2.071
  179    HB2  ASP  26           HB2      ASP  26  86.905  14.589   3.943
  180    HB3  ASP  26           HB1      ASP  26  86.637  16.017   2.942
  181    H    LEU  27           HN       LEU  27  90.597  14.346   4.181
  182    HA   LEU  27           HA       LEU  27  90.663  16.573   6.142
  183    HB2  LEU  27           HB2      LEU  27  89.786  13.784   6.638
  184    HB3  LEU  27           HB1      LEU  27  90.917  14.403   7.826
  185    HG   LEU  27           HG       LEU  27  88.518  16.046   7.009
  186   HD11  LEU  27          HD11      LEU  27  87.473  14.007   7.631
  187   HD12  LEU  27          HD12      LEU  27  87.410  15.013   9.078
  188   HD13  LEU  27          HD13      LEU  27  88.614  13.729   8.946
  189   HD21  LEU  27          HD21      LEU  27  88.863  17.120   9.105
  190   HD22  LEU  27          HD22      LEU  27  90.482  16.897   8.437
  191   HD23  LEU  27          HD23      LEU  27  89.891  15.811   9.693
  192    H    ASN  28           HN       ASN  28  92.102  13.761   4.665
  193    HA   ASN  28           HA       ASN  28  94.355  13.344   4.155
  194    HB2  ASN  28           HB2      ASN  28  94.614  15.924   4.414
  195    HB3  ASN  28           HB1      ASN  28  95.258  15.552   6.008
  196   HD21  ASN  28          HD21      ASN  28  96.247  12.898   4.840
  197   HD22  ASN  28          HD22      ASN  28  97.685  13.312   4.048
  198    H    ARG  29           HN       ARG  29  92.737  12.747   6.818
  199    HA   ARG  29           HA       ARG  29  95.012  11.991   8.541
  200    HB2  ARG  29           HB2      ARG  29  92.029  11.693   8.916
  201    HB3  ARG  29           HB1      ARG  29  93.252  11.293  10.122
  202    HG2  ARG  29           HG2      ARG  29  93.994  13.593  10.220
  203    HG3  ARG  29           HG1      ARG  29  92.931  14.036   8.894
  204    HD2  ARG  29           HD2      ARG  29  91.661  14.693  10.748
  205    HD3  ARG  29           HD1      ARG  29  91.039  13.069  10.448
  206    HE   ARG  29           HE       ARG  29  93.132  12.657  12.214
  207   HH11  ARG  29          HH11      ARG  29  92.847  12.663  14.457
  208   HH12  ARG  29          HH12      ARG  29  91.523  13.543  15.145
  209   HH21  ARG  29          HH21      ARG  29  90.325  14.651  12.085
  210   HH22  ARG  29          HH22      ARG  29  90.093  14.667  13.801
  211    H    ASP  30           HN       ASP  30  94.438   9.748   9.621
  212    HA   ASP  30           HA       ASP  30  93.677   7.753   7.562
  213    HB2  ASP  30           HB2      ASP  30  96.150   7.582   9.307
  214    HB3  ASP  30           HB1      ASP  30  95.568   6.335   8.204
  215    H    VAL  31           HN       VAL  31  92.033   6.715   8.408
  216    HA   VAL  31           HA       VAL  31  91.982   6.211  11.364
  217    HB   VAL  31           HB       VAL  31  89.651   6.239   9.426
  218   HG11  VAL  31          HG11      VAL  31  89.916   6.133  12.442
  219   HG12  VAL  31          HG12      VAL  31  89.217   4.905  11.388
  220   HG13  VAL  31          HG13      VAL  31  88.395   6.450  11.611
  221   HG21  VAL  31          HG21      VAL  31  90.534   8.383  11.398
  222   HG22  VAL  31          HG22      VAL  31  89.131   8.457  10.333
  223   HG23  VAL  31          HG23      VAL  31  90.757   8.486   9.652
  224    H    THR  32           HN       THR  32  91.136   4.150  12.020
  225    HA   THR  32           HA       THR  32  91.268   2.004   9.944
  226    HB   THR  32           HB       THR  32  92.290   0.952  12.415
  227    HG1  THR  32           HG1      THR  32  93.702   3.253  11.590
  228   HG21  THR  32          HG21      THR  32  92.880   0.384   9.960
  229   HG22  THR  32          HG22      THR  32  94.192   0.362  11.136
  230   HG23  THR  32          HG23      THR  32  94.000   1.745  10.056
  231    H    LEU  33           HN       LEU  33  89.631   0.551  10.128
  232    HA   LEU  33           HA       LEU  33  87.809   0.776  12.493
  233    HB2  LEU  33           HB2      LEU  33  87.387   0.340   9.555
  234    HB3  LEU  33           HB1      LEU  33  86.211  -0.314  10.676
  235    HG   LEU  33           HG       LEU  33  85.703   2.007   9.767
  236   HD11  LEU  33          HD11      LEU  33  84.887   0.974  12.026
  237   HD12  LEU  33          HD12      LEU  33  84.669   2.699  11.739
  238   HD13  LEU  33          HD13      LEU  33  85.985   2.140  12.765
  239   HD21  LEU  33          HD21      LEU  33  86.943   3.871  10.495
  240   HD22  LEU  33          HD22      LEU  33  88.176   2.700  10.039
  241   HD23  LEU  33          HD23      LEU  33  87.777   2.954  11.735
  242    H    ARG  34           HN       ARG  34  88.132  -0.922  13.805
  243    HA   ARG  34           HA       ARG  34  89.351  -3.401  13.114
  244    HB2  ARG  34           HB2      ARG  34  88.992  -2.469  15.462
  245    HB3  ARG  34           HB1      ARG  34  87.315  -2.974  15.317
  246    HG2  ARG  34           HG2      ARG  34  88.326  -4.812  16.393
  247    HG3  ARG  34           HG1      ARG  34  88.265  -5.306  14.704
  248    HD2  ARG  34           HD2      ARG  34  90.574  -4.933  14.385
  249    HD3  ARG  34           HD1      ARG  34  90.695  -3.914  15.803
  250    HE   ARG  34           HE       ARG  34  89.913  -6.536  16.616
  251   HH11  ARG  34          HH11      ARG  34  91.507  -7.826  17.590
  252   HH12  ARG  34          HH12      ARG  34  93.178  -7.440  17.348
  253   HH21  ARG  34          HH21      ARG  34  92.529  -4.693  15.337
  254   HH22  ARG  34          HH22      ARG  34  93.756  -5.669  16.073
  255    H    VAL  35           HN       VAL  35  88.435  -4.471  11.382
  256    HA   VAL  35           HA       VAL  35  85.555  -5.275  11.637
  257    HB   VAL  35           HB       VAL  35  85.436  -5.110   9.156
  258   HG11  VAL  35          HG11      VAL  35  86.062  -2.654  10.806
  259   HG12  VAL  35          HG12      VAL  35  84.476  -3.291  10.362
  260   HG13  VAL  35          HG13      VAL  35  85.498  -2.540   9.137
  261   HG21  VAL  35          HG21      VAL  35  87.767  -5.263   8.566
  262   HG22  VAL  35          HG22      VAL  35  88.159  -3.840   9.528
  263   HG23  VAL  35          HG23      VAL  35  87.197  -3.673   8.062
  264    H    THR  36           HN       THR  36  85.303  -6.895   9.539
  265    HA   THR  36           HA       THR  36  87.538  -8.844   9.520
  266    HB   THR  36           HB       THR  36  85.722 -10.661   9.886
  267    HG1  THR  36           HG1      THR  36  84.121  -8.780   9.850
  268   HG21  THR  36          HG21      THR  36  87.404 -10.408  11.529
  269   HG22  THR  36          HG22      THR  36  85.871 -10.366  12.399
  270   HG23  THR  36          HG23      THR  36  86.736  -8.868  12.075
  271    H    GLY  37           HN       GLY  37  86.749 -10.690   7.925
  272    HA2  GLY  37           HA2      GLY  37  85.955  -9.337   5.474
  273    HA3  GLY  37           HA1      GLY  37  86.399 -11.035   5.630
  274    H    GLU  38           HN       GLU  38  83.918  -9.128   7.290
  275    HA   GLU  38           HA       GLU  38  81.788 -10.644   5.904
  276    HB2  GLU  38           HB2      GLU  38  80.702 -11.096   8.162
  277    HB3  GLU  38           HB1      GLU  38  82.117 -12.078   7.784
  278    HG2  GLU  38           HG2      GLU  38  83.515 -10.832   9.205
  279    HG3  GLU  38           HG1      GLU  38  82.375  -9.487   9.300
  280    H    VAL  39           HN       VAL  39  83.027  -7.765   6.997
  281    HA   VAL  39           HA       VAL  39  80.435  -6.584   7.731
  282    HB   VAL  39           HB       VAL  39  81.603  -4.713   8.459
  283   HG11  VAL  39          HG11      VAL  39  83.303  -5.569   9.854
  284   HG12  VAL  39          HG12      VAL  39  83.761  -6.799   8.673
  285   HG13  VAL  39          HG13      VAL  39  82.240  -6.940   9.552
  286   HG21  VAL  39          HG21      VAL  39  83.820  -5.513   6.540
  287   HG22  VAL  39          HG22      VAL  39  83.961  -4.206   7.713
  288   HG23  VAL  39          HG23      VAL  39  82.782  -4.090   6.421
  289    H    HIS  40           HN       HIS  40  79.142  -5.576   6.281
  290    HA   HIS  40           HA       HIS  40  79.825  -5.575   3.481
  291    HB2  HIS  40           HB2      HIS  40  77.675  -3.801   4.630
  292    HB3  HIS  40           HB1      HIS  40  77.686  -4.697   3.110
  293    HD1  HIS  40           HD1      HIS  40  77.042  -5.097   6.777
  294    HD2  HIS  40           HD2      HIS  40  77.028  -7.467   3.348
  295    HE1  HIS  40           HE1      HIS  40  75.920  -7.276   7.417
  296    H    ILE  41           HN       ILE  41  80.513  -3.839   2.169
  297    HA   ILE  41           HA       ILE  41  82.341  -1.971   3.122
  298    HB   ILE  41           HB       ILE  41  80.410  -1.642   0.808
  299   HG12  ILE  41          HG12      ILE  41  83.300  -2.536   0.811
  300   HG13  ILE  41          HG11      ILE  41  81.932  -3.645   0.842
  301   HG21  ILE  41          HG21      ILE  41  81.320   0.523   1.302
  302   HG22  ILE  41          HG22      ILE  41  82.235  -0.115  -0.067
  303   HG23  ILE  41          HG23      ILE  41  82.932  -0.147   1.558
  304   HD11  ILE  41          HD11      ILE  41  81.341  -3.210  -1.326
  305   HD12  ILE  41          HD12      ILE  41  83.055  -2.823  -1.459
  306   HD13  ILE  41          HD13      ILE  41  81.873  -1.531  -1.259
  307    H    GLY  42           HN       GLY  42  78.943  -1.288   2.365
  308    HA2  GLY  42           HA2      GLY  42  78.894   1.323   3.385
  309    HA3  GLY  42           HA1      GLY  42  77.476   0.298   3.255
  310    H    GLY  43           HN       GLY  43  79.212  -1.630   4.957
  311    HA2  GLY  43           HA2      GLY  43  78.039  -0.840   7.510
  312    HA3  GLY  43           HA1      GLY  43  79.043  -2.262   7.220
  313    H    VAL  44           HN       VAL  44  81.016  -0.311   5.875
  314    HA   VAL  44           HA       VAL  44  82.578   0.203   8.320
  315    HB   VAL  44           HB       VAL  44  83.093   0.345   5.345
  316   HG11  VAL  44          HG11      VAL  44  84.171   2.365   6.049
  317   HG12  VAL  44          HG12      VAL  44  85.443   1.146   5.982
  318   HG13  VAL  44          HG13      VAL  44  84.755   1.618   7.536
  319   HG21  VAL  44          HG21      VAL  44  83.384  -1.782   6.583
  320   HG22  VAL  44          HG22      VAL  44  84.546  -0.989   7.647
  321   HG23  VAL  44          HG23      VAL  44  84.913  -1.188   5.934
  322    H    MET  45           HN       MET  45  81.288   2.206   5.606
  323    HA   MET  45           HA       MET  45  82.086   4.710   6.597
  324    HB2  MET  45           HB2      MET  45  79.295   4.454   5.501
  325    HB3  MET  45           HB1      MET  45  80.523   5.677   5.171
  326    HG2  MET  45           HG2      MET  45  81.856   3.869   4.002
  327    HG3  MET  45           HG1      MET  45  80.438   2.840   4.144
  328    HE1  MET  45           HE1      MET  45  78.240   3.471   3.666
  329    HE2  MET  45           HE2      MET  45  78.419   3.023   1.967
  330    HE3  MET  45           HE3      MET  45  77.658   4.559   2.402
  331    H    LEU  46           HN       LEU  46  79.322   2.712   7.529
  332    HA   LEU  46           HA       LEU  46  78.044   4.534   9.294
  333    HB2  LEU  46           HB2      LEU  46  77.148   2.303   8.562
  334    HB3  LEU  46           HB1      LEU  46  78.310   1.524   9.627
  335    HG   LEU  46           HG       LEU  46  76.657   3.634  10.943
  336   HD11  LEU  46          HD11      LEU  46  75.386   1.246   9.625
  337   HD12  LEU  46          HD12      LEU  46  74.754   2.876   9.862
  338   HD13  LEU  46          HD13      LEU  46  74.798   1.750  11.211
  339   HD21  LEU  46          HD21      LEU  46  78.320   1.946  11.990
  340   HD22  LEU  46          HD22      LEU  46  77.042   0.752  11.773
  341   HD23  LEU  46          HD23      LEU  46  76.767   2.161  12.797
  342    H    LYS  47           HN       LYS  47  80.501   2.038  10.064
  343    HA   LYS  47           HA       LYS  47  80.813   2.929  12.777
  344    HB2  LYS  47           HB2      LYS  47  82.837   1.470  11.064
  345    HB3  LYS  47           HB1      LYS  47  82.769   1.496  12.828
  346    HG2  LYS  47           HG2      LYS  47  80.632   0.326  12.797
  347    HG3  LYS  47           HG1      LYS  47  80.595   0.400  11.035
  348    HD2  LYS  47           HD2      LYS  47  82.813  -0.867  11.064
  349    HD3  LYS  47           HD1      LYS  47  82.515  -1.156  12.778
  350    HE2  LYS  47           HE2      LYS  47  80.550  -1.891  10.591
  351    HE3  LYS  47           HE1      LYS  47  81.731  -3.015  11.264
  352    HZ1  LYS  47           HZ1      LYS  47  79.300  -1.955  12.442
  353    HZ2  LYS  47           HZ2      LYS  47  80.636  -2.050  13.488
  354    HZ3  LYS  47           HZ3      LYS  47  80.071  -3.444  12.696
  355    H    LEU  48           HN       LEU  48  82.914   3.447   9.913
  356    HA   LEU  48           HA       LEU  48  84.910   4.999  11.011
  357    HB2  LEU  48           HB2      LEU  48  84.958   4.416   8.672
  358    HB3  LEU  48           HB1      LEU  48  83.482   5.314   8.359
  359    HG   LEU  48           HG       LEU  48  84.711   7.439   8.904
  360   HD11  LEU  48          HD11      LEU  48  87.180   7.343   8.955
  361   HD12  LEU  48          HD12      LEU  48  87.094   5.586   9.002
  362   HD13  LEU  48          HD13      LEU  48  86.461   6.536  10.347
  363   HD21  LEU  48          HD21      LEU  48  84.532   6.864   6.590
  364   HD22  LEU  48          HD22      LEU  48  85.766   5.612   6.743
  365   HD23  LEU  48          HD23      LEU  48  86.220   7.314   6.850
  366    H    VAL  49           HN       VAL  49  81.642   6.141  10.140
  367    HA   VAL  49           HA       VAL  49  82.251   8.890  10.918
  368    HB   VAL  49           HB       VAL  49  79.633   7.474  10.356
  369   HG11  VAL  49          HG11      VAL  49  80.260  10.361  11.007
  370   HG12  VAL  49          HG12      VAL  49  79.086   9.303  11.790
  371   HG13  VAL  49          HG13      VAL  49  78.793   9.885  10.152
  372   HG21  VAL  49          HG21      VAL  49  81.361   9.394   8.765
  373   HG22  VAL  49          HG22      VAL  49  79.745   8.880   8.284
  374   HG23  VAL  49          HG23      VAL  49  81.049   7.698   8.388
  375    H    GLU  50           HN       GLU  50  80.407   6.203  12.381
  376    HA   GLU  50           HA       GLU  50  79.378   7.400  14.655
  377    HB2  GLU  50           HB2      GLU  50  80.674   4.699  14.283
  378    HB3  GLU  50           HB1      GLU  50  79.965   5.168  15.825
  379    HG2  GLU  50           HG2      GLU  50  78.438   5.322  13.214
  380    HG3  GLU  50           HG1      GLU  50  78.419   3.896  14.252
  381    H    LYS  51           HN       LYS  51  82.737   6.468  14.085
  382    HA   LYS  51           HA       LYS  51  83.606   7.129  16.763
  383    HB2  LYS  51           HB2      LYS  51  85.226   6.829  14.235
  384    HB3  LYS  51           HB1      LYS  51  85.836   6.772  15.890
  385    HG2  LYS  51           HG2      LYS  51  84.145   4.877  16.279
  386    HG3  LYS  51           HG1      LYS  51  83.987   4.823  14.525
  387    HD2  LYS  51           HD2      LYS  51  86.495   4.375  16.155
  388    HD3  LYS  51           HD1      LYS  51  85.633   3.204  15.169
  389    HE2  LYS  51           HE2      LYS  51  87.471   3.875  13.834
  390    HE3  LYS  51           HE1      LYS  51  86.096   4.767  13.185
  391    HZ1  LYS  51           HZ1      LYS  51  87.419   6.125  15.338
  392    HZ2  LYS  51           HZ2      LYS  51  86.985   6.698  13.799
  393    HZ3  LYS  51           HZ3      LYS  51  88.441   5.850  14.014
  394    H    LEU  52           HN       LEU  52  83.636   8.862  13.637
  395    HA   LEU  52           HA       LEU  52  85.191  11.058  14.485
  396    HB2  LEU  52           HB2      LEU  52  83.851  10.205  12.158
  397    HB3  LEU  52           HB1      LEU  52  83.088  11.730  12.553
  398    HG   LEU  52           HG       LEU  52  84.915  12.221  11.113
  399   HD11  LEU  52          HD11      LEU  52  84.657  13.428  13.530
  400   HD12  LEU  52          HD12      LEU  52  85.833  13.933  12.320
  401   HD13  LEU  52          HD13      LEU  52  86.330  12.884  13.644
  402   HD21  LEU  52          HD21      LEU  52  86.086   9.962  11.718
  403   HD22  LEU  52          HD22      LEU  52  86.911  10.915  12.950
  404   HD23  LEU  52          HD23      LEU  52  87.082  11.337  11.249
  405    H    ASP  53           HN       ASP  53  81.682  11.068  13.970
  406    HA   ASP  53           HA       ASP  53  79.945  11.956  15.232
  407    HB2  ASP  53           HB2      ASP  53  81.572  11.132  17.104
  408    HB3  ASP  53           HB1      ASP  53  81.865  12.840  17.352
  409    H    VAL  54           HN       VAL  54  79.938  13.510  13.528
  410    HA   VAL  54           HA       VAL  54  80.016  16.216  14.474
  411    HB   VAL  54           HB       VAL  54  82.379  16.069  14.249
  412   HG11  VAL  54          HG11      VAL  54  82.474  14.003  12.970
  413   HG12  VAL  54          HG12      VAL  54  83.439  15.243  12.167
  414   HG13  VAL  54          HG13      VAL  54  81.842  14.827  11.543
  415   HG21  VAL  54          HG21      VAL  54  81.235  18.074  13.178
  416   HG22  VAL  54          HG22      VAL  54  81.428  17.260  11.626
  417   HG23  VAL  54          HG23      VAL  54  82.849  17.725  12.559
  418    H    LYS  55           HN       LYS  55  78.808  17.533  13.120
  419    HA   LYS  55           HA       LYS  55  77.185  16.218  11.156
  420    HB2  LYS  55           HB2      LYS  55  77.553  19.137  11.842
  421    HB3  LYS  55           HB1      LYS  55  76.394  18.565  10.642
  422    HG2  LYS  55           HG2      LYS  55  75.727  16.934  12.740
  423    HG3  LYS  55           HG1      LYS  55  76.302  18.340  13.621
  424    HD2  LYS  55           HD2      LYS  55  74.762  19.773  12.297
  425    HD3  LYS  55           HD1      LYS  55  74.160  18.326  11.485
  426    HE2  LYS  55           HE2      LYS  55  72.615  18.723  13.248
  427    HE3  LYS  55           HE1      LYS  55  73.649  17.417  13.825
  428    HZ1  LYS  55           HZ1      LYS  55  75.018  19.123  14.944
  429    HZ2  LYS  55           HZ2      LYS  55  73.431  19.035  15.546
  430    HZ3  LYS  55           HZ3      LYS  55  73.877  20.297  14.499
  431    H    LYS  56           HN       LYS  56  80.068  16.102  10.532
  432    HA   LYS  56           HA       LYS  56  80.381  17.874   8.209
  433    HB2  LYS  56           HB2      LYS  56  82.357  17.178   9.482
  434    HB3  LYS  56           HB1      LYS  56  82.010  15.497   9.137
  435    HG2  LYS  56           HG2      LYS  56  83.232  15.654   7.214
  436    HG3  LYS  56           HG1      LYS  56  82.085  16.833   6.598
  437    HD2  LYS  56           HD2      LYS  56  84.127  17.981   6.498
  438    HD3  LYS  56           HD1      LYS  56  83.433  18.566   8.006
  439    HE2  LYS  56           HE2      LYS  56  85.793  17.967   8.332
  440    HE3  LYS  56           HE1      LYS  56  84.766  16.870   9.251
  441    HZ1  LYS  56           HZ1      LYS  56  86.680  16.098   7.534
  442    HZ2  LYS  56           HZ2      LYS  56  85.299  16.020   6.547
  443    HZ3  LYS  56           HZ3      LYS  56  85.362  15.138   7.998
  444    H    ASP  57           HN       ASP  57  80.103  17.273   6.073
  445    HA   ASP  57           HA       ASP  57  78.135  15.329   5.449
  446    HB2  ASP  57           HB2      ASP  57  80.214  16.655   3.687
  447    HB3  ASP  57           HB1      ASP  57  78.857  15.707   3.082
  448    H    TRP  58           HN       TRP  58  78.377  13.159   5.603
  449    HA   TRP  58           HA       TRP  58  81.018  11.935   4.890
  450    HB2  TRP  58           HB2      TRP  58  78.895  10.951   6.788
  451    HB3  TRP  58           HB1      TRP  58  80.388  10.124   6.408
  452    HD1  TRP  58           HD1      TRP  58  78.961  12.241   8.926
  453    HE1  TRP  58           HE1      TRP  58  80.769  13.396  10.341
  454    HE3  TRP  58           HE3      TRP  58  83.062  11.476   5.969
  455    HZ2  TRP  58           HZ2      TRP  58  83.568  13.922  10.247
  456    HZ3  TRP  58           HZ3      TRP  58  85.281  12.309   6.665
  457    HH2  TRP  58           HH2      TRP  58  85.536  13.532   8.804
  458    H    SER  59           HN       SER  59  77.479  11.450   4.879
  459    HA   SER  59           HA       SER  59  77.305   9.035   3.504
  460    HB2  SER  59           HB2      SER  59  75.358  10.379   4.346
  461    HB3  SER  59           HB1      SER  59  75.537  11.430   2.943
  462    HG   SER  59           HG       SER  59  74.282   9.984   2.052
  463    H    ASP  60           HN       ASP  60  77.347  12.257   1.926
  464    HA   ASP  60           HA       ASP  60  77.454  11.365  -0.733
  465    HB2  ASP  60           HB2      ASP  60  77.222  13.720  -0.275
  466    HB3  ASP  60           HB1      ASP  60  78.761  13.762   0.582
  467    H    HIS  61           HN       HIS  61  80.048  11.617   1.650
  468    HA   HIS  61           HA       HIS  61  82.149  10.956  -0.187
  469    HB2  HIS  61           HB2      HIS  61  82.017  10.822   2.830
  470    HB3  HIS  61           HB1      HIS  61  83.482  10.598   1.902
  471    HD1  HIS  61           HD1      HIS  61  84.519  12.745   2.987
  472    HD2  HIS  61           HD2      HIS  61  81.072  13.466   0.757
  473    HE1  HIS  61           HE1      HIS  61  84.379  15.253   2.672
  474    H    ALA  62           HN       ALA  62  82.741   9.051  -0.941
  475    HA   ALA  62           HA       ALA  62  81.800   6.552   0.412
  476    HB1  ALA  62           HB1      ALA  62  80.689   7.178  -1.832
  477    HB2  ALA  62           HB2      ALA  62  81.404   5.568  -1.726
  478    HB3  ALA  62           HB3      ALA  62  82.261   6.863  -2.565
  479    H    LEU  63           HN       LEU  63  83.364   4.725   0.045
  480    HA   LEU  63           HA       LEU  63  86.123   5.804  -0.119
  481    HB2  LEU  63           HB2      LEU  63  86.428   3.194   0.792
  482    HB3  LEU  63           HB1      LEU  63  86.331   4.609   1.825
  483    HG   LEU  63           HG       LEU  63  83.804   4.323   1.790
  484   HD11  LEU  63          HD11      LEU  63  84.634   1.685   0.668
  485   HD12  LEU  63          HD12      LEU  63  83.822   2.964  -0.238
  486   HD13  LEU  63          HD13      LEU  63  82.989   2.158   1.091
  487   HD21  LEU  63          HD21      LEU  63  85.297   1.946   2.899
  488   HD22  LEU  63          HD22      LEU  63  83.782   2.636   3.492
  489   HD23  LEU  63          HD23      LEU  63  85.294   3.534   3.670
  490    H    TRP  64           HN       TRP  64  87.699   4.879  -1.357
  491    HA   TRP  64           HA       TRP  64  86.798   3.137  -3.641
  492    HB2  TRP  64           HB2      TRP  64  87.341   4.852  -5.063
  493    HB3  TRP  64           HB1      TRP  64  87.403   5.875  -3.665
  494    HD1  TRP  64           HD1      TRP  64  90.144   5.215  -2.392
  495    HE1  TRP  64           HE1      TRP  64  92.341   5.693  -3.641
  496    HE3  TRP  64           HE3      TRP  64  88.389   5.465  -7.178
  497    HZ2  TRP  64           HZ2      TRP  64  93.231   6.173  -6.319
  498    HZ3  TRP  64           HZ3      TRP  64  89.927   5.962  -9.056
  499    HH2  TRP  64           HH2      TRP  64  92.343   6.317  -8.633
  500    H    TRP  65           HN       TRP  65  88.450   1.706  -4.464
  501    HA   TRP  65           HA       TRP  65  90.602   1.136  -2.486
  502    HB2  TRP  65           HB2      TRP  65  88.935  -0.654  -3.276
  503    HB3  TRP  65           HB1      TRP  65  89.800  -0.618  -4.807
  504    HD1  TRP  65           HD1      TRP  65  92.491   0.033  -2.581
  505    HE1  TRP  65           HE1      TRP  65  93.707  -2.099  -1.824
  506    HE3  TRP  65           HE3      TRP  65  89.009  -3.474  -3.883
  507    HZ2  TRP  65           HZ2      TRP  65  93.274  -4.927  -1.794
  508    HZ3  TRP  65           HZ3      TRP  65  89.446  -5.879  -3.483
  509    HH2  TRP  65           HH2      TRP  65  91.571  -6.609  -2.439
  510    H    GLU  66           HN       GLU  66  92.133   2.744  -3.192
  511    HA   GLU  66           HA       GLU  66  92.841   3.301  -5.856
  512    HB2  GLU  66           HB2      GLU  66  95.098   3.945  -4.906
  513    HB3  GLU  66           HB1      GLU  66  93.704   4.699  -4.147
  514    HG2  GLU  66           HG2      GLU  66  93.750   2.976  -2.369
  515    HG3  GLU  66           HG1      GLU  66  95.170   2.268  -3.127
  516    H    LYS  67           HN       LYS  67  93.629   0.446  -3.984
  517    HA   LYS  67           HA       LYS  67  95.912  -0.305  -5.600
  518    HB2  LYS  67           HB2      LYS  67  93.970  -2.217  -4.275
  519    HB3  LYS  67           HB1      LYS  67  95.645  -2.534  -4.705
  520    HG2  LYS  67           HG2      LYS  67  94.699  -0.562  -2.610
  521    HG3  LYS  67           HG1      LYS  67  95.439  -2.127  -2.295
  522    HD2  LYS  67           HD2      LYS  67  97.413  -1.231  -3.733
  523    HD3  LYS  67           HD1      LYS  67  96.689   0.353  -3.457
  524    HE2  LYS  67           HE2      LYS  67  98.049   0.290  -1.590
  525    HE3  LYS  67           HE1      LYS  67  96.667  -0.575  -0.910
  526    HZ1  LYS  67           HZ1      LYS  67  98.521  -2.217  -2.405
  527    HZ2  LYS  67           HZ2      LYS  67  97.776  -2.502  -0.905
  528    HZ3  LYS  67           HZ3      LYS  67  99.168  -1.533  -0.994
  529    H    LYS  68           HN       LYS  68  92.660   0.075  -6.129
  530    HA   LYS  68           HA       LYS  68  92.714  -1.456  -8.683
  531    HB2  LYS  68           HB2      LYS  68  90.170  -1.172  -7.098
  532    HB3  LYS  68           HB1      LYS  68  90.612  -2.402  -8.279
  533    HG2  LYS  68           HG2      LYS  68  92.000  -2.180  -5.588
  534    HG3  LYS  68           HG1      LYS  68  90.548  -3.122  -5.833
  535    HD2  LYS  68           HD2      LYS  68  91.589  -4.595  -7.360
  536    HD3  LYS  68           HD1      LYS  68  92.945  -3.500  -7.613
  537    HE2  LYS  68           HE2      LYS  68  93.971  -4.091  -5.618
  538    HE3  LYS  68           HE1      LYS  68  92.457  -4.542  -4.839
  539    HZ1  LYS  68           HZ1      LYS  68  92.503  -6.327  -6.771
  540    HZ2  LYS  68           HZ2      LYS  68  93.259  -6.594  -5.273
  541    HZ3  LYS  68           HZ3      LYS  68  94.175  -6.092  -6.613
  542    H    ARG  69           HN       ARG  69  92.161   1.466  -7.026
  543    HA   ARG  69           HA       ARG  69  91.216   3.506  -7.693
  544    HB2  ARG  69           HB2      ARG  69  91.928   2.304 -10.396
  545    HB3  ARG  69           HB1      ARG  69  91.305   3.933 -10.203
  546    HG2  ARG  69           HG2      ARG  69  93.599   4.346 -10.189
  547    HG3  ARG  69           HG1      ARG  69  93.290   4.179  -8.465
  548    HD2  ARG  69           HD2      ARG  69  95.221   2.841  -8.978
  549    HD3  ARG  69           HD1      ARG  69  93.880   1.742  -8.689
  550    HE   ARG  69           HE       ARG  69  94.030   2.341 -11.485
  551   HH11  ARG  69          HH11      ARG  69  94.884   0.744 -12.844
  552   HH12  ARG  69          HH12      ARG  69  95.854  -0.521 -12.166
  553   HH21  ARG  69          HH21      ARG  69  95.601   0.664  -8.917
  554   HH22  ARG  69          HH22      ARG  69  96.262  -0.565  -9.943
  555    H    THR  70           HN       THR  70  89.425   1.557  -6.979
  556    HA   THR  70           HA       THR  70  87.253   1.666  -9.049
  557    HB   THR  70           HB       THR  70  88.172  -0.559  -8.135
  558    HG1  THR  70           HG1      THR  70  86.099  -0.157  -9.187
  559   HG21  THR  70          HG21      THR  70  86.322  -0.187  -5.828
  560   HG22  THR  70          HG22      THR  70  87.951   0.474  -5.694
  561   HG23  THR  70          HG23      THR  70  87.720  -1.251  -5.980
  562    H    TRP  71           HN       TRP  71  85.101   1.200  -7.549
  563    HA   TRP  71           HA       TRP  71  85.014   3.279  -5.418
  564    HB2  TRP  71           HB2      TRP  71  82.494   3.431  -6.416
  565    HB3  TRP  71           HB1      TRP  71  83.790   4.476  -6.976
  566    HD1  TRP  71           HD1      TRP  71  82.509   0.925  -7.904
  567    HE1  TRP  71           HE1      TRP  71  82.584   0.693 -10.424
  568    HE3  TRP  71           HE3      TRP  71  84.410   5.499  -9.132
  569    HZ2  TRP  71           HZ2      TRP  71  83.347   2.233 -12.725
  570    HZ3  TRP  71           HZ3      TRP  71  84.800   6.088 -11.507
  571    HH2  TRP  71           HH2      TRP  71  84.271   4.463 -13.305
  572    H    LEU  72           HN       LEU  72  84.885   1.914  -3.721
  573    HA   LEU  72           HA       LEU  72  83.806  -0.702  -3.841
  574    HB2  LEU  72           HB2      LEU  72  84.066   1.046  -1.421
  575    HB3  LEU  72           HB1      LEU  72  84.046  -0.705  -1.431
  576    HG   LEU  72           HG       LEU  72  86.110   0.822  -3.025
  577   HD11  LEU  72          HD11      LEU  72  86.358   1.748  -0.867
  578   HD12  LEU  72          HD12      LEU  72  87.638   0.555  -1.061
  579   HD13  LEU  72          HD13      LEU  72  86.213   0.173  -0.091
  580   HD21  LEU  72          HD21      LEU  72  86.699  -1.270  -3.587
  581   HD22  LEU  72          HD22      LEU  72  85.611  -1.989  -2.403
  582   HD23  LEU  72          HD23      LEU  72  87.233  -1.503  -1.922
  583    H    LEU  73           HN       LEU  73  81.804  -0.369  -4.904
  584    HA   LEU  73           HA       LEU  73  79.582   0.607  -3.148
  585    HB2  LEU  73           HB2      LEU  73  78.245   0.800  -5.288
  586    HB3  LEU  73           HB1      LEU  73  79.573   1.942  -5.135
  587    HG   LEU  73           HG       LEU  73  80.892  -0.011  -6.464
  588   HD11  LEU  73          HD11      LEU  73  79.541  -1.138  -8.073
  589   HD12  LEU  73          HD12      LEU  73  78.111  -0.197  -7.643
  590   HD13  LEU  73          HD13      LEU  73  78.734  -1.404  -6.530
  591   HD21  LEU  73          HD21      LEU  73  80.724   2.285  -7.249
  592   HD22  LEU  73          HD22      LEU  73  79.035   2.056  -7.677
  593   HD23  LEU  73          HD23      LEU  73  80.293   1.210  -8.575
  594    H    LYS  74           HN       LYS  74  81.075  -2.090  -3.595
  595    HA   LYS  74           HA       LYS  74  78.883  -3.840  -4.481
  596    HB2  LYS  74           HB2      LYS  74  81.744  -4.214  -3.637
  597    HB3  LYS  74           HB1      LYS  74  80.663  -5.593  -3.511
  598    HG2  LYS  74           HG2      LYS  74  81.790  -5.593  -5.694
  599    HG3  LYS  74           HG1      LYS  74  80.058  -5.359  -5.888
  600    HD2  LYS  74           HD2      LYS  74  81.333  -3.815  -7.327
  601    HD3  LYS  74           HD1      LYS  74  80.393  -2.941  -6.123
  602    HE2  LYS  74           HE2      LYS  74  82.924  -2.306  -6.531
  603    HE3  LYS  74           HE1      LYS  74  82.273  -2.326  -4.898
  604    HZ1  LYS  74           HZ1      LYS  74  83.046  -4.708  -4.810
  605    HZ2  LYS  74           HZ2      LYS  74  84.258  -3.522  -4.799
  606    HZ3  LYS  74           HZ3      LYS  74  83.926  -4.386  -6.224
  607    H    THR  75           HN       THR  75  77.681  -2.578  -2.561
  608    HA   THR  75           HA       THR  75  78.233  -3.578   0.110
  609    HB   THR  75           HB       THR  75  75.527  -2.473  -0.583
  610    HG1  THR  75           HG1      THR  75  76.735  -1.175  -1.855
  611   HG21  THR  75          HG21      THR  75  77.364  -1.333   1.486
  612   HG22  THR  75          HG22      THR  75  76.713  -2.949   1.781
  613   HG23  THR  75          HG23      THR  75  75.620  -1.583   1.555
  614    H    HIS  76           HN       HIS  76  76.888  -5.009  -2.591
  615    HA   HIS  76           HA       HIS  76  74.698  -6.470  -1.437
  616    HB2  HIS  76           HB2      HIS  76  76.443  -7.225  -3.795
  617    HB3  HIS  76           HB1      HIS  76  74.845  -7.875  -3.433
  618    HD1  HIS  76           HD1      HIS  76  76.225  -4.313  -3.646
  619    HD2  HIS  76           HD2      HIS  76  73.033  -6.593  -5.055
  620    HE1  HIS  76           HE1      HIS  76  74.787  -2.753  -5.030
  621    H    TRP  77           HN       TRP  77  78.047  -7.504  -2.166
  622    HA   TRP  77           HA       TRP  77  77.629  -9.895  -0.435
  623    HB2  TRP  77           HB2      TRP  77  79.694  -9.135  -2.491
  624    HB3  TRP  77           HB1      TRP  77  79.966 -10.480  -1.393
  625    HD1  TRP  77           HD1      TRP  77  77.874 -12.328  -1.339
  626    HE1  TRP  77           HE1      TRP  77  76.598 -13.291  -3.350
  627    HE3  TRP  77           HE3      TRP  77  78.911  -8.756  -4.837
  628    HZ2  TRP  77           HZ2      TRP  77  76.074 -12.640  -6.088
  629    HZ3  TRP  77           HZ3      TRP  77  78.011  -8.952  -7.138
  630    HH2  TRP  77           HH2      TRP  77  76.594 -10.888  -7.768
  631    H    THR  78           HN       THR  78  80.891  -9.527  -0.323
  632    HA   THR  78           HA       THR  78  80.970  -7.475   1.780
  633    HB   THR  78           HB       THR  78  82.099  -9.975   2.857
  634    HG1  THR  78           HG1      THR  78  80.261 -10.675   1.510
  635   HG21  THR  78          HG21      THR  78  81.714  -8.323   4.470
  636   HG22  THR  78          HG22      THR  78  80.316  -9.379   4.676
  637   HG23  THR  78          HG23      THR  78  80.143  -7.871   3.796
  638    H    LEU  79           HN       LEU  79  83.117  -6.883   2.286
  639    HA   LEU  79           HA       LEU  79  84.965  -6.755   0.292
  640    HB2  LEU  79           HB2      LEU  79  86.605  -6.257   1.885
  641    HB3  LEU  79           HB1      LEU  79  85.116  -5.569   2.380
  642    HG   LEU  79           HG       LEU  79  86.328  -8.082   3.441
  643   HD11  LEU  79          HD11      LEU  79  87.432  -5.897   4.048
  644   HD12  LEU  79          HD12      LEU  79  86.826  -6.822   5.423
  645   HD13  LEU  79          HD13      LEU  79  85.915  -5.437   4.823
  646   HD21  LEU  79          HD21      LEU  79  83.991  -8.382   3.774
  647   HD22  LEU  79          HD22      LEU  79  83.727  -6.658   3.967
  648   HD23  LEU  79          HD23      LEU  79  84.471  -7.580   5.269
  649    H    ASP  80           HN       ASP  80  84.953  -9.343   2.709
  650    HA   ASP  80           HA       ASP  80  87.130 -10.858   1.872
  651    HB2  ASP  80           HB2      ASP  80  85.358 -11.318   3.669
  652    HB3  ASP  80           HB1      ASP  80  84.432 -12.103   2.408
  653    H    LYS  81           HN       LYS  81  83.969 -10.526   0.373
  654    HA   LYS  81           HA       LYS  81  84.384 -12.625  -1.550
  655    HB2  LYS  81           HB2      LYS  81  82.198 -12.287  -1.982
  656    HB3  LYS  81           HB1      LYS  81  82.228 -10.940  -0.862
  657    HG2  LYS  81           HG2      LYS  81  83.055 -10.561  -3.753
  658    HG3  LYS  81           HG1      LYS  81  81.375 -10.537  -3.273
  659    HD2  LYS  81           HD2      LYS  81  81.838  -8.778  -1.645
  660    HD3  LYS  81           HD1      LYS  81  83.519  -8.762  -2.108
  661    HE2  LYS  81           HE2      LYS  81  82.607  -8.349  -4.521
  662    HE3  LYS  81           HE1      LYS  81  81.140  -7.859  -3.679
  663    HZ1  LYS  81           HZ1      LYS  81  82.533  -6.329  -2.348
  664    HZ2  LYS  81           HZ2      LYS  81  82.495  -5.946  -4.003
  665    HZ3  LYS  81           HZ3      LYS  81  83.854  -6.719  -3.338
  666    H    TYR  82           HN       TYR  82  85.260  -9.303  -1.336
  667    HA   TYR  82           HA       TYR  82  86.206  -9.159  -4.107
  668    HB2  TYR  82           HB2      TYR  82  85.469  -7.239  -2.380
  669    HB3  TYR  82           HB1      TYR  82  87.175  -7.275  -1.977
  670    HD1  TYR  82           HD1      TYR  82  85.476  -5.030  -3.331
  671    HD2  TYR  82           HD2      TYR  82  88.100  -8.054  -4.893
  672    HE1  TYR  82           HE1      TYR  82  85.955  -3.611  -5.307
  673    HE2  TYR  82           HE2      TYR  82  88.565  -6.639  -6.860
  674    HH   TYR  82           HH       TYR  82  88.258  -4.659  -7.810
  675    H    GLY  83           HN       GLY  83  87.706  -9.302  -0.846
  676    HA2  GLY  83           HA2      GLY  83  89.532 -11.095  -0.642
  677    HA3  GLY  83           HA1      GLY  83  90.185 -10.475  -2.159
  678    H    ILE  84           HN       ILE  84  88.854  -8.069  -0.307
  679    HA   ILE  84           HA       ILE  84  91.236  -6.577   0.095
  680    HB   ILE  84           HB       ILE  84  88.515  -6.591   1.323
  681   HG12  ILE  84          HG12      ILE  84  89.632  -4.536  -0.565
  682   HG13  ILE  84          HG11      ILE  84  88.919  -6.036  -1.150
  683   HG21  ILE  84          HG21      ILE  84  90.609  -4.456   1.640
  684   HG22  ILE  84          HG22      ILE  84  89.953  -5.479   2.921
  685   HG23  ILE  84          HG23      ILE  84  88.918  -4.309   2.116
  686   HD11  ILE  84          HD11      ILE  84  86.795  -5.509  -0.323
  687   HD12  ILE  84          HD12      ILE  84  87.378  -3.948  -0.891
  688   HD13  ILE  84          HD13      ILE  84  87.422  -4.334   0.830
  689    H    GLN  85           HN       GLN  85  92.185  -6.027   2.243
  690    HA   GLN  85           HA       GLN  85  91.640  -7.741   4.522
  691    HB2  GLN  85           HB2      GLN  85  93.216  -8.983   2.727
  692    HB3  GLN  85           HB1      GLN  85  94.458  -8.042   3.540
  693    HG2  GLN  85           HG2      GLN  85  94.467  -9.930   4.903
  694    HG3  GLN  85           HG1      GLN  85  93.236  -8.979   5.737
  695   HE21  GLN  85          HE21      GLN  85  91.066  -9.310   3.968
  696   HE22  GLN  85          HE22      GLN  85  90.602 -10.935   3.961
  697    H    ALA  86           HN       ALA  86  94.209  -7.409   5.750
  698    HA   ALA  86           HA       ALA  86  93.968  -4.658   6.643
  699    HB1  ALA  86           HB1      ALA  86  94.701  -6.267   8.253
  700    HB2  ALA  86           HB2      ALA  86  96.110  -5.265   7.903
  701    HB3  ALA  86           HB3      ALA  86  95.961  -6.865   7.174
  702    H    ASP  87           HN       ASP  87  95.912  -6.344   4.295
  703    HA   ASP  87           HA       ASP  87  97.920  -4.236   4.081
  704    HB2  ASP  87           HB2      ASP  87  98.457  -5.582   1.923
  705    HB3  ASP  87           HB1      ASP  87  98.712  -6.376   3.479
  706    H    ALA  88           HN       ALA  88  94.742  -4.412   3.227
  707    HA   ALA  88           HA       ALA  88  95.020  -2.911   0.673
  708    HB1  ALA  88           HB1      ALA  88  92.829  -4.352   2.125
  709    HB2  ALA  88           HB2      ALA  88  93.416  -4.615   0.489
  710    HB3  ALA  88           HB3      ALA  88  92.425  -3.199   0.851
  711    H    LYS  89           HN       LYS  89  95.232  -0.706   0.998
  712    HA   LYS  89           HA       LYS  89  93.903   0.515   3.371
  713    HB2  LYS  89           HB2      LYS  89  95.666   2.044   1.474
  714    HB3  LYS  89           HB1      LYS  89  95.386   2.306   3.194
  715    HG2  LYS  89           HG2      LYS  89  96.849  -0.101   2.066
  716    HG3  LYS  89           HG1      LYS  89  97.634   1.350   2.648
  717    HD2  LYS  89           HD2      LYS  89  97.005   0.983   4.879
  718    HD3  LYS  89           HD1      LYS  89  95.714  -0.124   4.431
  719    HE2  LYS  89           HE2      LYS  89  97.707  -1.293   5.374
  720    HE3  LYS  89           HE1      LYS  89  97.303  -1.797   3.732
  721    HZ1  LYS  89           HZ1      LYS  89  99.678  -1.385   3.993
  722    HZ2  LYS  89           HZ2      LYS  89  99.359   0.221   4.448
  723    HZ3  LYS  89           HZ3      LYS  89  98.985  -0.311   2.878
  724    H    LEU  90           HN       LEU  90  91.963   1.241   3.106
  725    HA   LEU  90           HA       LEU  90  90.998   2.115   0.445
  726    HB2  LEU  90           HB2      LEU  90  89.344   2.124   2.957
  727    HB3  LEU  90           HB1      LEU  90  88.822   1.904   1.288
  728    HG   LEU  90           HG       LEU  90  90.420  -0.039   2.959
  729   HD11  LEU  90          HD11      LEU  90  87.599   0.003   1.880
  730   HD12  LEU  90          HD12      LEU  90  88.125  -0.207   3.550
  731   HD13  LEU  90          HD13      LEU  90  88.384  -1.497   2.377
  732   HD21  LEU  90          HD21      LEU  90  91.289  -0.253   0.754
  733   HD22  LEU  90          HD22      LEU  90  89.699  -0.027   0.020
  734   HD23  LEU  90          HD23      LEU  90  90.073  -1.523   0.883
  735    H    GLN  91           HN       GLN  91  89.464   4.167   0.682
  736    HA   GLN  91           HA       GLN  91  90.697   6.203   2.497
  737    HB2  GLN  91           HB2      GLN  91  90.161   6.954  -0.378
  738    HB3  GLN  91           HB1      GLN  91  91.178   7.766   0.799
  739    HG2  GLN  91           HG2      GLN  91  92.976   6.318   0.443
  740    HG3  GLN  91           HG1      GLN  91  91.964   5.037  -0.141
  741   HE21  GLN  91          HE21      GLN  91  91.013   7.968  -1.539
  742   HE22  GLN  91          HE22      GLN  91  91.830   7.783  -3.000
  743    H    PHE  92           HN       PHE  92  89.135   7.893   2.963
  744    HA   PHE  92           HA       PHE  92  86.398   7.316   1.865
  745    HB2  PHE  92           HB2      PHE  92  86.897   7.071   4.411
  746    HB3  PHE  92           HB1      PHE  92  86.857   8.820   4.450
  747    HD1  PHE  92           HD1      PHE  92  84.917   5.961   3.006
  748    HD2  PHE  92           HD2      PHE  92  84.742   9.822   4.866
  749    HE1  PHE  92           HE1      PHE  92  82.452   5.852   2.976
  750    HE2  PHE  92           HE2      PHE  92  82.256   9.693   4.846
  751    HZ   PHE  92           HZ       PHE  92  81.119   7.718   3.903
  752    H    THR  93           HN       THR  93  86.638   8.562   0.082
  753    HA   THR  93           HA       THR  93  87.170  11.485   0.426
  754    HB   THR  93           HB       THR  93  88.222  11.425  -1.619
  755    HG1  THR  93           HG1      THR  93  87.056   9.575  -3.067
  756   HG21  THR  93          HG21      THR  93  88.977   9.301  -0.368
  757   HG22  THR  93          HG22      THR  93  89.323   9.393  -2.094
  758   HG23  THR  93          HG23      THR  93  87.968   8.424  -1.516
  759    HA   PRO  94           HA       PRO  94  83.147  12.849  -0.868
  760    HB2  PRO  94           HB2      PRO  94  84.031  13.598  -3.631
  761    HB3  PRO  94           HB1      PRO  94  83.259  14.598  -2.382
  762    HG2  PRO  94           HG2      PRO  94  85.834  14.880  -2.925
  763    HG3  PRO  94           HG1      PRO  94  85.252  14.949  -1.250
  764    HD2  PRO  94           HD2      PRO  94  86.624  12.687  -2.675
  765    HD3  PRO  94           HD1      PRO  94  86.870  13.273  -1.014
  766    H    TYR 541           HT1      TYR 541  58.710  47.808  12.339
  767    HA   TYR 541           HA       TYR 541  59.976  45.816  11.742
  768    HB2  TYR 541           HB2      TYR 541  59.354  46.423  14.131
  769    HB3  TYR 541           HB1      TYR 541  58.029  45.265  13.996
  770    HD1  TYR 541           HD1      TYR 541  58.413  42.962  14.348
  771    HD2  TYR 541           HD2      TYR 541  61.735  45.583  13.608
  772    HE1  TYR 541           HE1      TYR 541  59.985  41.110  14.848
  773    HE2  TYR 541           HE2      TYR 541  63.307  43.731  14.109
  774    HH   TYR 541           HH       TYR 541  63.449  41.453  14.336
  775    H    HIS 542           HN       HIS 542  59.941  43.758  10.858
  776    HA   HIS 542           HA       HIS 542  57.415  42.851   9.698
  777    HB2  HIS 542           HB2      HIS 542  60.230  41.735   9.633
  778    HB3  HIS 542           HB1      HIS 542  58.875  41.046   8.753
  779    HD1  HIS 542           HD1      HIS 542  61.601  43.161   8.127
  780    HD2  HIS 542           HD2      HIS 542  57.546  43.427   7.198
  781    HE1  HIS 542           HE1      HIS 542  61.412  44.802   6.208
  782    H    GLU 543           HN       GLU 543  57.802  40.065   9.825
  783    HA   GLU 543           HA       GLU 543  58.243  38.991  12.363
  784    HB2  GLU 543           HB2      GLU 543  56.183  40.301  12.948
  785    HB3  GLU 543           HB1      GLU 543  55.313  39.412  11.695
  786    HG2  GLU 543           HG2      GLU 543  54.945  37.739  13.196
  787    HG3  GLU 543           HG1      GLU 543  56.689  37.444  13.184
  788    H    ARG 544           HN       ARG 544  59.195  37.474  11.027
  789    HA   ARG 544           HA       ARG 544  57.533  36.010   9.050
  790    HB2  ARG 544           HB2      ARG 544  60.445  35.428   9.560
  791    HB3  ARG 544           HB1      ARG 544  59.535  35.341   8.051
  792    HG2  ARG 544           HG2      ARG 544  60.313  37.888   9.513
  793    HG3  ARG 544           HG1      ARG 544  61.048  37.274   8.045
  794    HD2  ARG 544           HD2      ARG 544  58.657  37.332   7.047
  795    HD3  ARG 544           HD1      ARG 544  58.271  38.374   8.417
  796    HE   ARG 544           HE       ARG 544  60.546  39.526   7.333
  797   HH11  ARG 544          HH11      ARG 544  60.459  41.109   5.723
  798   HH12  ARG 544          HH12      ARG 544  59.077  41.193   4.682
  799   HH21  ARG 544          HH21      ARG 544  57.457  38.518   6.182
  800   HH22  ARG 544          HH22      ARG 544  57.376  39.726   4.943
  801    H    ARG 545           HN       ARG 545  56.382  35.168  11.215
  802    HA   ARG 545           HA       ARG 545  57.737  33.219  12.811
  803    HB2  ARG 545           HB2      ARG 545  54.793  33.232  12.120
  804    HB3  ARG 545           HB1      ARG 545  55.558  32.599  13.573
  805    HG2  ARG 545           HG2      ARG 545  55.452  35.502  12.737
  806    HG3  ARG 545           HG1      ARG 545  54.557  34.763  14.059
  807    HD2  ARG 545           HD2      ARG 545  56.908  34.049  14.947
  808    HD3  ARG 545           HD1      ARG 545  57.513  35.298  13.859
  809    HE   ARG 545           HE       ARG 545  55.519  36.577  15.299
  810   HH11  ARG 545          HH11      ARG 545  55.932  37.657  17.245
  811   HH12  ARG 545          HH12      ARG 545  57.303  37.200  18.199
  812   HH21  ARG 545          HH21      ARG 545  58.335  34.718  16.007
  813   HH22  ARG 545          HH22      ARG 545  58.663  35.535  17.499
  814    H    GLY 546           HN       GLY 546  55.522  31.175  12.269
  815    HA2  GLY 546           HA2      GLY 546  55.480  30.047   9.765
  816    HA3  GLY 546           HA1      GLY 546  57.081  29.593  10.351
  817    H    SER 547           HN       SER 547  57.222  28.230  12.238
  818    HA   SER 547           HA       SER 547  54.835  27.136  13.490
  819    HB2  SER 547           HB2      SER 547  56.172  25.700  11.221
  820    HB3  SER 547           HB1      SER 547  55.604  24.739  12.585
  821    HG   SER 547           HG       SER 547  53.863  24.881  11.299
  822    H    LEU 548           HN       LEU 548  55.620  26.824  15.548
  823    HA   LEU 548           HA       LEU 548  58.382  26.830  16.138
  824    HB2  LEU 548           HB2      LEU 548  55.873  26.377  17.631
  825    HB3  LEU 548           HB1      LEU 548  57.272  25.581  18.343
  826    HG   LEU 548           HG       LEU 548  58.489  27.812  18.177
  827   HD11  LEU 548          HD11      LEU 548  55.717  28.661  17.348
  828   HD12  LEU 548          HD12      LEU 548  57.256  29.026  16.577
  829   HD13  LEU 548          HD13      LEU 548  56.837  29.794  18.101
  830   HD21  LEU 548          HD21      LEU 548  57.297  26.892  20.246
  831   HD22  LEU 548          HD22      LEU 548  55.987  28.001  19.842
  832   HD23  LEU 548          HD23      LEU 548  57.596  28.629  20.204
  833    H    CYS 549           HN       CYS 549  59.912  25.254  16.352
  834    HA   CYS 549           HA       CYS 549  59.216  22.577  15.336
  835    HB2  CYS 549           HB2      CYS 549  61.300  23.272  14.522
  836    HB3  CYS 549           HB1      CYS 549  61.701  24.127  15.993
  837    H    SER 550           HN       SER 550  58.068  21.527  16.847
  838    HA   SER 550           HA       SER 550  58.035  21.845  19.588
  839    HB2  SER 550           HB2      SER 550  56.330  20.513  18.761
  840    HB3  SER 550           HB1      SER 550  57.430  19.499  17.830
  841    HG   SER 550           HG       SER 550  58.260  18.793  19.921
  842    H    GLY 551           HN       GLY 551  59.354  21.483  21.177
  843    HA2  GLY 551           HA2      GLY 551  60.961  20.139  22.436
  844    HA3  GLY 551           HA1      GLY 551  61.547  19.474  20.905
  845    H    CYS 552           HN       CYS 552  61.308  22.121  19.657
  846    HA   CYS 552           HA       CYS 552  63.829  23.362  20.683
  847    HB2  CYS 552           HB2      CYS 552  63.518  22.260  18.352
  848    HB3  CYS 552           HB1      CYS 552  62.551  23.673  17.978
  849    H    GLN 553           HN       GLN 553  60.503  23.737  19.720
  850    HA   GLN 553           HA       GLN 553  59.026  25.482  19.758
  851    HB2  GLN 553           HB2      GLN 553  60.497  25.977  22.326
  852    HB3  GLN 553           HB1      GLN 553  58.952  26.716  21.895
  853    HG2  GLN 553           HG2      GLN 553  59.431  23.736  21.922
  854    HG3  GLN 553           HG1      GLN 553  58.736  24.614  23.269
  855   HE21  GLN 553          HE21      GLN 553  58.189  23.682  19.895
  856   HE22  GLN 553          HE22      GLN 553  56.501  23.882  19.924
  857    H    LYS 554           HN       LYS 554  60.563  26.141  17.987
  858    HA   LYS 554           HA       LYS 554  60.886  29.060  18.238
  859    HB2  LYS 554           HB2      LYS 554  63.005  27.196  17.181
  860    HB3  LYS 554           HB1      LYS 554  63.025  28.930  16.893
  861    HG2  LYS 554           HG2      LYS 554  63.007  27.626  19.625
  862    HG3  LYS 554           HG1      LYS 554  64.441  28.250  18.827
  863    HD2  LYS 554           HD2      LYS 554  62.975  30.470  18.659
  864    HD3  LYS 554           HD1      LYS 554  62.120  29.738  20.018
  865    HE2  LYS 554           HE2      LYS 554  65.109  30.234  19.905
  866    HE3  LYS 554           HE1      LYS 554  63.945  31.224  20.786
  867    HZ1  LYS 554           HZ1      LYS 554  65.041  28.637  21.448
  868    HZ2  LYS 554           HZ2      LYS 554  63.359  28.754  21.661
  869    HZ3  LYS 554           HZ3      LYS 554  64.398  29.835  22.461
  870    HA   PRO 555           HA       PRO 555  58.262  28.531  14.589
  871    HB2  PRO 555           HB2      PRO 555  59.625  30.986  13.631
  872    HB3  PRO 555           HB1      PRO 555  57.900  30.637  13.762
  873    HG2  PRO 555           HG2      PRO 555  59.252  32.244  15.534
  874    HG3  PRO 555           HG1      PRO 555  57.794  31.343  15.959
  875    HD2  PRO 555           HD2      PRO 555  60.565  30.881  16.859
  876    HD3  PRO 555           HD1      PRO 555  59.054  30.204  17.513
  877    H    ILE 556           HN       ILE 556  58.507  27.443  12.776
  878    HA   ILE 556           HA       ILE 556  61.222  26.969  11.681
  879    HB   ILE 556           HB       ILE 556  58.517  25.655  11.255
  880   HG12  ILE 556          HG12      ILE 556  60.982  24.349  12.397
  881   HG13  ILE 556          HG11      ILE 556  60.007  25.352  13.440
  882   HG21  ILE 556          HG21      ILE 556  61.215  25.152   9.995
  883   HG22  ILE 556          HG22      ILE 556  59.665  25.410   9.193
  884   HG23  ILE 556          HG23      ILE 556  59.966  23.916  10.077
  885   HD11  ILE 556          HD11      ILE 556  59.555  22.686  13.022
  886   HD12  ILE 556          HD12      ILE 556  58.457  23.388  11.836
  887   HD13  ILE 556          HD13      ILE 556  58.312  23.820  13.541
  888    H    THR 557           HN       THR 557  61.623  28.785  10.381
  889    HA   THR 557           HA       THR 557  59.526  29.629   8.442
  890    HB   THR 557           HB       THR 557  60.633  31.686   8.337
  891    HG1  THR 557           HG1      THR 557  62.920  31.312   9.594
  892   HG21  THR 557          HG21      THR 557  59.766  30.986  10.658
  893   HG22  THR 557          HG22      THR 557  60.895  32.343  10.607
  894   HG23  THR 557          HG23      THR 557  61.460  30.743  11.082
  895    H    GLY 558           HN       GLY 558  59.696  27.971   6.931
  896    HA2  GLY 558           HA2      GLY 558  61.081  28.265   4.620
  897    HA3  GLY 558           HA1      GLY 558  62.244  27.374   5.610
  898    H    ARG 559           HN       ARG 559  61.860  25.244   6.073
  899    HA   ARG 559           HA       ARG 559  59.462  23.957   4.827
  900    HB2  ARG 559           HB2      ARG 559  62.347  23.130   5.108
  901    HB3  ARG 559           HB1      ARG 559  61.108  21.877   5.052
  902    HG2  ARG 559           HG2      ARG 559  61.097  24.071   2.985
  903    HG3  ARG 559           HG1      ARG 559  62.223  22.728   2.813
  904    HD2  ARG 559           HD2      ARG 559  60.506  21.147   2.568
  905    HD3  ARG 559           HD1      ARG 559  59.305  22.184   3.338
  906    HE   ARG 559           HE       ARG 559  60.031  23.583   1.056
  907   HH11  ARG 559          HH11      ARG 559  58.965  23.321  -0.922
  908   HH12  ARG 559          HH12      ARG 559  58.126  21.842  -1.248
  909   HH21  ARG 559          HH21      ARG 559  58.920  20.406   1.805
  910   HH22  ARG 559          HH22      ARG 559  58.100  20.193   0.295
  911    H    CYS 560           HN       CYS 560  58.482  22.260   6.137
  912    HA   CYS 560           HA       CYS 560  59.450  22.087   8.932
  913    HB2  CYS 560           HB2      CYS 560  57.170  22.504   9.816
  914    HB3  CYS 560           HB1      CYS 560  57.873  23.926   9.037
  915    HG   CYS 560           HG       CYS 560  55.794  23.898   7.673
  916    H    ILE 561           HN       ILE 561  59.452  20.128   9.630
  917    HA   ILE 561           HA       ILE 561  57.961  18.038   8.174
  918    HB   ILE 561           HB       ILE 561  59.943  17.925  10.469
  919   HG12  ILE 561          HG12      ILE 561  60.138  17.386   7.511
  920   HG13  ILE 561          HG11      ILE 561  60.879  18.729   8.366
  921   HG21  ILE 561          HG21      ILE 561  60.014  15.537  10.134
  922   HG22  ILE 561          HG22      ILE 561  58.934  15.642   8.746
  923   HG23  ILE 561          HG23      ILE 561  58.319  15.971  10.371
  924   HD11  ILE 561          HD11      ILE 561  62.591  17.070   8.055
  925   HD12  ILE 561          HD12      ILE 561  61.535  15.789   8.656
  926   HD13  ILE 561          HD13      ILE 561  62.128  17.035   9.757
  927    H    THR 562           HN       THR 562  56.401  16.852   9.152
  928    HA   THR 562           HA       THR 562  55.374  17.820  11.793
  929    HB   THR 562           HB       THR 562  53.605  16.739   9.610
  930    HG1  THR 562           HG1      THR 562  54.219  19.432  10.236
  931   HG21  THR 562          HG21      THR 562  52.886  16.748  12.039
  932   HG22  THR 562          HG22      THR 562  51.837  17.654  10.946
  933   HG23  THR 562          HG23      THR 562  52.985  18.508  11.976
  934    H    ALA 563           HN       ALA 563  54.592  16.322  13.165
  935    HA   ALA 563           HA       ALA 563  55.092  13.455  12.477
  936    HB1  ALA 563           HB1      ALA 563  55.425  14.728  15.189
  937    HB2  ALA 563           HB2      ALA 563  56.752  14.606  14.029
  938    HB3  ALA 563           HB3      ALA 563  55.988  13.139  14.664
  939    H    MET 564           HN       MET 564  54.115  13.392  15.486
  940    HA   MET 564           HA       MET 564  51.462  12.468  14.937
  941    HB2  MET 564           HB2      MET 564  52.346  13.439  17.644
  942    HB3  MET 564           HB1      MET 564  51.355  12.037  17.236
  943    HG2  MET 564           HG2      MET 564  53.478  11.131  16.056
  944    HG3  MET 564           HG1      MET 564  54.336  12.373  16.964
  945    HE1  MET 564           HE1      MET 564  55.455   9.946  17.322
  946    HE2  MET 564           HE2      MET 564  55.339   9.309  18.960
  947    HE3  MET 564           HE3      MET 564  55.809  10.988  18.707
  948    H    ALA 565           HN       ALA 565  52.210  15.212  14.174
  949    HA   ALA 565           HA       ALA 565  50.618  16.986  13.709
  950    HB1  ALA 565           HB1      ALA 565  49.107  17.809  15.380
  951    HB2  ALA 565           HB2      ALA 565  49.878  16.860  16.646
  952    HB3  ALA 565           HB3      ALA 565  48.933  16.056  15.385
  953    H    LYS 566           HN       LYS 566  53.098  16.248  15.784
  954    HA   LYS 566           HA       LYS 566  53.662  18.970  16.716
  955    HB2  LYS 566           HB2      LYS 566  55.458  16.529  16.664
  956    HB3  LYS 566           HB1      LYS 566  55.682  17.974  17.633
  957    HG2  LYS 566           HG2      LYS 566  53.283  16.137  17.857
  958    HG3  LYS 566           HG1      LYS 566  54.694  16.042  18.897
  959    HD2  LYS 566           HD2      LYS 566  53.573  17.509  20.256
  960    HD3  LYS 566           HD1      LYS 566  54.056  18.740  19.093
  961    HE2  LYS 566           HE2      LYS 566  51.739  19.062  19.218
  962    HE3  LYS 566           HE1      LYS 566  51.870  17.994  17.820
  963    HZ1  LYS 566           HZ1      LYS 566  51.062  16.226  18.971
  964    HZ2  LYS 566           HZ2      LYS 566  50.242  17.470  19.787
  965    HZ3  LYS 566           HZ3      LYS 566  51.635  16.776  20.469
  966    H    LYS 567           HN       LYS 567  55.368  20.281  15.875
  967    HA   LYS 567           HA       LYS 567  56.027  19.685  13.032
  968    HB2  LYS 567           HB2      LYS 567  56.781  22.223  14.436
  969    HB3  LYS 567           HB1      LYS 567  56.347  21.984  12.755
  970    HG2  LYS 567           HG2      LYS 567  54.459  21.862  15.132
  971    HG3  LYS 567           HG1      LYS 567  54.537  23.148  13.937
  972    HD2  LYS 567           HD2      LYS 567  53.834  20.253  13.280
  973    HD3  LYS 567           HD1      LYS 567  52.661  21.544  13.528
  974    HE2  LYS 567           HE2      LYS 567  53.922  22.839  11.704
  975    HE3  LYS 567           HE1      LYS 567  54.710  21.310  11.328
  976    HZ1  LYS 567           HZ1      LYS 567  52.140  22.177  10.602
  977    HZ2  LYS 567           HZ2      LYS 567  51.992  20.799  11.584
  978    HZ3  LYS 567           HZ3      LYS 567  52.933  20.742  10.171
  979    H    PHE 568           HN       PHE 568  58.398  20.485  12.452
  980    HA   PHE 568           HA       PHE 568  60.320  20.026  14.628
  981    HB2  PHE 568           HB2      PHE 568  59.506  17.863  12.765
  982    HB3  PHE 568           HB1      PHE 568  61.242  18.051  12.909
  983    HD1  PHE 568           HD1      PHE 568  58.377  16.530  14.336
  984    HD2  PHE 568           HD2      PHE 568  62.132  18.329  15.398
  985    HE1  PHE 568           HE1      PHE 568  58.333  15.339  16.510
  986    HE2  PHE 568           HE2      PHE 568  62.087  17.137  17.572
  987    HZ   PHE 568           HZ       PHE 568  60.188  15.642  18.128
  988    H    HIS 569           HN       HIS 569  62.150  21.093  14.167
  989    HA   HIS 569           HA       HIS 569  62.493  22.700  11.867
  990    HB2  HIS 569           HB2      HIS 569  64.215  21.696  14.040
  991    HB3  HIS 569           HB1      HIS 569  65.089  22.155  12.595
  992    HD2  HIS 569           HD2      HIS 569  63.841  24.985  11.824
  993    HE1  HIS 569           HE1      HIS 569  64.343  25.954  15.897
  994    HA   PRO 570           HA       PRO 570  63.034  19.093   9.130
  995    HB2  PRO 570           HB2      PRO 570  64.393  21.117   7.398
  996    HB3  PRO 570           HB1      PRO 570  63.083  19.993   6.997
  997    HG2  PRO 570           HG2      PRO 570  62.658  22.665   7.379
  998    HG3  PRO 570           HG1      PRO 570  61.435  21.441   7.733
  999    HD2  PRO 570           HD2      PRO 570  63.034  23.070   9.628
 1000    HD3  PRO 570           HD1      PRO 570  61.493  22.219   9.887
 1001    H    GLU 571           HN       GLU 571  65.316  21.123  10.636
 1002    HA   GLU 571           HA       GLU 571  67.683  19.594   9.741
 1003    HB2  GLU 571           HB2      GLU 571  67.736  21.835  11.748
 1004    HB3  GLU 571           HB1      GLU 571  68.970  21.354  10.586
 1005    HG2  GLU 571           HG2      GLU 571  67.345  22.022   8.758
 1006    HG3  GLU 571           HG1      GLU 571  66.345  22.728  10.033
 1007    H    HIS 572           HN       HIS 572  66.184  20.613  12.837
 1008    HA   HIS 572           HA       HIS 572  67.850  18.942  14.443
 1009    HB2  HIS 572           HB2      HIS 572  65.088  20.035  15.004
 1010    HB3  HIS 572           HB1      HIS 572  65.978  19.101  16.183
 1011    HD2  HIS 572           HD2      HIS 572  68.979  20.476  15.570
 1012    HE1  HIS 572           HE1      HIS 572  67.197  24.073  16.811
 1013    H    PHE 573           HN       PHE 573  65.737  17.968  12.129
 1014    HA   PHE 573           HA       PHE 573  65.508  15.256  13.398
 1015    HB2  PHE 573           HB2      PHE 573  63.317  16.744  13.042
 1016    HB3  PHE 573           HB1      PHE 573  63.480  16.179  11.387
 1017    HD1  PHE 573           HD1      PHE 573  63.391  13.743  10.869
 1018    HD2  PHE 573           HD2      PHE 573  62.692  15.253  14.829
 1019    HE1  PHE 573           HE1      PHE 573  62.388  11.570  11.520
 1020    HE2  PHE 573           HE2      PHE 573  61.688  13.081  15.480
 1021    HZ   PHE 573           HZ       PHE 573  61.535  11.240  13.826
 1022    H    VAL 574           HN       VAL 574  67.693  15.716  12.059
 1023    HA   VAL 574           HA       VAL 574  67.396  15.163   9.187
 1024    HB   VAL 574           HB       VAL 574  69.888  15.361   9.186
 1025   HG11  VAL 574          HG11      VAL 574  69.503  17.915  10.294
 1026   HG12  VAL 574          HG12      VAL 574  67.900  17.430   9.739
 1027   HG13  VAL 574          HG13      VAL 574  69.249  17.460   8.623
 1028   HG21  VAL 574          HG21      VAL 574  70.932  16.242  11.245
 1029   HG22  VAL 574          HG22      VAL 574  70.253  14.640  11.514
 1030   HG23  VAL 574          HG23      VAL 574  69.405  16.079  12.101
 1031    H    CYS 575           HN       CYS 575  69.212  13.570   8.349
 1032    HA   CYS 575           HA       CYS 575  68.739  10.923   9.551
 1033    HB2  CYS 575           HB2      CYS 575  68.911  10.411   7.339
 1034    HB3  CYS 575           HB1      CYS 575  69.618  11.984   6.986
 1035    H    ALA 576           HN       ALA 576  70.398   9.606  10.574
 1036    HA   ALA 576           HA       ALA 576  72.713  11.295  11.475
 1037    HB1  ALA 576           HB1      ALA 576  71.490   8.694  12.408
 1038    HB2  ALA 576           HB2      ALA 576  71.712  10.194  13.306
 1039    HB3  ALA 576           HB3      ALA 576  73.104   9.174  12.938
 1040    H    PHE 577           HN       PHE 577  73.538  11.157   9.276
 1041    HA   PHE 577           HA       PHE 577  75.711   9.228   9.079
 1042    HB2  PHE 577           HB2      PHE 577  73.793   8.244   7.615
 1043    HB3  PHE 577           HB1      PHE 577  73.985   9.657   6.600
 1044    HD1  PHE 577           HD1      PHE 577  74.329   6.958   5.431
 1045    HD2  PHE 577           HD2      PHE 577  77.273   9.406   7.419
 1046    HE1  PHE 577           HE1      PHE 577  76.119   5.857   4.167
 1047    HE2  PHE 577           HE2      PHE 577  79.038   8.267   6.147
 1048    HZ   PHE 577           HZ       PHE 577  78.468   6.502   4.522
 1049    H    CYS 578           HN       CYS 578  73.794  11.474   7.296
 1050    HA   CYS 578           HA       CYS 578  75.946  13.539   7.205
 1051    HB2  CYS 578           HB2      CYS 578  74.868  14.272   5.072
 1052    HB3  CYS 578           HB1      CYS 578  75.494  12.634   4.943
 1053    H    LEU 579           HN       LEU 579  74.990  14.156   9.254
 1054    HA   LEU 579           HA       LEU 579  72.318  14.604   9.854
 1055    HB2  LEU 579           HB2      LEU 579  74.747  16.147  10.777
 1056    HB3  LEU 579           HB1      LEU 579  73.175  16.213  11.552
 1057    HG   LEU 579           HG       LEU 579  73.641  13.451  11.372
 1058   HD11  LEU 579          HD11      LEU 579  76.054  14.227  10.732
 1059   HD12  LEU 579          HD12      LEU 579  75.854  12.955  11.937
 1060   HD13  LEU 579          HD13      LEU 579  76.205  14.604  12.449
 1061   HD21  LEU 579          HD21      LEU 579  73.895  13.521  13.779
 1062   HD22  LEU 579          HD22      LEU 579  72.733  14.766  13.321
 1063   HD23  LEU 579          HD23      LEU 579  74.391  15.211  13.727
 1064    H    LYS 580           HN       LYS 580  73.290  15.998   7.095
 1065    HA   LYS 580           HA       LYS 580  72.516  18.765   7.788
 1066    HB2  LYS 580           HB2      LYS 580  73.354  19.395   5.740
 1067    HB3  LYS 580           HB1      LYS 580  74.227  17.888   5.944
 1068    HG2  LYS 580           HG2      LYS 580  71.625  18.125   4.371
 1069    HG3  LYS 580           HG1      LYS 580  73.226  18.210   3.658
 1070    HD2  LYS 580           HD2      LYS 580  73.702  15.977   4.071
 1071    HD3  LYS 580           HD1      LYS 580  72.566  15.869   5.410
 1072    HE2  LYS 580           HE2      LYS 580  71.951  14.752   3.120
 1073    HE3  LYS 580           HE1      LYS 580  70.724  15.650   4.009
 1074    HZ1  LYS 580           HZ1      LYS 580  70.647  17.239   2.462
 1075    HZ2  LYS 580           HZ2      LYS 580  71.399  16.103   1.446
 1076    HZ3  LYS 580           HZ3      LYS 580  72.330  17.273   2.254
 1077    H    GLN 581           HN       GLN 581  70.863  16.036   6.040
 1078    HA   GLN 581           HA       GLN 581  68.383  17.432   6.643
 1079    HB2  GLN 581           HB2      GLN 581  69.223  18.584   4.603
 1080    HB3  GLN 581           HB1      GLN 581  68.935  17.089   3.716
 1081    HG2  GLN 581           HG2      GLN 581  66.950  18.371   3.444
 1082    HG3  GLN 581           HG1      GLN 581  66.547  17.192   4.677
 1083   HE21  GLN 581          HE21      GLN 581  66.716  17.976   6.991
 1084   HE22  GLN 581          HE22      GLN 581  66.418  19.612   7.295
 1085    H    LEU 582           HN       LEU 582  66.618  16.283   6.701
 1086    HA   LEU 582           HA       LEU 582  66.478  13.625   5.396
 1087    HB2  LEU 582           HB2      LEU 582  67.227  13.482   7.824
 1088    HB3  LEU 582           HB1      LEU 582  65.635  14.075   8.258
 1089    HG   LEU 582           HG       LEU 582  64.624  12.127   7.126
 1090   HD11  LEU 582          HD11      LEU 582  67.430  11.726   6.239
 1091   HD12  LEU 582          HD12      LEU 582  65.922  11.237   5.474
 1092   HD13  LEU 582          HD13      LEU 582  66.601  10.259   6.770
 1093   HD21  LEU 582          HD21      LEU 582  65.732  10.378   8.734
 1094   HD22  LEU 582          HD22      LEU 582  64.904  11.774   9.420
 1095   HD23  LEU 582          HD23      LEU 582  66.655  11.758   9.314
 1096    H    ASN 583           HN       ASN 583  64.089  12.832   5.587
 1097    HA   ASN 583           HA       ASN 583  62.120  15.030   5.904
 1098    HB2  ASN 583           HB2      ASN 583  62.832  13.717   3.281
 1099    HB3  ASN 583           HB1      ASN 583  61.178  14.250   3.557
 1100   HD21  ASN 583          HD21      ASN 583  62.506  15.515   1.539
 1101   HD22  ASN 583          HD22      ASN 583  62.956  17.081   2.000
 1102    H    LYS 584           HN       LYS 584  60.214  14.233   6.668
 1103    HA   LYS 584           HA       LYS 584  59.935  11.633   7.668
 1104    HB2  LYS 584           HB2      LYS 584  57.451  12.156   7.595
 1105    HB3  LYS 584           HB1      LYS 584  58.449  13.371   8.401
 1106    HG2  LYS 584           HG2      LYS 584  58.257  14.905   6.645
 1107    HG3  LYS 584           HG1      LYS 584  57.935  13.658   5.439
 1108    HD2  LYS 584           HD2      LYS 584  55.921  15.022   6.000
 1109    HD3  LYS 584           HD1      LYS 584  55.719  13.303   6.325
 1110    HE2  LYS 584           HE2      LYS 584  55.966  13.599   8.666
 1111    HE3  LYS 584           HE1      LYS 584  56.631  15.219   8.467
 1112    HZ1  LYS 584           HZ1      LYS 584  53.992  14.788   7.345
 1113    HZ2  LYS 584           HZ2      LYS 584  54.606  16.119   8.206
 1114    HZ3  LYS 584           HZ3      LYS 584  54.082  14.733   9.038
 1115    H    GLY 585           HN       GLY 585  59.641  12.767   4.437
 1116    HA2  GLY 585           HA2      GLY 585  58.045  10.464   3.526
 1117    HA3  GLY 585           HA1      GLY 585  58.650  11.780   2.523
 1118    H    THR 586           HN       THR 586  61.299  11.349   3.969
 1119    HA   THR 586           HA       THR 586  62.184   8.851   2.583
 1120    HB   THR 586           HB       THR 586  63.894   9.936   1.432
 1121    HG1  THR 586           HG1      THR 586  64.549  10.975   3.488
 1122   HG21  THR 586          HG21      THR 586  61.896  12.195   1.725
 1123   HG22  THR 586          HG22      THR 586  61.637  10.785   0.700
 1124   HG23  THR 586          HG23      THR 586  62.966  11.894   0.354
 1125    H    PHE 587           HN       PHE 587  61.628   9.687   5.431
 1126    HA   PHE 587           HA       PHE 587  64.356   9.615   6.596
 1127    HB2  PHE 587           HB2      PHE 587  63.424  10.167   8.654
 1128    HB3  PHE 587           HB1      PHE 587  62.399  11.022   7.530
 1129    HD1  PHE 587           HD1      PHE 587  62.176   9.415  10.478
 1130    HD2  PHE 587           HD2      PHE 587  60.503   9.075   6.536
 1131    HE1  PHE 587           HE1      PHE 587  60.204   8.243  11.411
 1132    HE2  PHE 587           HE2      PHE 587  58.534   7.906   7.470
 1133    HZ   PHE 587           HZ       PHE 587  58.383   7.489   9.909
 1134    H    LYS 588           HN       LYS 588  65.288   7.722   6.609
 1135    HA   LYS 588           HA       LYS 588  63.741   5.253   7.235
 1136    HB2  LYS 588           HB2      LYS 588  65.620   5.885   5.228
 1137    HB3  LYS 588           HB1      LYS 588  66.533   4.959   6.373
 1138    HG2  LYS 588           HG2      LYS 588  65.501   3.602   4.528
 1139    HG3  LYS 588           HG1      LYS 588  65.127   3.050   6.146
 1140    HD2  LYS 588           HD2      LYS 588  63.240   3.150   4.332
 1141    HD3  LYS 588           HD1      LYS 588  62.881   3.644   5.967
 1142    HE2  LYS 588           HE2      LYS 588  62.687   5.887   5.374
 1143    HE3  LYS 588           HE1      LYS 588  63.819   5.737   4.048
 1144    HZ1  LYS 588           HZ1      LYS 588  61.182   4.420   4.022
 1145    HZ2  LYS 588           HZ2      LYS 588  62.232   4.693   2.714
 1146    HZ3  LYS 588           HZ3      LYS 588  61.414   5.995   3.437
 1147    H    GLU 589           HN       GLU 589  65.086   3.661   8.644
 1148    HA   GLU 589           HA       GLU 589  66.949   5.027  10.490
 1149    HB2  GLU 589           HB2      GLU 589  65.026   5.664  11.645
 1150    HB3  GLU 589           HB1      GLU 589  64.159   4.187  11.247
 1151    HG2  GLU 589           HG2      GLU 589  65.433   2.919  12.834
 1152    HG3  GLU 589           HG1      GLU 589  66.596   4.231  13.057
 1153    H    GLN 590           HN       GLN 590  67.964   3.636  11.929
 1154    HA   GLN 590           HA       GLN 590  67.630   0.743  11.736
 1155    HB2  GLN 590           HB2      GLN 590  69.193   1.619   9.789
 1156    HB3  GLN 590           HB1      GLN 590  70.375   1.814  11.071
 1157    HG2  GLN 590           HG2      GLN 590  70.855  -0.375  10.491
 1158    HG3  GLN 590           HG1      GLN 590  69.590  -0.679  11.680
 1159   HE21  GLN 590          HE21      GLN 590  70.488  -1.962   8.915
 1160   HE22  GLN 590          HE22      GLN 590  69.001  -2.215   8.135
 1161    H    ASN 591           HN       ASN 591  68.614  -0.229  13.588
 1162    HA   ASN 591           HA       ASN 591  69.168  -0.173  15.857
 1163    HB2  ASN 591           HB2      ASN 591  71.399   1.413  16.062
 1164    HB3  ASN 591           HB1      ASN 591  71.426  -0.242  15.491
 1165   HD21  ASN 591          HD21      ASN 591  70.776  -0.317  12.997
 1166   HD22  ASN 591          HD22      ASN 591  71.591   0.801  12.023
 1167    H    ASP 592           HN       ASP 592  67.335   2.008  14.826
 1168    HA   ASP 592           HA       ASP 592  66.065   3.621  15.988
 1169    HB2  ASP 592           HB2      ASP 592  68.248   3.987  18.024
 1170    HB3  ASP 592           HB1      ASP 592  66.509   4.190  18.211
 1171    H    LYS 593           HN       LYS 593  69.107   3.968  14.683
 1172    HA   LYS 593           HA       LYS 593  69.346   6.856  15.116
 1173    HB2  LYS 593           HB2      LYS 593  70.944   5.024  13.349
 1174    HB3  LYS 593           HB1      LYS 593  71.394   6.637  13.880
 1175    HG2  LYS 593           HG2      LYS 593  71.076   5.607  16.294
 1176    HG3  LYS 593           HG1      LYS 593  71.306   4.077  15.452
 1177    HD2  LYS 593           HD2      LYS 593  73.442   4.883  14.532
 1178    HD3  LYS 593           HD1      LYS 593  73.216   6.432  15.343
 1179    HE2  LYS 593           HE2      LYS 593  73.176   3.868  16.932
 1180    HE3  LYS 593           HE1      LYS 593  74.709   4.619  16.491
 1181    HZ1  LYS 593           HZ1      LYS 593  72.706   6.404  17.593
 1182    HZ2  LYS 593           HZ2      LYS 593  74.379   6.330  17.882
 1183    HZ3  LYS 593           HZ3      LYS 593  73.328   5.255  18.674
 1184    HA   PRO 594           HA       PRO 594  66.620   7.496  11.480
 1185    HB2  PRO 594           HB2      PRO 594  68.038  10.117  11.462
 1186    HB3  PRO 594           HB1      PRO 594  66.306   9.787  11.421
 1187    HG2  PRO 594           HG2      PRO 594  67.575  10.717  13.633
 1188    HG3  PRO 594           HG1      PRO 594  66.162   9.654  13.728
 1189    HD2  PRO 594           HD2      PRO 594  69.013   9.029  14.319
 1190    HD3  PRO 594           HD1      PRO 594  67.536   8.211  14.885
 1191    H    TYR 595           HN       TYR 595  67.013   7.995   9.131
 1192    HA   TYR 595           HA       TYR 595  69.727   8.265   8.121
 1193    HB2  TYR 595           HB2      TYR 595  68.451   5.536   8.275
 1194    HB3  TYR 595           HB1      TYR 595  69.550   5.910   6.960
 1195    HD1  TYR 595           HD1      TYR 595  71.781   7.202   7.851
 1196    HD2  TYR 595           HD2      TYR 595  69.413   4.403  10.077
 1197    HE1  TYR 595           HE1      TYR 595  73.757   6.634   9.249
 1198    HE2  TYR 595           HE2      TYR 595  71.387   3.846  11.467
 1199    HH   TYR 595           HH       TYR 595  74.209   5.717  11.498
 1200    H    CYS 596           HN       CYS 596  69.617   8.847   5.919
 1201    HA   CYS 596           HA       CYS 596  66.967   9.124   4.703
 1202    HB2  CYS 596           HB2      CYS 596  69.527   9.152   3.088
 1203    HB3  CYS 596           HB1      CYS 596  68.054  10.072   2.833
 1204    H    GLN 597           HN       GLN 597  66.285   7.745   2.830
 1205    HA   GLN 597           HA       GLN 597  66.868   5.002   3.293
 1206    HB2  GLN 597           HB2      GLN 597  64.878   5.277   2.105
 1207    HB3  GLN 597           HB1      GLN 597  65.525   6.564   1.130
 1208    HG2  GLN 597           HG2      GLN 597  65.359   4.847  -0.439
 1209    HG3  GLN 597           HG1      GLN 597  67.011   4.644   0.102
 1210   HE21  GLN 597          HE21      GLN 597  65.930   3.629   2.778
 1211   HE22  GLN 597          HE22      GLN 597  65.483   2.038   2.469
 1212    H    ASN 598           HN       ASN 598  67.996   7.174   0.707
 1213    HA   ASN 598           HA       ASN 598  69.894   5.523  -0.494
 1214    HB2  ASN 598           HB2      ASN 598  70.621   8.390   0.023
 1215    HB3  ASN 598           HB1      ASN 598  70.745   7.459  -1.464
 1216   HD21  ASN 598          HD21      ASN 598  68.284   6.527  -1.952
 1217   HD22  ASN 598          HD22      ASN 598  67.146   7.775  -2.057
 1218    H    CYS 599           HN       CYS 599  70.014   7.137   2.605
 1219    HA   CYS 599           HA       CYS 599  72.860   6.616   3.009
 1220    HB2  CYS 599           HB2      CYS 599  70.632   7.810   4.618
 1221    HB3  CYS 599           HB1      CYS 599  72.039   7.215   5.484
 1222    H    PHE 600           HN       PHE 600  69.877   5.440   4.606
 1223    HA   PHE 600           HA       PHE 600  71.097   3.315   6.036
 1224    HB2  PHE 600           HB2      PHE 600  68.970   3.674   6.842
 1225    HB3  PHE 600           HB1      PHE 600  68.364   4.154   5.265
 1226    HD1  PHE 600           HD1      PHE 600  69.031   1.288   7.498
 1227    HD2  PHE 600           HD2      PHE 600  67.448   2.539   3.716
 1228    HE1  PHE 600           HE1      PHE 600  67.962  -0.932   7.213
 1229    HE2  PHE 600           HE2      PHE 600  66.378   0.321   3.425
 1230    HZ   PHE 600           HZ       PHE 600  66.636  -1.417   5.175
 1231    H    LEU 601           HN       LEU 601  69.139   3.068   3.041
 1232    HA   LEU 601           HA       LEU 601  69.518   0.383   2.520
 1233    HB2  LEU 601           HB2      LEU 601  68.396   0.928   0.618
 1234    HB3  LEU 601           HB1      LEU 601  68.506   2.602   1.133
 1235    HG   LEU 601           HG       LEU 601  70.711   2.748  -0.099
 1236   HD11  LEU 601          HD11      LEU 601  70.225  -0.114  -0.421
 1237   HD12  LEU 601          HD12      LEU 601  71.670   0.817  -0.799
 1238   HD13  LEU 601          HD13      LEU 601  70.392   0.661  -1.996
 1239   HD21  LEU 601          HD21      LEU 601  68.709   3.642  -1.100
 1240   HD22  LEU 601          HD22      LEU 601  68.178   2.040  -1.600
 1241   HD23  LEU 601          HD23      LEU 601  69.587   2.780  -2.359
 1242    H    LYS 602           HN       LYS 602  71.757   3.014   1.872
 1243    HA   LYS 602           HA       LYS 602  73.686   1.517   0.412
 1244    HB2  LYS 602           HB2      LYS 602  73.710   3.958   0.484
 1245    HB3  LYS 602           HB1      LYS 602  74.061   3.925   2.203
 1246    HG2  LYS 602           HG2      LYS 602  76.049   4.343   0.835
 1247    HG3  LYS 602           HG1      LYS 602  76.193   2.854   1.759
 1248    HD2  LYS 602           HD2      LYS 602  75.951   1.497  -0.135
 1249    HD3  LYS 602           HD1      LYS 602  75.110   2.750  -1.049
 1250    HE2  LYS 602           HE2      LYS 602  78.058   2.723  -0.333
 1251    HE3  LYS 602           HE1      LYS 602  77.363   2.468  -1.932
 1252    HZ1  LYS 602           HZ1      LYS 602  77.702   4.933  -0.431
 1253    HZ2  LYS 602           HZ2      LYS 602  76.257   4.787  -1.312
 1254    HZ3  LYS 602           HZ3      LYS 602  77.755   4.665  -2.105
 1255    H    LEU 603           HN       LEU 603  72.947   1.501   3.814
 1256    HA   LEU 603           HA       LEU 603  75.582   0.353   4.519
 1257    HB2  LEU 603           HB2      LEU 603  73.297   0.540   6.454
 1258    HB3  LEU 603           HB1      LEU 603  75.027   0.729   6.746
 1259    HG   LEU 603           HG       LEU 603  73.195   2.650   5.315
 1260   HD11  LEU 603          HD11      LEU 603  74.911   3.389   7.648
 1261   HD12  LEU 603          HD12      LEU 603  73.443   2.459   7.959
 1262   HD13  LEU 603          HD13      LEU 603  73.343   4.027   7.161
 1263   HD21  LEU 603          HD21      LEU 603  75.142   2.994   4.094
 1264   HD22  LEU 603          HD22      LEU 603  76.188   2.444   5.400
 1265   HD23  LEU 603          HD23      LEU 603  75.471   4.051   5.460
 1266    H    PHE 604           HN       PHE 604  72.176  -0.694   4.974
 1267    HA   PHE 604           HA       PHE 604  73.154  -3.495   5.217
 1268    HB2  PHE 604           HB2      PHE 604  70.668  -2.013   6.004
 1269    HB3  PHE 604           HB1      PHE 604  70.508  -3.736   5.664
 1270    HD1  PHE 604           HD1      PHE 604  72.538  -1.287   7.684
 1271    HD2  PHE 604           HD2      PHE 604  71.127  -5.333   7.278
 1272    HE1  PHE 604           HE1      PHE 604  73.468  -1.841   9.909
 1273    HE2  PHE 604           HE2      PHE 604  72.061  -5.878   9.507
 1274    HZ   PHE 604           HZ       PHE 604  73.232  -4.133  10.822
 1275    H    CYS 605           HN       CYS 605  72.632  -1.679   2.659
 1276    HA   CYS 605           HA       CYS 605  71.819  -3.950   1.007
 1277    HB2  CYS 605           HB2      CYS 605  70.009  -1.570   1.396
 1278    HB3  CYS 605           HB1      CYS 605  69.983  -2.484  -0.109
 1279    HG   CYS 605           HG       CYS 605  68.515  -4.071   1.088
  Start of MODEL   19
    1    H    MET   1           HT1      MET   1  94.200 -28.652   7.925
    2    HA   MET   1           HA       MET   1  92.919 -27.797   5.925
    3    HB2  MET   1           HB2      MET   1  91.990 -25.790   7.988
    4    HB3  MET   1           HB1      MET   1  91.613 -25.789   6.287
    5    HG2  MET   1           HG2      MET   1  90.905 -28.154   7.970
    6    HG3  MET   1           HG1      MET   1  89.893 -26.723   8.005
    7    HE1  MET   1           HE1      MET   1  88.302 -28.695   7.473
    8    HE2  MET   1           HE2      MET   1  87.655 -28.803   5.838
    9    HE3  MET   1           HE3      MET   1  87.640 -27.257   6.683
   10    H    ALA   2           HN       ALA   2  93.577 -25.410   8.417
   11    HA   ALA   2           HA       ALA   2  96.364 -25.039   7.920
   12    HB1  ALA   2           HB1      ALA   2  95.924 -24.317   5.698
   13    HB2  ALA   2           HB2      ALA   2  96.103 -22.825   6.618
   14    HB3  ALA   2           HB3      ALA   2  94.495 -23.412   6.194
   15    H    LEU   3           HN       LEU   3  93.383 -24.236   9.265
   16    HA   LEU   3           HA       LEU   3  93.532 -21.699  10.351
   17    HB2  LEU   3           HB2      LEU   3  92.988 -24.197  11.963
   18    HB3  LEU   3           HB1      LEU   3  92.405 -22.577  12.311
   19    HG   LEU   3           HG       LEU   3  91.557 -23.098   9.647
   20   HD11  LEU   3          HD11      LEU   3  90.830 -25.456  11.398
   21   HD12  LEU   3          HD12      LEU   3  92.163 -25.515  10.245
   22   HD13  LEU   3          HD13      LEU   3  90.512 -25.238   9.679
   23   HD21  LEU   3          HD21      LEU   3  90.217 -21.867  11.196
   24   HD22  LEU   3          HD22      LEU   3  90.147 -23.228  12.312
   25   HD23  LEU   3          HD23      LEU   3  89.294 -23.307  10.769
   26    H    ASP   4           HN       ASP   4  94.727 -24.509  12.047
   27    HA   ASP   4           HA       ASP   4  96.432 -22.917  13.760
   28    HB2  ASP   4           HB2      ASP   4  95.436 -24.933  14.659
   29    HB3  ASP   4           HB1      ASP   4  96.109 -25.898  13.344
   30    H    GLY   5           HN       GLY   5  96.739 -23.345  10.674
   31    HA2  GLY   5           HA2      GLY   5  99.266 -24.604  10.203
   32    HA3  GLY   5           HA1      GLY   5  98.566 -23.333   9.193
   33    H    ILE   6           HN       ILE   6  98.355 -21.856  11.849
   34    HA   ILE   6           HA       ILE   6 101.122 -20.720  11.889
   35    HB   ILE   6           HB       ILE   6  99.497 -18.729  12.866
   36   HG12  ILE   6          HG12      ILE   6  97.533 -20.311  12.278
   37   HG13  ILE   6          HG11      ILE   6  97.419 -18.641  11.758
   38   HG21  ILE   6          HG21      ILE   6  99.500 -17.923  10.362
   39   HG22  ILE   6          HG22      ILE   6 100.503 -19.346  10.108
   40   HG23  ILE   6          HG23      ILE   6 101.025 -18.090  11.230
   41   HD11  ILE   6          HD11      ILE   6  98.714 -20.440   9.785
   42   HD12  ILE   6          HD12      ILE   6  97.498 -19.189   9.551
   43   HD13  ILE   6          HD13      ILE   6  97.021 -20.784  10.118
   44    H    ARG   7           HN       ARG   7  99.056 -19.539  14.339
   45    HA   ARG   7           HA       ARG   7  99.286 -21.604  16.201
   46    HB2  ARG   7           HB2      ARG   7 101.744 -20.671  15.786
   47    HB3  ARG   7           HB1      ARG   7 101.267 -19.428  16.847
   48    HG2  ARG   7           HG2      ARG   7 102.179 -21.069  18.275
   49    HG3  ARG   7           HG1      ARG   7 100.431 -21.284  18.374
   50    HD2  ARG   7           HD2      ARG   7 100.894 -23.468  17.865
   51    HD3  ARG   7           HD1      ARG   7 100.981 -22.821  16.221
   52    HE   ARG   7           HE       ARG   7 103.547 -22.485  17.294
   53   HH11  ARG   7          HH11      ARG   7 105.159 -24.037  16.967
   54   HH12  ARG   7          HH12      ARG   7 104.710 -25.669  16.599
   55   HH21  ARG   7          HH21      ARG   7 101.303 -25.035  16.698
   56   HH22  ARG   7          HH22      ARG   7 102.528 -26.233  16.447
   57    H    MET   8           HN       MET   8 100.106 -18.347  17.037
   58    HA   MET   8           HA       MET   8  97.416 -18.070  18.301
   59    HB2  MET   8           HB2      MET   8  99.465 -16.424  19.583
   60    HB3  MET   8           HB1      MET   8  98.385 -17.615  20.282
   61    HG2  MET   8           HG2      MET   8 100.010 -19.366  19.165
   62    HG3  MET   8           HG1      MET   8 101.139 -18.041  19.156
   63    HE1  MET   8           HE1      MET   8 100.721 -16.322  21.621
   64    HE2  MET   8           HE2      MET   8 102.221 -16.986  20.977
   65    HE3  MET   8           HE3      MET   8 101.862 -17.142  22.695
   66    HA   PRO   9           HA       PRO   9  98.577 -13.516  16.985
   67    HB2  PRO   9           HB2      PRO   9 100.451 -14.207  14.741
   68    HB3  PRO   9           HB1      PRO   9 100.469 -12.799  15.830
   69    HG2  PRO   9           HG2      PRO   9 102.191 -14.706  16.238
   70    HG3  PRO   9           HG1      PRO   9 101.267 -14.060  17.615
   71    HD2  PRO   9           HD2      PRO   9 100.763 -16.614  16.090
   72    HD3  PRO   9           HD1      PRO   9 100.842 -16.342  17.830
   73    H    ASP  10           HN       ASP  10  98.682 -16.096  14.632
   74    HA   ASP  10           HA       ASP  10  96.388 -14.858  13.140
   75    HB2  ASP  10           HB2      ASP  10  98.614 -14.885  11.942
   76    HB3  ASP  10           HB1      ASP  10  98.548 -16.637  12.010
   77    H    GLY  11           HN       GLY  11  97.754 -17.572  14.726
   78    HA2  GLY  11           HA2      GLY  11  95.810 -19.497  13.644
   79    HA3  GLY  11           HA1      GLY  11  97.032 -19.827  14.877
   80    H    CYS  12           HN       CYS  12  95.616 -16.997  15.756
   81    HA   CYS  12           HA       CYS  12  93.226 -18.123  17.056
   82    HB2  CYS  12           HB2      CYS  12  95.169 -18.676  18.563
   83    HB3  CYS  12           HB1      CYS  12  95.458 -16.943  18.714
   84    HG   CYS  12           HG       CYS  12  92.668 -18.076  19.521
   85    H    TYR  13           HN       TYR  13  95.458 -15.312  17.116
   86    HA   TYR  13           HA       TYR  13  95.038 -13.040  16.992
   87    HB2  TYR  13           HB2      TYR  13  92.946 -14.295  15.303
   88    HB3  TYR  13           HB1      TYR  13  92.476 -12.733  15.942
   89    HD1  TYR  13           HD1      TYR  13  94.648 -10.996  15.916
   90    HD2  TYR  13           HD2      TYR  13  93.875 -14.206  13.163
   91    HE1  TYR  13           HE1      TYR  13  96.039  -9.866  14.203
   92    HE2  TYR  13           HE2      TYR  13  95.266 -13.074  11.453
   93    HH   TYR  13           HH       TYR  13  96.064 -10.839  10.921
   94    H    ALA  14           HN       ALA  14  91.747 -14.266  17.528
   95    HA   ALA  14           HA       ALA  14  91.524 -14.147  20.271
   96    HB1  ALA  14           HB1      ALA  14  91.705 -11.436  19.045
   97    HB2  ALA  14           HB2      ALA  14  92.179 -11.962  20.657
   98    HB3  ALA  14           HB3      ALA  14  90.481 -11.644  20.300
   99    H    ASP  15           HN       ASP  15  90.058 -13.016  17.271
  100    HA   ASP  15           HA       ASP  15  87.671 -14.618  17.867
  101    HB2  ASP  15           HB2      ASP  15  87.327 -12.355  18.960
  102    HB3  ASP  15           HB1      ASP  15  87.375 -11.658  17.341
  103    H    GLY  16           HN       GLY  16  89.941 -13.706  15.770
  104    HA2  GLY  16           HA2      GLY  16  90.086 -14.194  13.447
  105    HA3  GLY  16           HA1      GLY  16  88.341 -14.459  13.424
  106    H    THR  17           HN       THR  17  89.344 -11.633  15.014
  107    HA   THR  17           HA       THR  17  88.103  -9.977  12.923
  108    HB   THR  17           HB       THR  17  88.464  -8.183  14.674
  109    HG1  THR  17           HG1      THR  17  89.445 -10.451  16.032
  110   HG21  THR  17          HG21      THR  17  86.916 -10.699  15.264
  111   HG22  THR  17          HG22      THR  17  86.317  -9.181  14.589
  112   HG23  THR  17          HG23      THR  17  86.797  -9.264  16.284
  113    H    TRP  18           HN       TRP  18  89.266  -8.962  11.467
  114    HA   TRP  18           HA       TRP  18  92.134  -8.267  12.012
  115    HB2  TRP  18           HB2      TRP  18  91.847  -8.256   9.228
  116    HB3  TRP  18           HB1      TRP  18  92.616  -9.524  10.167
  117    HD1  TRP  18           HD1      TRP  18  89.409  -8.697   8.307
  118    HE1  TRP  18           HE1      TRP  18  88.030 -10.858   8.029
  119    HE3  TRP  18           HE3      TRP  18  92.120 -11.862  11.259
  120    HZ2  TRP  18           HZ2      TRP  18  88.069 -13.570   8.941
  121    HZ3  TRP  18           HZ3      TRP  18  91.430 -14.226  11.535
  122    HH2  TRP  18           HH2      TRP  18  89.409 -15.083  10.382
  123    H    GLU  19           HN       GLU  19  92.378  -6.097  12.137
  124    HA   GLU  19           HA       GLU  19  90.163  -4.372  11.365
  125    HB2  GLU  19           HB2      GLU  19  92.314  -2.672  11.995
  126    HB3  GLU  19           HB1      GLU  19  91.027  -3.166  13.084
  127    HG2  GLU  19           HG2      GLU  19  93.251  -3.609  14.033
  128    HG3  GLU  19           HG1      GLU  19  92.334  -5.097  13.788
  129    H    LEU  20           HN       LEU  20  89.915  -3.307   9.501
  130    HA   LEU  20           HA       LEU  20  91.987  -3.588   7.432
  131    HB2  LEU  20           HB2      LEU  20  89.147  -3.326   7.452
  132    HB3  LEU  20           HB1      LEU  20  89.744  -1.871   6.671
  133    HG   LEU  20           HG       LEU  20  89.381  -3.539   4.971
  134   HD11  LEU  20          HD11      LEU  20  91.684  -2.147   5.175
  135   HD12  LEU  20          HD12      LEU  20  91.331  -3.237   3.836
  136   HD13  LEU  20          HD13      LEU  20  92.345  -3.785   5.167
  137   HD21  LEU  20          HD21      LEU  20  90.080  -5.768   5.072
  138   HD22  LEU  20          HD22      LEU  20  89.713  -5.459   6.764
  139   HD23  LEU  20          HD23      LEU  20  91.383  -5.424   6.202
  140    H    SER  21           HN       SER  21  93.361  -1.947   6.853
  141    HA   SER  21           HA       SER  21  93.479   0.380   8.608
  142    HB2  SER  21           HB2      SER  21  95.420  -0.965   7.402
  143    HB3  SER  21           HB1      SER  21  95.110   0.182   6.097
  144    HG   SER  21           HG       SER  21  95.412   1.025   8.779
  145    H    VAL  22           HN       VAL  22  93.132   2.517   8.057
  146    HA   VAL  22           HA       VAL  22  92.030   3.086   5.353
  147    HB   VAL  22           HB       VAL  22  90.675   3.727   7.987
  148   HG11  VAL  22          HG11      VAL  22  90.654   5.835   6.851
  149   HG12  VAL  22          HG12      VAL  22  89.099   5.091   6.483
  150   HG13  VAL  22          HG13      VAL  22  90.392   5.069   5.283
  151   HG21  VAL  22          HG21      VAL  22  89.777   2.506   5.353
  152   HG22  VAL  22          HG22      VAL  22  88.728   2.796   6.746
  153   HG23  VAL  22          HG23      VAL  22  90.053   1.632   6.866
  154    H    HIS  23           HN       HIS  23  93.524   4.403   4.578
  155    HA   HIS  23           HA       HIS  23  95.010   6.285   6.250
  156    HB2  HIS  23           HB2      HIS  23  94.896   5.551   3.345
  157    HB3  HIS  23           HB1      HIS  23  95.717   7.030   3.805
  158    HD1  HIS  23           HD1      HIS  23  97.919   5.715   2.925
  159    HD2  HIS  23           HD2      HIS  23  96.182   4.228   6.412
  160    HE1  HIS  23           HE1      HIS  23  99.653   4.221   4.010
  161    H    VAL  24           HN       VAL  24  93.702   7.939   7.048
  162    HA   VAL  24           HA       VAL  24  91.563   9.055   5.443
  163    HB   VAL  24           HB       VAL  24  92.775  10.579   7.740
  164   HG11  VAL  24          HG11      VAL  24  90.472  11.104   8.208
  165   HG12  VAL  24          HG12      VAL  24  89.902   9.842   7.123
  166   HG13  VAL  24          HG13      VAL  24  90.681  11.281   6.468
  167   HG21  VAL  24          HG21      VAL  24  91.313   7.929   7.914
  168   HG22  VAL  24          HG22      VAL  24  91.417   9.058   9.268
  169   HG23  VAL  24          HG23      VAL  24  92.885   8.338   8.608
  170    H    THR  25           HN       THR  25  92.300   9.826   3.540
  171    HA   THR  25           HA       THR  25  94.779  11.191   3.168
  172    HB   THR  25           HB       THR  25  94.049  11.501   0.910
  173    HG1  THR  25           HG1      THR  25  91.774  11.132   0.446
  174   HG21  THR  25          HG21      THR  25  92.573   9.022   1.824
  175   HG22  THR  25          HG22      THR  25  94.334   9.109   1.792
  176   HG23  THR  25          HG23      THR  25  93.416   9.279   0.295
  177    H    ASP  26           HN       ASP  26  91.422  12.478   3.323
  178    HA   ASP  26           HA       ASP  26  92.303  15.220   3.054
  179    HB2  ASP  26           HB2      ASP  26  89.731  13.946   3.999
  180    HB3  ASP  26           HB1      ASP  26  89.960  15.695   4.022
  181    H    LEU  27           HN       LEU  27  93.225  13.256   5.342
  182    HA   LEU  27           HA       LEU  27  93.309  15.383   7.426
  183    HB2  LEU  27           HB2      LEU  27  91.966  12.775   7.596
  184    HB3  LEU  27           HB1      LEU  27  93.062  13.047   8.933
  185    HG   LEU  27           HG       LEU  27  91.078  15.174   8.107
  186   HD11  LEU  27          HD11      LEU  27  89.660  13.277   8.461
  187   HD12  LEU  27          HD12      LEU  27  89.614  14.208   9.958
  188   HD13  LEU  27          HD13      LEU  27  90.604  12.750   9.855
  189   HD21  LEU  27          HD21      LEU  27  92.111  14.486  10.865
  190   HD22  LEU  27          HD22      LEU  27  91.453  16.018  10.290
  191   HD23  LEU  27          HD23      LEU  27  93.052  15.493   9.761
  192    H    ASN  28           HN       ASN  28  94.639  12.585   5.861
  193    HA   ASN  28           HA       ASN  28  96.867  11.904   5.664
  194    HB2  ASN  28           HB2      ASN  28  97.352  14.409   6.161
  195    HB3  ASN  28           HB1      ASN  28  97.715  13.870   7.794
  196   HD21  ASN  28          HD21      ASN  28  98.573  11.198   6.510
  197   HD22  ASN  28          HD22      ASN  28 100.155  11.502   5.986
  198    H    ARG  29           HN       ARG  29  94.837  11.290   8.028
  199    HA   ARG  29           HA       ARG  29  96.787  10.151   9.943
  200    HB2  ARG  29           HB2      ARG  29  93.768  10.217   9.989
  201    HB3  ARG  29           HB1      ARG  29  94.804   9.612  11.282
  202    HG2  ARG  29           HG2      ARG  29  95.792  11.801  11.589
  203    HG3  ARG  29           HG1      ARG  29  94.913  12.433  10.204
  204    HD2  ARG  29           HD2      ARG  29  93.608  13.126  12.041
  205    HD3  ARG  29           HD1      ARG  29  92.781  11.680  11.463
  206    HE   ARG  29           HE       ARG  29  94.354  11.906  13.963
  207   HH11  ARG  29          HH11      ARG  29  94.070  10.193  15.396
  208   HH12  ARG  29          HH12      ARG  29  93.231   8.769  14.875
  209   HH21  ARG  29          HH21      ARG  29  92.651   9.945  11.671
  210   HH22  ARG  29          HH22      ARG  29  92.432   8.632  12.775
  211    H    ASP  30           HN       ASP  30  95.810   7.959  10.788
  212    HA   ASP  30           HA       ASP  30  95.004   6.206   8.534
  213    HB2  ASP  30           HB2      ASP  30  97.368   5.764  10.374
  214    HB3  ASP  30           HB1      ASP  30  96.623   4.481   9.418
  215    H    VAL  31           HN       VAL  31  93.155   5.374   9.197
  216    HA   VAL  31           HA       VAL  31  92.806   4.745  12.104
  217    HB   VAL  31           HB       VAL  31  90.655   5.157  10.002
  218   HG11  VAL  31          HG11      VAL  31  89.268   5.412  12.095
  219   HG12  VAL  31          HG12      VAL  31  90.674   4.866  13.009
  220   HG13  VAL  31          HG13      VAL  31  89.917   3.793  11.835
  221   HG21  VAL  31          HG21      VAL  31  90.371   7.385  10.872
  222   HG22  VAL  31          HG22      VAL  31  92.094   7.218  10.540
  223   HG23  VAL  31          HG23      VAL  31  91.498   7.085  12.194
  224    H    THR  32           HN       THR  32  91.656   2.777  12.588
  225    HA   THR  32           HA       THR  32  91.736   0.720  10.425
  226    HB   THR  32           HB       THR  32  92.387  -0.536  12.929
  227    HG1  THR  32           HG1      THR  32  94.521   0.951  12.743
  228   HG21  THR  32          HG21      THR  32  93.127  -1.094  10.508
  229   HG22  THR  32          HG22      THR  32  94.316  -1.311  11.790
  230   HG23  THR  32          HG23      THR  32  94.384   0.119  10.755
  231    H    LEU  33           HN       LEU  33  89.974  -0.580  10.373
  232    HA   LEU  33           HA       LEU  33  87.899  -0.167  12.481
  233    HB2  LEU  33           HB2      LEU  33  87.780  -0.921   9.555
  234    HB3  LEU  33           HB1      LEU  33  86.407  -1.131  10.623
  235    HG   LEU  33           HG       LEU  33  86.296   0.998   9.382
  236   HD11  LEU  33          HD11      LEU  33  85.578   0.625  11.924
  237   HD12  LEU  33          HD12      LEU  33  85.458   2.202  11.154
  238   HD13  LEU  33          HD13      LEU  33  86.817   1.847  12.209
  239   HD21  LEU  33          HD21      LEU  33  87.944   2.604   9.444
  240   HD22  LEU  33          HD22      LEU  33  88.942   1.169   9.550
  241   HD23  LEU  33          HD23      LEU  33  88.557   2.086  11.012
  242    H    ARG  34           HN       ARG  34  88.012  -1.810  13.891
  243    HA   ARG  34           HA       ARG  34  89.054  -4.412  13.368
  244    HB2  ARG  34           HB2      ARG  34  88.683  -3.441  15.666
  245    HB3  ARG  34           HB1      ARG  34  86.954  -3.666  15.425
  246    HG2  ARG  34           HG2      ARG  34  87.644  -5.608  16.608
  247    HG3  ARG  34           HG1      ARG  34  87.491  -6.127  14.933
  248    HD2  ARG  34           HD2      ARG  34  89.804  -6.223  14.610
  249    HD3  ARG  34           HD1      ARG  34  90.150  -5.161  15.974
  250    HE   ARG  34           HE       ARG  34  88.878  -7.693  16.721
  251   HH11  ARG  34          HH11      ARG  34  90.165  -9.079  17.962
  252   HH12  ARG  34          HH12      ARG  34  91.862  -8.767  18.104
  253   HH21  ARG  34          HH21      ARG  34  91.781  -5.935  16.105
  254   HH22  ARG  34          HH22      ARG  34  92.777  -6.988  17.053
  255    H    VAL  35           HN       VAL  35  88.181  -5.427  11.601
  256    HA   VAL  35           HA       VAL  35  85.231  -5.965  11.645
  257    HB   VAL  35           HB       VAL  35  85.304  -5.831   9.161
  258   HG11  VAL  35          HG11      VAL  35  86.034  -3.416  10.818
  259   HG12  VAL  35          HG12      VAL  35  84.436  -3.908  10.257
  260   HG13  VAL  35          HG13      VAL  35  85.618  -3.280   9.109
  261   HG21  VAL  35          HG21      VAL  35  88.122  -4.889   9.724
  262   HG22  VAL  35          HG22      VAL  35  87.289  -4.538   8.214
  263   HG23  VAL  35          HG23      VAL  35  87.609  -6.208   8.675
  264    H    THR  36           HN       THR  36  84.997  -7.572   9.558
  265    HA   THR  36           HA       THR  36  87.034  -9.720   9.729
  266    HB   THR  36           HB       THR  36  85.066 -11.363   9.907
  267    HG1  THR  36           HG1      THR  36  83.234 -10.458  10.937
  268   HG21  THR  36          HG21      THR  36  84.862 -10.958  12.428
  269   HG22  THR  36          HG22      THR  36  85.929  -9.581  12.171
  270   HG23  THR  36          HG23      THR  36  86.482 -11.209  11.784
  271    H    GLY  37           HN       GLY  37  86.289 -11.436   7.953
  272    HA2  GLY  37           HA2      GLY  37  85.858  -9.885   5.528
  273    HA3  GLY  37           HA1      GLY  37  86.167 -11.613   5.593
  274    H    GLU  38           HN       GLU  38  83.650  -9.657   7.143
  275    HA   GLU  38           HA       GLU  38  81.584 -10.917   5.440
  276    HB2  GLU  38           HB2      GLU  38  80.344 -11.816   7.245
  277    HB3  GLU  38           HB1      GLU  38  81.998 -12.343   7.520
  278    HG2  GLU  38           HG2      GLU  38  81.570 -11.525   9.645
  279    HG3  GLU  38           HG1      GLU  38  82.074 -10.014   8.891
  280    H    VAL  39           HN       VAL  39  82.882  -8.192   6.699
  281    HA   VAL  39           HA       VAL  39  80.343  -6.881   7.423
  282    HB   VAL  39           HB       VAL  39  81.627  -5.068   8.167
  283   HG11  VAL  39          HG11      VAL  39  83.564  -7.330   8.561
  284   HG12  VAL  39          HG12      VAL  39  81.968  -7.356   9.308
  285   HG13  VAL  39          HG13      VAL  39  83.099  -6.067   9.701
  286   HG21  VAL  39          HG21      VAL  39  83.861  -6.120   6.406
  287   HG22  VAL  39          HG22      VAL  39  84.061  -4.813   7.571
  288   HG23  VAL  39          HG23      VAL  39  82.982  -4.601   6.205
  289    H    HIS  40           HN       HIS  40  79.262  -5.441   6.131
  290    HA   HIS  40           HA       HIS  40  80.010  -5.382   3.286
  291    HB2  HIS  40           HB2      HIS  40  77.770  -3.704   4.388
  292    HB3  HIS  40           HB1      HIS  40  77.852  -4.624   2.884
  293    HD1  HIS  40           HD1      HIS  40  77.442  -7.212   3.037
  294    HD2  HIS  40           HD2      HIS  40  76.851  -5.166   6.621
  295    HE1  HIS  40           HE1      HIS  40  76.221  -8.807   4.580
  296    H    ILE  41           HN       ILE  41  80.667  -3.482   2.158
  297    HA   ILE  41           HA       ILE  41  82.424  -1.709   3.391
  298    HB   ILE  41           HB       ILE  41  80.611  -1.029   1.064
  299   HG12  ILE  41          HG12      ILE  41  83.408  -2.194   1.011
  300   HG13  ILE  41          HG11      ILE  41  81.946  -3.171   0.878
  301   HG21  ILE  41          HG21      ILE  41  82.658   0.381   0.462
  302   HG22  ILE  41          HG22      ILE  41  83.205   0.114   2.116
  303   HG23  ILE  41          HG23      ILE  41  81.687   0.960   1.814
  304   HD11  ILE  41          HD11      ILE  41  82.261  -0.802  -0.936
  305   HD12  ILE  41          HD12      ILE  41  81.383  -2.304  -1.196
  306   HD13  ILE  41          HD13      ILE  41  83.142  -2.284  -1.302
  307    H    GLY  42           HN       GLY  42  79.027  -0.944   2.569
  308    HA2  GLY  42           HA2      GLY  42  78.919   1.564   3.847
  309    HA3  GLY  42           HA1      GLY  42  77.524   0.502   3.643
  310    H    GLY  43           HN       GLY  43  79.320  -1.537   5.139
  311    HA2  GLY  43           HA2      GLY  43  78.181  -1.003   7.780
  312    HA3  GLY  43           HA1      GLY  43  79.187  -2.385   7.334
  313    H    VAL  44           HN       VAL  44  81.209  -0.597   6.149
  314    HA   VAL  44           HA       VAL  44  82.765  -0.082   8.575
  315    HB   VAL  44           HB       VAL  44  83.265  -0.102   5.610
  316   HG11  VAL  44          HG11      VAL  44  84.268   2.010   6.028
  317   HG12  VAL  44          HG12      VAL  44  85.602   0.861   6.129
  318   HG13  VAL  44          HG13      VAL  44  84.876   1.502   7.603
  319   HG21  VAL  44          HG21      VAL  44  85.055  -1.576   6.209
  320   HG22  VAL  44          HG22      VAL  44  83.677  -2.041   7.206
  321   HG23  VAL  44          HG23      VAL  44  84.984  -1.081   7.900
  322    H    MET  45           HN       MET  45  81.167   1.790   6.006
  323    HA   MET  45           HA       MET  45  82.056   4.372   6.675
  324    HB2  MET  45           HB2      MET  45  79.318   3.419   5.787
  325    HB3  MET  45           HB1      MET  45  79.723   5.124   5.953
  326    HG2  MET  45           HG2      MET  45  81.775   4.451   4.390
  327    HG3  MET  45           HG1      MET  45  80.696   3.135   3.928
  328    HE1  MET  45           HE1      MET  45  77.593   4.777   2.516
  329    HE2  MET  45           HE2      MET  45  78.076   3.734   3.850
  330    HE3  MET  45           HE3      MET  45  78.705   3.420   2.231
  331    H    LEU  46           HN       LEU  46  79.553   2.376   8.157
  332    HA   LEU  46           HA       LEU  46  78.602   4.329  10.026
  333    HB2  LEU  46           HB2      LEU  46  77.655   1.961   9.405
  334    HB3  LEU  46           HB1      LEU  46  78.733   1.384  10.673
  335    HG   LEU  46           HG       LEU  46  77.621   3.364  12.081
  336   HD11  LEU  46          HD11      LEU  46  76.274   4.266  10.251
  337   HD12  LEU  46          HD12      LEU  46  75.216   3.599  11.493
  338   HD13  LEU  46          HD13      LEU  46  75.508   2.693  10.008
  339   HD21  LEU  46          HD21      LEU  46  76.141   0.777  11.505
  340   HD22  LEU  46          HD22      LEU  46  75.980   1.771  12.955
  341   HD23  LEU  46          HD23      LEU  46  77.499   0.940  12.619
  342    H    LYS  47           HN       LYS  47  80.863   1.619  10.606
  343    HA   LYS  47           HA       LYS  47  81.582   2.333  13.218
  344    HB2  LYS  47           HB2      LYS  47  83.427   1.099  11.171
  345    HB3  LYS  47           HB1      LYS  47  83.533   0.949  12.928
  346    HG2  LYS  47           HG2      LYS  47  81.360  -0.197  12.969
  347    HG3  LYS  47           HG1      LYS  47  81.236  -0.028  11.218
  348    HD2  LYS  47           HD2      LYS  47  83.250  -1.389  10.914
  349    HD3  LYS  47           HD1      LYS  47  83.445  -1.518  12.662
  350    HE2  LYS  47           HE2      LYS  47  80.923  -2.428  11.269
  351    HE3  LYS  47           HE1      LYS  47  82.307  -3.499  11.488
  352    HZ1  LYS  47           HZ1      LYS  47  81.564  -2.076  13.872
  353    HZ2  LYS  47           HZ2      LYS  47  81.876  -3.731  13.647
  354    HZ3  LYS  47           HZ3      LYS  47  80.338  -3.098  13.297
  355    H    LEU  48           HN       LEU  48  83.552   3.100  10.296
  356    HA   LEU  48           HA       LEU  48  85.478   4.687  11.493
  357    HB2  LEU  48           HB2      LEU  48  85.308   4.111   9.036
  358    HB3  LEU  48           HB1      LEU  48  84.133   5.411   8.876
  359    HG   LEU  48           HG       LEU  48  85.811   7.055   9.577
  360   HD11  LEU  48          HD11      LEU  48  88.281   6.034   9.610
  361   HD12  LEU  48          HD12      LEU  48  87.411   4.626  10.212
  362   HD13  LEU  48          HD13      LEU  48  87.298   6.151  11.073
  363   HD21  LEU  48          HD21      LEU  48  87.210   6.956   7.619
  364   HD22  LEU  48          HD22      LEU  48  85.641   6.275   7.188
  365   HD23  LEU  48          HD23      LEU  48  87.007   5.207   7.507
  366    H    VAL  49           HN       VAL  49  82.172   5.660  10.689
  367    HA   VAL  49           HA       VAL  49  82.512   8.435  11.477
  368    HB   VAL  49           HB       VAL  49  80.055   6.662  11.265
  369   HG11  VAL  49          HG11      VAL  49  80.337   9.573  12.006
  370   HG12  VAL  49          HG12      VAL  49  79.414   8.312  12.823
  371   HG13  VAL  49          HG13      VAL  49  78.855   8.953  11.278
  372   HG21  VAL  49          HG21      VAL  49  80.217   8.951   9.424
  373   HG22  VAL  49          HG22      VAL  49  79.990   7.248   9.054
  374   HG23  VAL  49          HG23      VAL  49  81.616   7.890   9.247
  375    H    GLU  50           HN       GLU  50  80.983   5.629  13.041
  376    HA   GLU  50           HA       GLU  50  80.285   6.643  15.509
  377    HB2  GLU  50           HB2      GLU  50  81.533   3.987  14.808
  378    HB3  GLU  50           HB1      GLU  50  80.905   4.337  16.410
  379    HG2  GLU  50           HG2      GLU  50  79.259   4.632  13.880
  380    HG3  GLU  50           HG1      GLU  50  79.271   3.168  14.866
  381    H    LYS  51           HN       LYS  51  83.528   5.434  14.639
  382    HA   LYS  51           HA       LYS  51  84.687   5.842  17.187
  383    HB2  LYS  51           HB2      LYS  51  86.047   6.009  14.502
  384    HB3  LYS  51           HB1      LYS  51  86.824   5.722  16.059
  385    HG2  LYS  51           HG2      LYS  51  85.232   3.729  16.324
  386    HG3  LYS  51           HG1      LYS  51  84.870   3.928  14.615
  387    HD2  LYS  51           HD2      LYS  51  87.494   3.184  15.915
  388    HD3  LYS  51           HD1      LYS  51  86.590   2.302  14.692
  389    HE2  LYS  51           HE2      LYS  51  88.336   3.246  13.454
  390    HE3  LYS  51           HE1      LYS  51  87.025   4.390  13.195
  391    HZ1  LYS  51           HZ1      LYS  51  88.384   5.071  15.555
  392    HZ2  LYS  51           HZ2      LYS  51  88.248   5.969  14.120
  393    HZ3  LYS  51           HZ3      LYS  51  89.526   4.871  14.323
  394    H    LEU  52           HN       LEU  52  84.998   8.010  14.321
  395    HA   LEU  52           HA       LEU  52  86.265  10.118  15.687
  396    HB2  LEU  52           HB2      LEU  52  85.572   9.708  13.117
  397    HB3  LEU  52           HB1      LEU  52  84.233  10.751  13.575
  398    HG   LEU  52           HG       LEU  52  85.897  12.400  14.448
  399   HD11  LEU  52          HD11      LEU  52  87.944  11.454  14.849
  400   HD12  LEU  52          HD12      LEU  52  88.258  11.917  13.180
  401   HD13  LEU  52          HD13      LEU  52  87.774  10.264  13.562
  402   HD21  LEU  52          HD21      LEU  52  86.080  11.611  11.526
  403   HD22  LEU  52          HD22      LEU  52  86.620  13.161  12.167
  404   HD23  LEU  52          HD23      LEU  52  84.915  12.723  12.242
  405    H    ASP  53           HN       ASP  53  82.851   9.554  15.064
  406    HA   ASP  53           HA       ASP  53  80.933  10.166  16.215
  407    HB2  ASP  53           HB2      ASP  53  82.497   9.364  18.108
  408    HB3  ASP  53           HB1      ASP  53  82.672  11.066  18.494
  409    H    VAL  54           HN       VAL  54  80.956  11.868  14.575
  410    HA   VAL  54           HA       VAL  54  80.461  14.435  15.767
  411    HB   VAL  54           HB       VAL  54  82.843  14.615  15.877
  412   HG11  VAL  54          HG11      VAL  54  84.249  14.254  13.871
  413   HG12  VAL  54          HG12      VAL  54  82.816  13.715  12.993
  414   HG13  VAL  54          HG13      VAL  54  83.403  12.789  14.379
  415   HG21  VAL  54          HG21      VAL  54  82.051  16.037  13.322
  416   HG22  VAL  54          HG22      VAL  54  83.242  16.554  14.515
  417   HG23  VAL  54          HG23      VAL  54  81.525  16.574  14.917
  418    H    LYS  55           HN       LYS  55  79.345  15.766  14.380
  419    HA   LYS  55           HA       LYS  55  78.219  14.552  12.012
  420    HB2  LYS  55           HB2      LYS  55  78.077  17.309  13.215
  421    HB3  LYS  55           HB1      LYS  55  77.238  16.883  11.730
  422    HG2  LYS  55           HG2      LYS  55  76.938  15.307  14.296
  423    HG3  LYS  55           HG1      LYS  55  75.901  16.656  13.882
  424    HD2  LYS  55           HD2      LYS  55  75.709  15.173  11.578
  425    HD3  LYS  55           HD1      LYS  55  75.937  13.908  12.750
  426    HE2  LYS  55           HE2      LYS  55  74.093  15.160  14.122
  427    HE3  LYS  55           HE1      LYS  55  73.692  15.890  12.570
  428    HZ1  LYS  55           HZ1      LYS  55  73.179  13.257  13.509
  429    HZ2  LYS  55           HZ2      LYS  55  74.026  13.231  12.038
  430    HZ3  LYS  55           HZ3      LYS  55  72.548  14.059  12.154
  431    H    LYS  56           HN       LYS  56  81.007  14.586  11.751
  432    HA   LYS  56           HA       LYS  56  81.893  16.928  10.274
  433    HB2  LYS  56           HB2      LYS  56  83.464  15.510  11.540
  434    HB3  LYS  56           HB1      LYS  56  83.100  14.150  10.480
  435    HG2  LYS  56           HG2      LYS  56  84.177  15.131   8.634
  436    HG3  LYS  56           HG1      LYS  56  84.095  16.753   9.323
  437    HD2  LYS  56           HD2      LYS  56  85.739  16.141  11.032
  438    HD3  LYS  56           HD1      LYS  56  85.772  14.482  10.435
  439    HE2  LYS  56           HE2      LYS  56  86.706  16.971   8.986
  440    HE3  LYS  56           HE1      LYS  56  87.686  15.600   9.501
  441    HZ1  LYS  56           HZ1      LYS  56  85.574  15.607   7.418
  442    HZ2  LYS  56           HZ2      LYS  56  86.321  14.198   8.004
  443    HZ3  LYS  56           HZ3      LYS  56  87.238  15.373   7.189
  444    H    ASP  57           HN       ASP  57  82.859  16.585   7.998
  445    HA   ASP  57           HA       ASP  57  80.837  16.153   6.125
  446    HB2  ASP  57           HB2      ASP  57  83.745  15.591   5.529
  447    HB3  ASP  57           HB1      ASP  57  82.520  16.262   4.454
  448    H    TRP  58           HN       TRP  58  79.712  14.210   6.570
  449    HA   TRP  58           HA       TRP  58  81.167  11.661   6.025
  450    HB2  TRP  58           HB2      TRP  58  78.696  12.357   7.601
  451    HB3  TRP  58           HB1      TRP  58  79.125  10.705   7.189
  452    HD1  TRP  58           HD1      TRP  58  79.523  13.057   9.890
  453    HE1  TRP  58           HE1      TRP  58  81.547  12.502  11.392
  454    HE3  TRP  58           HE3      TRP  58  81.956   9.690   6.898
  455    HZ2  TRP  58           HZ2      TRP  58  83.875  10.854  11.318
  456    HZ3  TRP  58           HZ3      TRP  58  84.070   8.648   7.653
  457    HH2  TRP  58           HH2      TRP  58  85.033   9.230   9.859
  458    H    SER  59           HN       SER  59  78.888  13.864   4.897
  459    HA   SER  59           HA       SER  59  77.009  12.276   3.514
  460    HB2  SER  59           HB2      SER  59  76.990  14.813   3.747
  461    HB3  SER  59           HB1      SER  59  78.185  14.860   2.460
  462    HG   SER  59           HG       SER  59  76.387  13.314   1.514
  463    H    ASP  60           HN       ASP  60  80.014  13.701   2.269
  464    HA   ASP  60           HA       ASP  60  79.902  12.012  -0.148
  465    HB2  ASP  60           HB2      ASP  60  80.531  14.466  -0.097
  466    HB3  ASP  60           HB1      ASP  60  82.011  13.974   0.727
  467    H    HIS  61           HN       HIS  61  80.740  11.231   2.823
  468    HA   HIS  61           HA       HIS  61  83.472  10.338   2.577
  469    HB2  HIS  61           HB2      HIS  61  82.836  10.523   4.809
  470    HB3  HIS  61           HB1      HIS  61  81.227   9.905   4.501
  471    HD1  HIS  61           HD1      HIS  61  84.697   8.363   4.042
  472    HD2  HIS  61           HD2      HIS  61  80.997   7.491   5.748
  473    HE1  HIS  61           HE1      HIS  61  84.874   6.024   4.999
  474    H    ALA  62           HN       ALA  62  84.283   8.493   1.785
  475    HA   ALA  62           HA       ALA  62  82.796   6.042   1.448
  476    HB1  ALA  62           HB1      ALA  62  83.131   7.914  -0.883
  477    HB2  ALA  62           HB2      ALA  62  81.737   6.925  -0.446
  478    HB3  ALA  62           HB3      ALA  62  83.163   6.171  -1.161
  479    H    LEU  63           HN       LEU  63  84.273   4.323   0.884
  480    HA   LEU  63           HA       LEU  63  87.135   5.131   1.131
  481    HB2  LEU  63           HB2      LEU  63  85.944   2.344   1.169
  482    HB3  LEU  63           HB1      LEU  63  87.568   2.803   1.649
  483    HG   LEU  63           HG       LEU  63  86.278   2.519   3.649
  484   HD11  LEU  63          HD11      LEU  63  86.307   5.502   3.266
  485   HD12  LEU  63          HD12      LEU  63  87.807   4.577   3.349
  486   HD13  LEU  63          HD13      LEU  63  86.692   4.574   4.714
  487   HD21  LEU  63          HD21      LEU  63  84.292   4.673   3.047
  488   HD22  LEU  63          HD22      LEU  63  84.106   3.196   3.984
  489   HD23  LEU  63          HD23      LEU  63  84.046   3.130   2.227
  490    H    TRP  64           HN       TRP  64  88.733   4.491  -0.349
  491    HA   TRP  64           HA       TRP  64  87.787   3.322  -2.949
  492    HB2  TRP  64           HB2      TRP  64  88.255   5.268  -4.027
  493    HB3  TRP  64           HB1      TRP  64  88.626   6.012  -2.497
  494    HD1  TRP  64           HD1      TRP  64  90.674   3.500  -4.663
  495    HE1  TRP  64           HE1      TRP  64  93.023   4.491  -4.990
  496    HE3  TRP  64           HE3      TRP  64  90.115   7.967  -2.254
  497    HZ2  TRP  64           HZ2      TRP  64  94.461   6.871  -4.390
  498    HZ3  TRP  64           HZ3      TRP  64  91.987   9.586  -2.167
  499    HH2  TRP  64           HH2      TRP  64  94.159   9.044  -3.231
  500    H    TRP  65           HN       TRP  65  89.122   1.796  -3.792
  501    HA   TRP  65           HA       TRP  65  91.451   0.967  -2.147
  502    HB2  TRP  65           HB2      TRP  65  89.480  -0.566  -2.818
  503    HB3  TRP  65           HB1      TRP  65  90.189  -0.565  -4.424
  504    HD1  TRP  65           HD1      TRP  65  93.125  -0.430  -2.360
  505    HE1  TRP  65           HE1      TRP  65  94.082  -2.766  -1.893
  506    HE3  TRP  65           HE3      TRP  65  89.110  -3.313  -3.660
  507    HZ2  TRP  65           HZ2      TRP  65  93.263  -5.498  -2.034
  508    HZ3  TRP  65           HZ3      TRP  65  89.233  -5.780  -3.488
  509    HH2  TRP  65           HH2      TRP  65  91.302  -6.878  -2.673
  510    H    GLU  66           HN       GLU  66  93.061   2.451  -3.001
  511    HA   GLU  66           HA       GLU  66  93.438   3.002  -5.752
  512    HB2  GLU  66           HB2      GLU  66  95.842   3.502  -5.109
  513    HB3  GLU  66           HB1      GLU  66  94.611   4.374  -4.202
  514    HG2  GLU  66           HG2      GLU  66  94.745   2.668  -2.426
  515    HG3  GLU  66           HG1      GLU  66  96.039   1.878  -3.318
  516    H    LYS  67           HN       LYS  67  94.207   0.082  -4.004
  517    HA   LYS  67           HA       LYS  67  96.227  -0.865  -5.814
  518    HB2  LYS  67           HB2      LYS  67  94.147  -2.395  -4.271
  519    HB3  LYS  67           HB1      LYS  67  95.403  -3.155  -5.213
  520    HG2  LYS  67           HG2      LYS  67  95.733  -2.760  -2.624
  521    HG3  LYS  67           HG1      LYS  67  97.071  -2.613  -3.721
  522    HD2  LYS  67           HD2      LYS  67  96.862  -0.194  -3.724
  523    HD3  LYS  67           HD1      LYS  67  95.410  -0.291  -2.725
  524    HE2  LYS  67           HE2      LYS  67  97.250   0.214  -1.262
  525    HE3  LYS  67           HE1      LYS  67  96.804  -1.470  -0.983
  526    HZ1  LYS  67           HZ1      LYS  67  99.197  -1.208  -1.199
  527    HZ2  LYS  67           HZ2      LYS  67  99.003  -0.535  -2.747
  528    HZ3  LYS  67           HZ3      LYS  67  98.579  -2.155  -2.463
  529    H    LYS  68           HN       LYS  68  92.994  -0.085  -6.024
  530    HA   LYS  68           HA       LYS  68  92.632  -1.419  -8.670
  531    HB2  LYS  68           HB2      LYS  68  90.290  -0.872  -6.857
  532    HB3  LYS  68           HB1      LYS  68  90.457  -2.084  -8.123
  533    HG2  LYS  68           HG2      LYS  68  92.077  -2.216  -5.559
  534    HG3  LYS  68           HG1      LYS  68  90.480  -2.919  -5.703
  535    HD2  LYS  68           HD2      LYS  68  91.162  -4.400  -7.446
  536    HD3  LYS  68           HD1      LYS  68  92.691  -3.547  -7.657
  537    HE2  LYS  68           HE2      LYS  68  93.633  -4.495  -5.763
  538    HE3  LYS  68           HE1      LYS  68  92.087  -4.699  -4.951
  539    HZ1  LYS  68           HZ1      LYS  68  93.000  -6.813  -5.677
  540    HZ2  LYS  68           HZ2      LYS  68  93.036  -6.270  -7.286
  541    HZ3  LYS  68           HZ3      LYS  68  91.550  -6.476  -6.488
  542    H    ARG  69           HN       ARG  69  92.594   1.463  -6.822
  543    HA   ARG  69           HA       ARG  69  91.885   3.656  -7.316
  544    HB2  ARG  69           HB2      ARG  69  92.226   2.523 -10.116
  545    HB3  ARG  69           HB1      ARG  69  91.784   4.195  -9.811
  546    HG2  ARG  69           HG2      ARG  69  94.098   4.393  -9.976
  547    HG3  ARG  69           HG1      ARG  69  93.924   4.166  -8.239
  548    HD2  ARG  69           HD2      ARG  69  95.612   2.632  -8.822
  549    HD3  ARG  69           HD1      ARG  69  94.163   1.633  -8.775
  550    HE   ARG  69           HE       ARG  69  94.663   2.726 -11.422
  551   HH11  ARG  69          HH11      ARG  69  95.276   1.231 -13.003
  552   HH12  ARG  69          HH12      ARG  69  95.818  -0.343 -12.523
  553   HH21  ARG  69          HH21      ARG  69  95.436   0.270  -9.130
  554   HH22  ARG  69          HH22      ARG  69  95.909  -0.887 -10.329
  555    H    THR  70           HN       THR  70  89.938   1.906  -6.519
  556    HA   THR  70           HA       THR  70  87.627   2.455  -8.363
  557    HB   THR  70           HB       THR  70  88.305   0.061  -7.732
  558    HG1  THR  70           HG1      THR  70  85.703   0.538  -6.891
  559   HG21  THR  70          HG21      THR  70  88.521   0.850  -5.224
  560   HG22  THR  70          HG22      THR  70  87.939  -0.772  -5.599
  561   HG23  THR  70          HG23      THR  70  86.792   0.505  -5.195
  562    H    TRP  71           HN       TRP  71  85.559   2.261  -6.842
  563    HA   TRP  71           HA       TRP  71  85.911   4.038  -4.477
  564    HB2  TRP  71           HB2      TRP  71  83.423   4.712  -5.289
  565    HB3  TRP  71           HB1      TRP  71  84.846   5.586  -5.827
  566    HD1  TRP  71           HD1      TRP  71  82.887   2.449  -7.012
  567    HE1  TRP  71           HE1      TRP  71  82.844   2.451  -9.542
  568    HE3  TRP  71           HE3      TRP  71  85.613   6.666  -7.912
  569    HZ2  TRP  71           HZ2      TRP  71  83.821   4.034 -11.728
  570    HZ3  TRP  71           HZ3      TRP  71  86.039   7.399 -10.241
  571    HH2  TRP  71           HH2      TRP  71  85.147   6.090 -12.148
  572    H    LEU  72           HN       LEU  72  85.682   2.487  -2.947
  573    HA   LEU  72           HA       LEU  72  84.163   0.131  -3.292
  574    HB2  LEU  72           HB2      LEU  72  84.959   1.503  -0.724
  575    HB3  LEU  72           HB1      LEU  72  84.485  -0.185  -0.877
  576    HG   LEU  72           HG       LEU  72  86.753   1.002  -2.484
  577   HD11  LEU  72          HD11      LEU  72  87.484   1.337  -0.270
  578   HD12  LEU  72          HD12      LEU  72  88.219  -0.188  -0.766
  579   HD13  LEU  72          HD13      LEU  72  86.794  -0.193   0.276
  580   HD21  LEU  72          HD21      LEU  72  86.180  -1.038  -3.472
  581   HD22  LEU  72          HD22      LEU  72  85.726  -1.778  -1.935
  582   HD23  LEU  72          HD23      LEU  72  87.425  -1.537  -2.329
  583    H    LEU  73           HN       LEU  73  82.191   0.752  -4.124
  584    HA   LEU  73           HA       LEU  73  80.215   1.792  -2.120
  585    HB2  LEU  73           HB2      LEU  73  78.909   2.702  -4.046
  586    HB3  LEU  73           HB1      LEU  73  80.472   3.482  -3.848
  587    HG   LEU  73           HG       LEU  73  81.257   1.605  -5.588
  588   HD11  LEU  73          HD11      LEU  73  79.428   1.352  -7.336
  589   HD12  LEU  73          HD12      LEU  73  78.281   1.876  -6.103
  590   HD13  LEU  73          HD13      LEU  73  79.200   0.393  -5.880
  591   HD21  LEU  73          HD21      LEU  73  79.705   4.110  -6.306
  592   HD22  LEU  73          HD22      LEU  73  80.727   3.221  -7.434
  593   HD23  LEU  73          HD23      LEU  73  81.436   3.989  -6.022
  594    H    LYS  74           HN       LYS  74  81.241  -0.943  -3.382
  595    HA   LYS  74           HA       LYS  74  78.730  -2.023  -4.440
  596    HB2  LYS  74           HB2      LYS  74  81.516  -2.813  -4.401
  597    HB3  LYS  74           HB1      LYS  74  80.547  -4.141  -3.813
  598    HG2  LYS  74           HG2      LYS  74  80.803  -4.328  -6.240
  599    HG3  LYS  74           HG1      LYS  74  79.123  -4.042  -5.819
  600    HD2  LYS  74           HD2      LYS  74  80.076  -2.731  -7.812
  601    HD3  LYS  74           HD1      LYS  74  79.181  -1.812  -6.617
  602    HE2  LYS  74           HE2      LYS  74  81.155  -0.879  -5.700
  603    HE3  LYS  74           HE1      LYS  74  82.169  -2.104  -6.448
  604    HZ1  LYS  74           HZ1      LYS  74  82.169   0.139  -7.542
  605    HZ2  LYS  74           HZ2      LYS  74  80.572  -0.181  -8.026
  606    HZ3  LYS  74           HZ3      LYS  74  81.840  -1.175  -8.563
  607    H    THR  75           HN       THR  75  77.379  -1.577  -2.570
  608    HA   THR  75           HA       THR  75  77.996  -2.792  -0.007
  609    HB   THR  75           HB       THR  75  75.155  -2.137  -0.451
  610    HG1  THR  75           HG1      THR  75  75.397  -0.398  -1.549
  611   HG21  THR  75          HG21      THR  75  77.105  -0.562   1.225
  612   HG22  THR  75          HG22      THR  75  76.590  -2.171   1.736
  613   HG23  THR  75          HG23      THR  75  75.398  -0.892   1.522
  614    H    HIS  76           HN       HIS  76  76.758  -4.041  -2.930
  615    HA   HIS  76           HA       HIS  76  75.185  -6.167  -1.591
  616    HB2  HIS  76           HB2      HIS  76  75.093  -6.929  -4.170
  617    HB3  HIS  76           HB1      HIS  76  74.049  -5.661  -3.539
  618    HD1  HIS  76           HD1      HIS  76  76.294  -6.278  -6.241
  619    HD2  HIS  76           HD2      HIS  76  75.465  -2.957  -3.862
  620    HE1  HIS  76           HE1      HIS  76  77.107  -4.254  -7.527
  621    H    TRP  77           HN       TRP  77  77.849  -6.191  -0.838
  622    HA   TRP  77           HA       TRP  77  78.586  -8.895  -1.359
  623    HB2  TRP  77           HB2      TRP  77  79.903  -6.752  -3.003
  624    HB3  TRP  77           HB1      TRP  77  80.922  -8.047  -2.398
  625    HD1  TRP  77           HD1      TRP  77  79.202 -10.580  -2.761
  626    HE1  TRP  77           HE1      TRP  77  78.458 -11.387  -5.085
  627    HE3  TRP  77           HE3      TRP  77  79.680  -6.239  -5.402
  628    HZ2  TRP  77           HZ2      TRP  77  78.113 -10.341  -7.721
  629    HZ3  TRP  77           HZ3      TRP  77  79.140  -6.172  -7.820
  630    HH2  TRP  77           HH2      TRP  77  78.359  -8.218  -8.983
  631    H    THR  78           HN       THR  78  81.274  -8.853  -0.615
  632    HA   THR  78           HA       THR  78  81.424  -7.034   1.736
  633    HB   THR  78           HB       THR  78  82.353  -9.745   2.394
  634    HG1  THR  78           HG1      THR  78  79.820  -9.399   1.257
  635   HG21  THR  78          HG21      THR  78  80.429  -9.419   4.135
  636   HG22  THR  78          HG22      THR  78  80.401  -7.759   3.560
  637   HG23  THR  78          HG23      THR  78  81.883  -8.430   4.255
  638    H    LEU  79           HN       LEU  79  83.681  -7.952   2.865
  639    HA   LEU  79           HA       LEU  79  85.776  -6.969   1.166
  640    HB2  LEU  79           HB2      LEU  79  85.771  -8.534   3.743
  641    HB3  LEU  79           HB1      LEU  79  87.266  -8.031   2.975
  642    HG   LEU  79           HG       LEU  79  86.704  -5.701   3.238
  643   HD11  LEU  79          HD11      LEU  79  84.020  -6.752   4.147
  644   HD12  LEU  79          HD12      LEU  79  84.345  -5.685   2.777
  645   HD13  LEU  79          HD13      LEU  79  84.544  -5.094   4.425
  646   HD21  LEU  79          HD21      LEU  79  86.279  -5.639   5.775
  647   HD22  LEU  79          HD22      LEU  79  87.668  -6.583   5.236
  648   HD23  LEU  79          HD23      LEU  79  86.173  -7.400   5.694
  649    H    ASP  80           HN       ASP  80  85.224 -10.178   2.561
  650    HA   ASP  80           HA       ASP  80  87.065 -11.723   1.177
  651    HB2  ASP  80           HB2      ASP  80  85.483 -12.544   2.892
  652    HB3  ASP  80           HB1      ASP  80  84.171 -12.430   1.717
  653    H    LYS  81           HN       LYS  81  83.751 -11.027   0.135
  654    HA   LYS  81           HA       LYS  81  83.664 -12.320  -2.288
  655    HB2  LYS  81           HB2      LYS  81  82.678  -9.487  -2.102
  656    HB3  LYS  81           HB1      LYS  81  81.945 -10.851  -2.936
  657    HG2  LYS  81           HG2      LYS  81  82.103 -10.392   0.045
  658    HG3  LYS  81           HG1      LYS  81  80.655 -10.436  -0.954
  659    HD2  LYS  81           HD2      LYS  81  81.210 -12.826  -1.514
  660    HD3  LYS  81           HD1      LYS  81  82.488 -12.751  -0.305
  661    HE2  LYS  81           HE2      LYS  81  80.974 -12.490   1.473
  662    HE3  LYS  81           HE1      LYS  81  79.663 -11.979   0.410
  663    HZ1  LYS  81           HZ1      LYS  81  79.029 -14.105   0.596
  664    HZ2  LYS  81           HZ2      LYS  81  80.563 -14.641   1.093
  665    HZ3  LYS  81           HZ3      LYS  81  80.234 -14.410  -0.558
  666    H    TYR  82           HN       TYR  82  84.768  -8.967  -1.856
  667    HA   TYR  82           HA       TYR  82  85.796  -8.810  -4.556
  668    HB2  TYR  82           HB2      TYR  82  85.163  -6.966  -2.637
  669    HB3  TYR  82           HB1      TYR  82  86.912  -6.964  -2.499
  670    HD1  TYR  82           HD1      TYR  82  84.435  -5.151  -3.922
  671    HD2  TYR  82           HD2      TYR  82  87.952  -7.299  -5.138
  672    HE1  TYR  82           HE1      TYR  82  84.594  -3.741  -5.953
  673    HE2  TYR  82           HE2      TYR  82  88.110  -5.888  -7.169
  674    HH   TYR  82           HH       TYR  82  87.379  -3.786  -8.008
  675    H    GLY  83           HN       GLY  83  87.282  -9.416  -1.375
  676    HA2  GLY  83           HA2      GLY  83  89.132 -11.136  -1.400
  677    HA3  GLY  83           HA1      GLY  83  89.794 -10.280  -2.794
  678    H    ILE  84           HN       ILE  84  88.377  -8.196  -0.547
  679    HA   ILE  84           HA       ILE  84  90.905  -6.952   0.089
  680    HB   ILE  84           HB       ILE  84  88.144  -6.557   1.280
  681   HG12  ILE  84          HG12      ILE  84  89.508  -4.727  -0.699
  682   HG13  ILE  84          HG11      ILE  84  88.655  -6.155  -1.267
  683   HG21  ILE  84          HG21      ILE  84  90.689  -4.914   1.439
  684   HG22  ILE  84          HG22      ILE  84  89.803  -5.640   2.780
  685   HG23  ILE  84          HG23      ILE  84  89.101  -4.298   1.888
  686   HD11  ILE  84          HD11      ILE  84  87.302  -3.967  -1.121
  687   HD12  ILE  84          HD12      ILE  84  87.351  -4.204   0.626
  688   HD13  ILE  84          HD13      ILE  84  86.578  -5.409  -0.407
  689    H    GLN  85           HN       GLN  85  91.688  -6.651   2.309
  690    HA   GLN  85           HA       GLN  85  90.817  -8.327   4.475
  691    HB2  GLN  85           HB2      GLN  85  92.124  -9.829   2.646
  692    HB3  GLN  85           HB1      GLN  85  93.521  -9.207   3.515
  693    HG2  GLN  85           HG2      GLN  85  93.087 -11.106   4.789
  694    HG3  GLN  85           HG1      GLN  85  92.093  -9.936   5.653
  695   HE21  GLN  85          HE21      GLN  85  89.921  -9.707   3.868
  696   HE22  GLN  85          HE22      GLN  85  89.108 -11.186   3.794
  697    H    ALA  86           HN       ALA  86  93.224  -8.552   5.864
  698    HA   ALA  86           HA       ALA  86  93.652  -5.824   6.702
  699    HB1  ALA  86           HB1      ALA  86  93.876  -7.497   8.375
  700    HB2  ALA  86           HB2      ALA  86  95.524  -6.945   8.070
  701    HB3  ALA  86           HB3      ALA  86  94.956  -8.460   7.364
  702    H    ASP  87           HN       ASP  87  95.191  -7.888   4.374
  703    HA   ASP  87           HA       ASP  87  97.699  -6.386   4.343
  704    HB2  ASP  87           HB2      ASP  87  98.089  -7.725   2.232
  705    HB3  ASP  87           HB1      ASP  87  97.784  -8.699   3.672
  706    H    ALA  88           HN       ALA  88  94.585  -5.885   3.213
  707    HA   ALA  88           HA       ALA  88  95.426  -4.183   0.910
  708    HB1  ALA  88           HB1      ALA  88  92.885  -5.450   1.855
  709    HB2  ALA  88           HB2      ALA  88  93.620  -5.515   0.260
  710    HB3  ALA  88           HB3      ALA  88  92.788  -4.051   0.786
  711    H    LYS  89           HN       LYS  89  95.932  -2.109   1.567
  712    HA   LYS  89           HA       LYS  89  94.540  -0.976   3.933
  713    HB2  LYS  89           HB2      LYS  89  96.648   0.465   2.334
  714    HB3  LYS  89           HB1      LYS  89  96.213   0.668   4.029
  715    HG2  LYS  89           HG2      LYS  89  97.438  -1.879   2.941
  716    HG3  LYS  89           HG1      LYS  89  98.386  -0.553   3.583
  717    HD2  LYS  89           HD2      LYS  89  97.629  -0.857   5.771
  718    HD3  LYS  89           HD1      LYS  89  96.163  -1.680   5.258
  719    HE2  LYS  89           HE2      LYS  89  97.715  -3.291   6.233
  720    HE3  LYS  89           HE1      LYS  89  97.499  -3.603   4.510
  721    HZ1  LYS  89           HZ1      LYS  89  99.597  -1.753   4.907
  722    HZ2  LYS  89           HZ2      LYS  89  99.651  -3.285   4.173
  723    HZ3  LYS  89           HZ3      LYS  89  99.879  -3.135   5.850
  724    H    LEU  90           HN       LEU  90  92.732   0.035   3.620
  725    HA   LEU  90           HA       LEU  90  92.087   1.278   1.015
  726    HB2  LEU  90           HB2      LEU  90  90.305   1.296   3.443
  727    HB3  LEU  90           HB1      LEU  90  89.850   1.343   1.740
  728    HG   LEU  90           HG       LEU  90  91.040  -0.994   3.235
  729   HD11  LEU  90          HD11      LEU  90  88.326  -0.408   2.042
  730   HD12  LEU  90          HD12      LEU  90  88.708  -0.829   3.711
  731   HD13  LEU  90          HD13      LEU  90  88.845  -2.044   2.441
  732   HD21  LEU  90          HD21      LEU  90  91.984  -1.104   1.054
  733   HD22  LEU  90          HD22      LEU  90  90.491  -0.545   0.294
  734   HD23  LEU  90          HD23      LEU  90  90.579  -2.167   0.987
  735    H    GLN  91           HN       GLN  91  90.858   3.494   1.355
  736    HA   GLN  91           HA       GLN  91  92.223   5.152   3.421
  737    HB2  GLN  91           HB2      GLN  91  92.010   6.313   0.665
  738    HB3  GLN  91           HB1      GLN  91  93.157   6.684   1.940
  739    HG2  GLN  91           HG2      GLN  91  94.482   4.762   1.453
  740    HG3  GLN  91           HG1      GLN  91  93.221   4.037   0.495
  741   HE21  GLN  91          HE21      GLN  91  92.463   6.308  -1.036
  742   HE22  GLN  91          HE22      GLN  91  93.753   6.727  -2.029
  743    H    PHE  92           HN       PHE  92  91.007   7.015   3.989
  744    HA   PHE  92           HA       PHE  92  88.159   6.883   3.139
  745    HB2  PHE  92           HB2      PHE  92  88.124   6.962   5.466
  746    HB3  PHE  92           HB1      PHE  92  89.612   7.875   5.567
  747    HD1  PHE  92           HD1      PHE  92  89.526  10.367   4.720
  748    HD2  PHE  92           HD2      PHE  92  86.058   8.068   5.756
  749    HE1  PHE  92           HE1      PHE  92  88.235  12.457   5.012
  750    HE2  PHE  92           HE2      PHE  92  84.765  10.162   6.046
  751    HZ   PHE  92           HZ       PHE  92  85.850  12.355   5.674
  752    H    THR  93           HN       THR  93  87.154   8.631   2.113
  753    HA   THR  93           HA       THR  93  88.634  11.145   1.751
  754    HB   THR  93           HB       THR  93  89.496   9.593  -0.047
  755    HG1  THR  93           HG1      THR  93  89.712  11.365  -1.117
  756   HG21  THR  93          HG21      THR  93  86.719   9.895  -1.219
  757   HG22  THR  93          HG22      THR  93  87.241   8.456  -0.345
  758   HG23  THR  93          HG23      THR  93  88.049   8.920  -1.838
  759    HA   PRO  94           HA       PRO  94  84.317  12.376   1.627
  760    HB2  PRO  94           HB2      PRO  94  84.555  15.011   1.083
  761    HB3  PRO  94           HB1      PRO  94  85.124  14.335   2.624
  762    HG2  PRO  94           HG2      PRO  94  86.699  15.012   0.171
  763    HG3  PRO  94           HG1      PRO  94  87.061  15.372   1.870
  764    HD2  PRO  94           HD2      PRO  94  88.175  13.243   0.531
  765    HD3  PRO  94           HD1      PRO  94  87.886  13.244   2.288
  766    H    TYR 541           HT1      TYR 541  48.821  40.720  10.531
  767    HA   TYR 541           HA       TYR 541  50.591  38.887   9.272
  768    HB2  TYR 541           HB2      TYR 541  50.957  40.966  11.453
  769    HB3  TYR 541           HB1      TYR 541  52.250  40.240  10.498
  770    HD1  TYR 541           HD1      TYR 541  49.635  42.756  10.587
  771    HD2  TYR 541           HD2      TYR 541  52.301  40.597   8.003
  772    HE1  TYR 541           HE1      TYR 541  49.273  44.442   8.805
  773    HE2  TYR 541           HE2      TYR 541  51.940  42.283   6.221
  774    HH   TYR 541           HH       TYR 541  49.908  43.985   5.687
  775    H    HIS 542           HN       HIS 542  48.671  37.640  11.212
  776    HA   HIS 542           HA       HIS 542  50.078  36.966  13.619
  777    HB2  HIS 542           HB2      HIS 542  47.942  35.376  12.172
  778    HB3  HIS 542           HB1      HIS 542  48.380  35.247  13.870
  779    HD1  HIS 542           HD1      HIS 542  45.882  36.731  11.862
  780    HD2  HIS 542           HD2      HIS 542  48.120  38.096  15.103
  781    HE1  HIS 542           HE1      HIS 542  44.616  38.700  12.827
  782    H    GLU 543           HN       GLU 543  49.506  33.990  13.102
  783    HA   GLU 543           HA       GLU 543  52.176  33.176  12.562
  784    HB2  GLU 543           HB2      GLU 543  51.083  30.900  12.136
  785    HB3  GLU 543           HB1      GLU 543  50.752  31.636  13.705
  786    HG2  GLU 543           HG2      GLU 543  48.582  32.362  13.015
  787    HG3  GLU 543           HG1      GLU 543  48.927  32.006  11.322
  788    H    ARG 544           HN       ARG 544  50.024  34.544  10.439
  789    HA   ARG 544           HA       ARG 544  50.130  33.043   8.079
  790    HB2  ARG 544           HB2      ARG 544  50.518  36.046   8.180
  791    HB3  ARG 544           HB1      ARG 544  49.790  35.102   6.881
  792    HG2  ARG 544           HG2      ARG 544  48.664  35.354   9.688
  793    HG3  ARG 544           HG1      ARG 544  48.074  36.225   8.278
  794    HD2  ARG 544           HD2      ARG 544  47.796  33.881   7.198
  795    HD3  ARG 544           HD1      ARG 544  47.934  33.269   8.847
  796    HE   ARG 544           HE       ARG 544  46.005  35.244   9.043
  797   HH11  ARG 544          HH11      ARG 544  43.802  34.827   8.762
  798   HH12  ARG 544          HH12      ARG 544  43.306  33.474   7.802
  799   HH21  ARG 544          HH21      ARG 544  46.542  32.470   7.066
  800   HH22  ARG 544          HH22      ARG 544  44.856  32.140   6.842
  801    H    ARG 545           HN       ARG 545  52.756  34.371   9.819
  802    HA   ARG 545           HA       ARG 545  54.565  34.902   7.663
  803    HB2  ARG 545           HB2      ARG 545  55.137  34.015  10.503
  804    HB3  ARG 545           HB1      ARG 545  56.291  34.762   9.406
  805    HG2  ARG 545           HG2      ARG 545  55.346  36.871   9.602
  806    HG3  ARG 545           HG1      ARG 545  53.726  36.231   9.866
  807    HD2  ARG 545           HD2      ARG 545  54.611  37.277  11.913
  808    HD3  ARG 545           HD1      ARG 545  54.339  35.546  12.136
  809    HE   ARG 545           HE       ARG 545  56.988  35.681  11.367
  810   HH11  ARG 545          HH11      ARG 545  58.684  35.922  12.842
  811   HH12  ARG 545          HH12      ARG 545  58.381  36.673  14.373
  812   HH21  ARG 545          HH21      ARG 545  55.015  37.213  13.743
  813   HH22  ARG 545          HH22      ARG 545  56.304  37.404  14.883
  814    H    GLY 546           HN       GLY 546  55.149  32.296   9.983
  815    HA2  GLY 546           HA2      GLY 546  55.231  30.291   7.795
  816    HA3  GLY 546           HA1      GLY 546  56.753  30.617   8.625
  817    H    SER 547           HN       SER 547  57.165  29.452  10.442
  818    HA   SER 547           HA       SER 547  55.082  28.588  12.274
  819    HB2  SER 547           HB2      SER 547  56.142  26.724  10.185
  820    HB3  SER 547           HB1      SER 547  55.887  26.074  11.802
  821    HG   SER 547           HG       SER 547  53.978  25.852  10.707
  822    H    LEU 548           HN       LEU 548  56.185  28.810  14.183
  823    HA   LEU 548           HA       LEU 548  58.992  29.044  14.330
  824    HB2  LEU 548           HB2      LEU 548  56.759  28.838  16.257
  825    HB3  LEU 548           HB1      LEU 548  58.307  28.304  16.898
  826    HG   LEU 548           HG       LEU 548  59.287  30.499  16.033
  827   HD11  LEU 548          HD11      LEU 548  57.469  32.318  15.809
  828   HD12  LEU 548          HD12      LEU 548  56.360  30.982  15.511
  829   HD13  LEU 548          HD13      LEU 548  57.731  31.247  14.440
  830   HD21  LEU 548          HD21      LEU 548  58.491  30.013  18.429
  831   HD22  LEU 548          HD22      LEU 548  57.068  30.964  18.011
  832   HD23  LEU 548          HD23      LEU 548  58.671  31.702  17.958
  833    H    CYS 549           HN       CYS 549  60.645  27.620  14.610
  834    HA   CYS 549           HA       CYS 549  60.013  24.751  14.370
  835    HB2  CYS 549           HB2      CYS 549  61.907  25.365  13.094
  836    HB3  CYS 549           HB1      CYS 549  62.499  26.460  14.328
  837    H    SER 550           HN       SER 550  59.233  24.017  16.283
  838    HA   SER 550           HA       SER 550  59.720  25.031  18.829
  839    HB2  SER 550           HB2      SER 550  57.948  23.495  18.597
  840    HB3  SER 550           HB1      SER 550  59.003  22.219  17.999
  841    HG   SER 550           HG       SER 550  58.924  21.706  20.070
  842    H    GLY 551           HN       GLY 551  61.352  25.083  20.109
  843    HA2  GLY 551           HA2      GLY 551  63.273  23.983  21.241
  844    HA3  GLY 551           HA1      GLY 551  63.666  23.221  19.693
  845    H    CYS 552           HN       CYS 552  62.988  25.498  18.127
  846    HA   CYS 552           HA       CYS 552  65.349  27.253  18.655
  847    HB2  CYS 552           HB2      CYS 552  63.825  26.364  16.217
  848    HB3  CYS 552           HB1      CYS 552  64.722  27.872  16.172
  849    H    GLN 553           HN       GLN 553  61.924  27.078  17.929
  850    HA   GLN 553           HA       GLN 553  60.245  28.623  17.996
  851    HB2  GLN 553           HB2      GLN 553  62.013  29.803  20.119
  852    HB3  GLN 553           HB1      GLN 553  60.357  30.324  19.801
  853    HG2  GLN 553           HG2      GLN 553  61.130  27.468  20.399
  854    HG3  GLN 553           HG1      GLN 553  60.546  28.587  21.613
  855   HE21  GLN 553          HE21      GLN 553  59.632  26.868  18.655
  856   HE22  GLN 553          HE22      GLN 553  57.955  26.970  18.897
  857    H    LYS 554           HN       LYS 554  61.473  28.937  15.898
  858    HA   LYS 554           HA       LYS 554  61.592  31.859  15.421
  859    HB2  LYS 554           HB2      LYS 554  63.605  29.880  14.325
  860    HB3  LYS 554           HB1      LYS 554  63.508  31.572  13.865
  861    HG2  LYS 554           HG2      LYS 554  63.968  30.616  16.700
  862    HG3  LYS 554           HG1      LYS 554  65.263  31.079  15.603
  863    HD2  LYS 554           HD2      LYS 554  63.901  33.310  15.349
  864    HD3  LYS 554           HD1      LYS 554  63.130  32.803  16.849
  865    HE2  LYS 554           HE2      LYS 554  66.015  33.495  16.359
  866    HE3  LYS 554           HE1      LYS 554  64.934  34.086  17.620
  867    HZ1  LYS 554           HZ1      LYS 554  64.910  31.804  18.532
  868    HZ2  LYS 554           HZ2      LYS 554  66.446  32.529  18.576
  869    HZ3  LYS 554           HZ3      LYS 554  66.088  31.361  17.395
  870    HA   PRO 555           HA       PRO 555  58.471  30.339  12.493
  871    HB2  PRO 555           HB2      PRO 555  59.411  32.587  10.802
  872    HB3  PRO 555           HB1      PRO 555  57.772  32.174  11.314
  873    HG2  PRO 555           HG2      PRO 555  59.233  34.224  12.424
  874    HG3  PRO 555           HG1      PRO 555  57.953  33.364  13.286
  875    HD2  PRO 555           HD2      PRO 555  60.864  33.280  13.761
  876    HD3  PRO 555           HD1      PRO 555  59.548  32.687  14.803
  877    H    ILE 556           HN       ILE 556  58.542  28.863  10.975
  878    HA   ILE 556           HA       ILE 556  61.061  28.319   9.510
  879    HB   ILE 556           HB       ILE 556  58.470  26.775   9.893
  880   HG12  ILE 556          HG12      ILE 556  61.220  25.893  10.771
  881   HG13  ILE 556          HG11      ILE 556  60.343  27.039  11.763
  882   HG21  ILE 556          HG21      ILE 556  59.831  24.911   8.827
  883   HG22  ILE 556          HG22      ILE 556  60.942  26.161   8.273
  884   HG23  ILE 556          HG23      ILE 556  59.262  26.172   7.736
  885   HD11  ILE 556          HD11      ILE 556  58.780  25.483  12.419
  886   HD12  ILE 556          HD12      ILE 556  60.084  24.361  12.054
  887   HD13  ILE 556          HD13      ILE 556  58.806  24.634  10.874
  888    H    THR 557           HN       THR 557  61.050  29.791   7.782
  889    HA   THR 557           HA       THR 557  58.561  30.049   6.162
  890    HB   THR 557           HB       THR 557  59.669  32.007   5.189
  891    HG1  THR 557           HG1      THR 557  61.716  32.545   5.814
  892   HG21  THR 557          HG21      THR 557  59.696  31.753   8.206
  893   HG22  THR 557          HG22      THR 557  58.408  32.396   7.189
  894   HG23  THR 557          HG23      THR 557  59.917  33.291   7.369
  895    H    GLY 558           HN       GLY 558  58.629  28.125   5.008
  896    HA2  GLY 558           HA2      GLY 558  59.560  27.982   2.467
  897    HA3  GLY 558           HA1      GLY 558  60.958  27.397   3.382
  898    H    ARG 559           HN       ARG 559  60.859  25.408   4.351
  899    HA   ARG 559           HA       ARG 559  58.422  23.746   3.872
  900    HB2  ARG 559           HB2      ARG 559  61.378  23.198   3.769
  901    HB3  ARG 559           HB1      ARG 559  60.322  21.886   4.292
  902    HG2  ARG 559           HG2      ARG 559  59.654  23.434   1.799
  903    HG3  ARG 559           HG1      ARG 559  60.884  22.181   1.731
  904    HD2  ARG 559           HD2      ARG 559  59.290  20.548   2.658
  905    HD3  ARG 559           HD1      ARG 559  58.040  21.781   2.737
  906    HE   ARG 559           HE       ARG 559  58.770  20.188   0.446
  907   HH11  ARG 559          HH11      ARG 559  58.255  20.761  -1.654
  908   HH12  ARG 559          HH12      ARG 559  57.724  22.373  -1.997
  909   HH21  ARG 559          HH21      ARG 559  57.937  23.435   1.291
  910   HH22  ARG 559          HH22      ARG 559  57.545  23.881  -0.335
  911    H    CYS 560           HN       CYS 560  57.809  22.354   5.669
  912    HA   CYS 560           HA       CYS 560  59.234  22.841   8.219
  913    HB2  CYS 560           HB2      CYS 560  57.119  23.382   9.392
  914    HB3  CYS 560           HB1      CYS 560  57.586  24.613   8.213
  915    HG   CYS 560           HG       CYS 560  55.409  22.448   7.573
  916    H    ILE 561           HN       ILE 561  59.484  21.072   9.294
  917    HA   ILE 561           HA       ILE 561  57.898  18.675   8.612
  918    HB   ILE 561           HB       ILE 561  60.278  19.119  10.444
  919   HG12  ILE 561          HG12      ILE 561  59.944  17.923   7.701
  920   HG13  ILE 561          HG11      ILE 561  60.738  19.444   8.073
  921   HG21  ILE 561          HG21      ILE 561  59.181  16.458   9.485
  922   HG22  ILE 561          HG22      ILE 561  58.767  17.137  11.067
  923   HG23  ILE 561          HG23      ILE 561  60.445  16.744  10.681
  924   HD11  ILE 561          HD11      ILE 561  62.318  18.130   9.549
  925   HD12  ILE 561          HD12      ILE 561  62.484  17.821   7.821
  926   HD13  ILE 561          HD13      ILE 561  61.635  16.660   8.850
  927    H    THR 562           HN       THR 562  56.631  17.678  10.116
  928    HA   THR 562           HA       THR 562  56.033  19.213  12.613
  929    HB   THR 562           HB       THR 562  53.997  17.540  11.164
  930    HG1  THR 562           HG1      THR 562  53.229  19.684  10.502
  931   HG21  THR 562          HG21      THR 562  52.435  18.719  12.569
  932   HG22  THR 562          HG22      THR 562  53.695  19.820  13.125
  933   HG23  THR 562          HG23      THR 562  53.733  18.122  13.607
  934    H    ALA 563           HN       ALA 563  55.651  18.076  14.436
  935    HA   ALA 563           HA       ALA 563  56.306  15.160  14.363
  936    HB1  ALA 563           HB1      ALA 563  57.010  17.158  16.516
  937    HB2  ALA 563           HB2      ALA 563  58.116  16.670  15.227
  938    HB3  ALA 563           HB3      ALA 563  57.546  15.479  16.407
  939    H    MET 564           HN       MET 564  55.898  15.780  17.428
  940    HA   MET 564           HA       MET 564  53.301  14.598  17.651
  941    HB2  MET 564           HB2      MET 564  54.571  16.240  19.829
  942    HB3  MET 564           HB1      MET 564  53.662  14.733  19.961
  943    HG2  MET 564           HG2      MET 564  55.601  13.673  18.611
  944    HG3  MET 564           HG1      MET 564  56.491  15.142  19.007
  945    HE1  MET 564           HE1      MET 564  58.061  12.547  21.367
  946    HE2  MET 564           HE2      MET 564  58.414  14.053  20.526
  947    HE3  MET 564           HE3      MET 564  57.726  12.697  19.637
  948    H    ALA 565           HN       ALA 565  53.596  17.105  16.153
  949    HA   ALA 565           HA       ALA 565  51.761  18.615  15.643
  950    HB1  ALA 565           HB1      ALA 565  50.540  18.046  17.808
  951    HB2  ALA 565           HB2      ALA 565  50.535  19.750  17.365
  952    HB3  ALA 565           HB3      ALA 565  51.630  19.176  18.619
  953    H    LYS 566           HN       LYS 566  54.667  18.556  17.264
  954    HA   LYS 566           HA       LYS 566  55.083  21.466  17.373
  955    HB2  LYS 566           HB2      LYS 566  56.657  19.000  17.991
  956    HB3  LYS 566           HB1      LYS 566  57.591  20.427  17.558
  957    HG2  LYS 566           HG2      LYS 566  56.720  21.688  19.363
  958    HG3  LYS 566           HG1      LYS 566  55.411  20.543  19.643
  959    HD2  LYS 566           HD2      LYS 566  58.250  19.562  19.855
  960    HD3  LYS 566           HD1      LYS 566  57.587  20.518  21.173
  961    HE2  LYS 566           HE2      LYS 566  55.961  18.914  21.697
  962    HE3  LYS 566           HE1      LYS 566  55.978  18.216  20.072
  963    HZ1  LYS 566           HZ1      LYS 566  57.189  16.661  21.165
  964    HZ2  LYS 566           HZ2      LYS 566  57.780  17.749  22.328
  965    HZ3  LYS 566           HZ3      LYS 566  58.458  17.715  20.771
  966    H    LYS 567           HN       LYS 567  56.764  22.490  16.016
  967    HA   LYS 567           HA       LYS 567  56.798  21.326  13.260
  968    HB2  LYS 567           HB2      LYS 567  57.604  24.136  13.919
  969    HB3  LYS 567           HB1      LYS 567  56.896  23.517  12.440
  970    HG2  LYS 567           HG2      LYS 567  55.466  23.834  15.104
  971    HG3  LYS 567           HG1      LYS 567  55.255  24.856  13.693
  972    HD2  LYS 567           HD2      LYS 567  54.634  21.874  13.764
  973    HD3  LYS 567           HD1      LYS 567  53.443  23.166  13.901
  974    HE2  LYS 567           HE2      LYS 567  54.430  24.034  11.659
  975    HE3  LYS 567           HE1      LYS 567  55.125  22.420  11.523
  976    HZ1  LYS 567           HZ1      LYS 567  52.795  22.879  10.558
  977    HZ2  LYS 567           HZ2      LYS 567  52.275  22.738  12.169
  978    HZ3  LYS 567           HZ3      LYS 567  53.066  21.439  11.411
  979    H    PHE 568           HN       PHE 568  58.992  22.052  12.084
  980    HA   PHE 568           HA       PHE 568  61.273  22.171  13.938
  981    HB2  PHE 568           HB2      PHE 568  60.303  19.607  12.837
  982    HB3  PHE 568           HB1      PHE 568  62.000  19.867  12.499
  983    HD1  PHE 568           HD1      PHE 568  59.619  18.806  14.949
  984    HD2  PHE 568           HD2      PHE 568  63.491  20.615  14.508
  985    HE1  PHE 568           HE1      PHE 568  60.182  18.172  17.279
  986    HE2  PHE 568           HE2      PHE 568  64.053  19.980  16.838
  987    HZ   PHE 568           HZ       PHE 568  62.398  18.758  18.224
  988    H    HIS 569           HN       HIS 569  62.968  23.127  12.933
  989    HA   HIS 569           HA       HIS 569  62.804  24.199  10.321
  990    HB2  HIS 569           HB2      HIS 569  65.053  23.563  12.187
  991    HB3  HIS 569           HB1      HIS 569  65.449  24.043  10.548
  992    HD2  HIS 569           HD2      HIS 569  63.870  26.652   9.954
  993    HE1  HIS 569           HE1      HIS 569  64.718  27.931  13.879
  994    HA   PRO 570           HA       PRO 570  62.937  20.059   8.356
  995    HB2  PRO 570           HB2      PRO 570  63.799  21.677   5.993
  996    HB3  PRO 570           HB1      PRO 570  62.505  20.473   6.122
  997    HG2  PRO 570           HG2      PRO 570  62.010  23.154   6.023
  998    HG3  PRO 570           HG1      PRO 570  60.963  22.016   6.879
  999    HD2  PRO 570           HD2      PRO 570  62.803  24.050   8.004
 1000    HD3  PRO 570           HD1      PRO 570  61.413  23.242   8.766
 1001    H    GLU 571           HN       GLU 571  65.438  22.332   8.845
 1002    HA   GLU 571           HA       GLU 571  67.554  20.562   7.766
 1003    HB2  GLU 571           HB2      GLU 571  68.048  23.196   9.137
 1004    HB3  GLU 571           HB1      GLU 571  68.975  22.417   7.856
 1005    HG2  GLU 571           HG2      GLU 571  66.941  22.716   6.367
 1006    HG3  GLU 571           HG1      GLU 571  66.274  23.740   7.644
 1007    H    HIS 572           HN       HIS 572  66.808  22.316  10.781
 1008    HA   HIS 572           HA       HIS 572  68.814  21.082  12.364
 1009    HB2  HIS 572           HB2      HIS 572  66.092  21.967  13.375
 1010    HB3  HIS 572           HB1      HIS 572  67.588  21.868  14.303
 1011    HD2  HIS 572           HD2      HIS 572  69.257  23.228  11.555
 1012    HE1  HIS 572           HE1      HIS 572  67.230  26.696  12.823
 1013    H    PHE 573           HN       PHE 573  66.282  19.588  10.838
 1014    HA   PHE 573           HA       PHE 573  66.446  17.246  12.710
 1015    HB2  PHE 573           HB2      PHE 573  64.178  18.503  12.584
 1016    HB3  PHE 573           HB1      PHE 573  64.062  17.836  10.962
 1017    HD1  PHE 573           HD1      PHE 573  64.566  16.875  14.534
 1018    HD2  PHE 573           HD2      PHE 573  63.357  15.601  10.613
 1019    HE1  PHE 573           HE1      PHE 573  63.783  14.718  15.475
 1020    HE2  PHE 573           HE2      PHE 573  62.575  13.444  11.555
 1021    HZ   PHE 573           HZ       PHE 573  62.788  13.003  13.986
 1022    H    VAL 574           HN       VAL 574  68.319  17.453  10.843
 1023    HA   VAL 574           HA       VAL 574  67.455  16.157   8.351
 1024    HB   VAL 574           HB       VAL 574  69.857  16.331   7.716
 1025   HG11  VAL 574          HG11      VAL 574  69.529  19.116   8.273
 1026   HG12  VAL 574          HG12      VAL 574  67.919  18.435   8.036
 1027   HG13  VAL 574          HG13      VAL 574  69.142  18.259   6.796
 1028   HG21  VAL 574          HG21      VAL 574  70.956  16.250   9.850
 1029   HG22  VAL 574          HG22      VAL 574  70.022  17.637  10.451
 1030   HG23  VAL 574          HG23      VAL 574  71.242  17.875   9.197
 1031    H    CYS 575           HN       CYS 575  69.151  14.455   7.591
 1032    HA   CYS 575           HA       CYS 575  69.020  12.196   9.444
 1033    HB2  CYS 575           HB2      CYS 575  68.834  11.160   7.436
 1034    HB3  CYS 575           HB1      CYS 575  69.263  12.656   6.619
 1035    H    ALA 576           HN       ALA 576  70.912  11.022  10.270
 1036    HA   ALA 576           HA       ALA 576  73.276  12.856  10.461
 1037    HB1  ALA 576           HB1      ALA 576  72.830  10.200  11.866
 1038    HB2  ALA 576           HB2      ALA 576  72.219  11.731  12.495
 1039    HB3  ALA 576           HB3      ALA 576  73.957  11.479  12.317
 1040    H    PHE 577           HN       PHE 577  73.713  12.382   8.186
 1041    HA   PHE 577           HA       PHE 577  75.860  10.426   7.916
 1042    HB2  PHE 577           HB2      PHE 577  74.156   8.983   6.977
 1043    HB3  PHE 577           HB1      PHE 577  73.415  10.312   6.117
 1044    HD1  PHE 577           HD1      PHE 577  76.341   8.028   6.180
 1045    HD2  PHE 577           HD2      PHE 577  74.275  11.123   4.025
 1046    HE1  PHE 577           HE1      PHE 577  77.720   7.559   4.183
 1047    HE2  PHE 577           HE2      PHE 577  75.662  10.647   2.027
 1048    HZ   PHE 577           HZ       PHE 577  77.383   8.865   2.106
 1049    H    CYS 578           HN       CYS 578  73.633  12.668   6.609
 1050    HA   CYS 578           HA       CYS 578  75.751  14.504   5.648
 1051    HB2  CYS 578           HB2      CYS 578  74.236  14.974   3.671
 1052    HB3  CYS 578           HB1      CYS 578  74.948  13.363   3.645
 1053    H    LEU 579           HN       LEU 579  75.337  16.470   6.585
 1054    HA   LEU 579           HA       LEU 579  72.997  16.844   8.221
 1055    HB2  LEU 579           HB2      LEU 579  75.573  18.043   7.923
 1056    HB3  LEU 579           HB1      LEU 579  74.406  19.332   7.706
 1057    HG   LEU 579           HG       LEU 579  73.306  18.551   9.860
 1058   HD11  LEU 579          HD11      LEU 579  74.180  16.375  10.177
 1059   HD12  LEU 579          HD12      LEU 579  74.999  17.372  11.376
 1060   HD13  LEU 579          HD13      LEU 579  75.836  16.911   9.895
 1061   HD21  LEU 579          HD21      LEU 579  76.113  19.669   9.779
 1062   HD22  LEU 579          HD22      LEU 579  75.161  19.605  11.262
 1063   HD23  LEU 579          HD23      LEU 579  74.596  20.563   9.893
 1064    H    LYS 580           HN       LYS 580  72.833  16.931   4.912
 1065    HA   LYS 580           HA       LYS 580  71.747  19.682   4.736
 1066    HB2  LYS 580           HB2      LYS 580  72.068  19.543   2.474
 1067    HB3  LYS 580           HB1      LYS 580  73.203  18.311   2.997
 1068    HG2  LYS 580           HG2      LYS 580  70.362  17.731   2.060
 1069    HG3  LYS 580           HG1      LYS 580  71.798  17.603   1.062
 1070    HD2  LYS 580           HD2      LYS 580  72.617  15.744   2.193
 1071    HD3  LYS 580           HD1      LYS 580  71.740  16.116   3.674
 1072    HE2  LYS 580           HE2      LYS 580  70.824  14.155   2.345
 1073    HE3  LYS 580           HE1      LYS 580  69.656  15.422   2.716
 1074    HZ1  LYS 580           HZ1      LYS 580  69.408  14.882   0.441
 1075    HZ2  LYS 580           HZ2      LYS 580  71.081  14.970   0.157
 1076    HZ3  LYS 580           HZ3      LYS 580  70.198  16.382   0.494
 1077    H    GLN 581           HN       GLN 581  70.165  16.382   4.418
 1078    HA   GLN 581           HA       GLN 581  67.734  17.759   5.164
 1079    HB2  GLN 581           HB2      GLN 581  68.016  18.352   2.754
 1080    HB3  GLN 581           HB1      GLN 581  67.673  16.665   2.374
 1081    HG2  GLN 581           HG2      GLN 581  65.579  17.799   2.249
 1082    HG3  GLN 581           HG1      GLN 581  65.546  16.959   3.786
 1083   HE21  GLN 581          HE21      GLN 581  66.141  18.316   5.749
 1084   HE22  GLN 581          HE22      GLN 581  65.788  19.968   5.705
 1085    H    LEU 582           HN       LEU 582  66.109  16.609   5.854
 1086    HA   LEU 582           HA       LEU 582  65.932  13.722   5.286
 1087    HB2  LEU 582           HB2      LEU 582  67.145  14.165   7.480
 1088    HB3  LEU 582           HB1      LEU 582  65.631  14.817   8.082
 1089    HG   LEU 582           HG       LEU 582  64.535  12.651   7.638
 1090   HD11  LEU 582          HD11      LEU 582  67.102  12.080   6.276
 1091   HD12  LEU 582          HD12      LEU 582  65.512  11.383   6.017
 1092   HD13  LEU 582          HD13      LEU 582  66.534  10.774   7.314
 1093   HD21  LEU 582          HD21      LEU 582  66.887  12.938   9.465
 1094   HD22  LEU 582          HD22      LEU 582  66.177  11.328   9.309
 1095   HD23  LEU 582          HD23      LEU 582  65.185  12.684   9.840
 1096    H    ASN 583           HN       ASN 583  63.684  12.949   6.089
 1097    HA   ASN 583           HA       ASN 583  61.681  15.141   6.274
 1098    HB2  ASN 583           HB2      ASN 583  61.944  13.212   3.964
 1099    HB3  ASN 583           HB1      ASN 583  60.357  13.823   4.418
 1100   HD21  ASN 583          HD21      ASN 583  61.229  14.527   1.931
 1101   HD22  ASN 583          HD22      ASN 583  61.703  16.152   1.897
 1102    H    LYS 584           HN       LYS 584  59.996  14.539   7.550
 1103    HA   LYS 584           HA       LYS 584  60.086  12.227   9.144
 1104    HB2  LYS 584           HB2      LYS 584  57.661  12.751   9.586
 1105    HB3  LYS 584           HB1      LYS 584  58.753  14.122   9.793
 1106    HG2  LYS 584           HG2      LYS 584  57.966  15.231   7.911
 1107    HG3  LYS 584           HG1      LYS 584  57.570  13.740   7.053
 1108    HD2  LYS 584           HD2      LYS 584  55.537  14.977   7.718
 1109    HD3  LYS 584           HD1      LYS 584  55.635  13.400   8.497
 1110    HE2  LYS 584           HE2      LYS 584  56.285  14.342  10.579
 1111    HE3  LYS 584           HE1      LYS 584  56.662  15.898   9.841
 1112    HZ1  LYS 584           HZ1      LYS 584  53.937  14.863   9.580
 1113    HZ2  LYS 584           HZ2      LYS 584  54.479  16.469   9.700
 1114    HZ3  LYS 584           HZ3      LYS 584  54.407  15.488  11.085
 1115    H    GLY 585           HN       GLY 585  59.191  12.579   5.892
 1116    HA2  GLY 585           HA2      GLY 585  57.485  10.151   5.864
 1117    HA3  GLY 585           HA1      GLY 585  57.750  11.253   4.515
 1118    H    THR 586           HN       THR 586  60.688  11.133   5.436
 1119    HA   THR 586           HA       THR 586  61.395   8.451   4.334
 1120    HB   THR 586           HB       THR 586  62.824   9.338   2.698
 1121    HG1  THR 586           HG1      THR 586  63.878  10.834   4.007
 1122   HG21  THR 586          HG21      THR 586  60.606  11.396   2.863
 1123   HG22  THR 586          HG22      THR 586  60.383   9.759   2.248
 1124   HG23  THR 586          HG23      THR 586  61.463  10.876   1.410
 1125    H    PHE 587           HN       PHE 587  61.432   9.767   7.039
 1126    HA   PHE 587           HA       PHE 587  64.342  10.027   7.535
 1127    HB2  PHE 587           HB2      PHE 587  63.818  10.800   9.684
 1128    HB3  PHE 587           HB1      PHE 587  62.525  11.441   8.690
 1129    HD1  PHE 587           HD1      PHE 587  63.177   9.861  11.727
 1130    HD2  PHE 587           HD2      PHE 587  60.456   9.665   8.412
 1131    HE1  PHE 587           HE1      PHE 587  61.504   8.730  13.162
 1132    HE2  PHE 587           HE2      PHE 587  58.786   8.534   9.845
 1133    HZ   PHE 587           HZ       PHE 587  59.308   8.066  12.222
 1134    H    LYS 588           HN       LYS 588  65.432   8.203   7.583
 1135    HA   LYS 588           HA       LYS 588  64.241   5.740   8.751
 1136    HB2  LYS 588           HB2      LYS 588  65.784   6.248   6.445
 1137    HB3  LYS 588           HB1      LYS 588  66.904   5.514   7.545
 1138    HG2  LYS 588           HG2      LYS 588  65.747   3.891   6.024
 1139    HG3  LYS 588           HG1      LYS 588  65.612   3.520   7.730
 1140    HD2  LYS 588           HD2      LYS 588  63.514   3.310   6.164
 1141    HD3  LYS 588           HD1      LYS 588  63.324   3.955   7.774
 1142    HE2  LYS 588           HE2      LYS 588  62.953   6.128   6.987
 1143    HE3  LYS 588           HE1      LYS 588  63.862   5.849   5.518
 1144    HZ1  LYS 588           HZ1      LYS 588  62.103   4.351   4.776
 1145    HZ2  LYS 588           HZ2      LYS 588  61.537   5.934   5.025
 1146    HZ3  LYS 588           HZ3      LYS 588  61.210   4.721   6.170
 1147    H    GLU 589           HN       GLU 589  65.616   4.492  10.245
 1148    HA   GLU 589           HA       GLU 589  67.808   5.966  11.547
 1149    HB2  GLU 589           HB2      GLU 589  66.128   7.039  12.765
 1150    HB3  GLU 589           HB1      GLU 589  65.092   5.620  12.798
 1151    HG2  GLU 589           HG2      GLU 589  66.466   4.560  14.453
 1152    HG3  GLU 589           HG1      GLU 589  67.755   5.752  14.249
 1153    H    GLN 590           HN       GLN 590  68.884   4.789  13.111
 1154    HA   GLN 590           HA       GLN 590  68.239   2.068  13.784
 1155    HB2  GLN 590           HB2      GLN 590  70.158   0.981  12.751
 1156    HB3  GLN 590           HB1      GLN 590  69.202   1.757  11.502
 1157    HG2  GLN 590           HG2      GLN 590  70.725   3.678  11.522
 1158    HG3  GLN 590           HG1      GLN 590  71.699   2.887  12.744
 1159   HE21  GLN 590          HE21      GLN 590  70.366   0.607  10.595
 1160   HE22  GLN 590          HE22      GLN 590  71.717   0.405   9.588
 1161    H    ASN 591           HN       ASN 591  69.511   1.465  15.562
 1162    HA   ASN 591           HA       ASN 591  70.612   1.954  17.556
 1163    HB2  ASN 591           HB2      ASN 591  72.815   3.535  16.552
 1164    HB3  ASN 591           HB1      ASN 591  72.831   1.866  17.084
 1165   HD21  ASN 591          HD21      ASN 591  71.150   0.760  15.075
 1166   HD22  ASN 591          HD22      ASN 591  71.925   0.890  13.570
 1167    H    ASP 592           HN       ASP 592  68.662   3.960  16.383
 1168    HA   ASP 592           HA       ASP 592  67.689   5.886  17.328
 1169    HB2  ASP 592           HB2      ASP 592  70.226   6.528  18.808
 1170    HB3  ASP 592           HB1      ASP 592  68.559   6.892  19.248
 1171    H    LYS 593           HN       LYS 593  70.486   5.786  15.473
 1172    HA   LYS 593           HA       LYS 593  70.868   8.678  15.254
 1173    HB2  LYS 593           HB2      LYS 593  72.002   6.356  13.728
 1174    HB3  LYS 593           HB1      LYS 593  72.552   8.020  13.607
 1175    HG2  LYS 593           HG2      LYS 593  72.738   7.721  16.283
 1176    HG3  LYS 593           HG1      LYS 593  72.941   6.036  15.814
 1177    HD2  LYS 593           HD2      LYS 593  74.787   6.653  14.312
 1178    HD3  LYS 593           HD1      LYS 593  74.572   8.354  14.730
 1179    HE2  LYS 593           HE2      LYS 593  75.057   6.312  16.898
 1180    HE3  LYS 593           HE1      LYS 593  76.410   6.969  15.977
 1181    HZ1  LYS 593           HZ1      LYS 593  75.635   8.152  18.122
 1182    HZ2  LYS 593           HZ2      LYS 593  74.409   8.789  17.133
 1183    HZ3  LYS 593           HZ3      LYS 593  76.041   9.081  16.763
 1184    HA   PRO 594           HA       PRO 594  67.526   8.775  12.088
 1185    HB2  PRO 594           HB2      PRO 594  68.756  11.412  11.495
 1186    HB3  PRO 594           HB1      PRO 594  67.074  11.022  11.856
 1187    HG2  PRO 594           HG2      PRO 594  68.726  12.286  13.617
 1188    HG3  PRO 594           HG1      PRO 594  67.393  11.241  14.132
 1189    HD2  PRO 594           HD2      PRO 594  70.324  10.717  14.232
 1190    HD3  PRO 594           HD1      PRO 594  69.011   9.990  15.190
 1191    H    TYR 595           HN       TYR 595  67.532   8.981   9.675
 1192    HA   TYR 595           HA       TYR 595  70.032   9.238   8.220
 1193    HB2  TYR 595           HB2      TYR 595  68.956   6.502   8.853
 1194    HB3  TYR 595           HB1      TYR 595  69.851   6.777   7.369
 1195    HD1  TYR 595           HD1      TYR 595  70.182   5.684  10.642
 1196    HD2  TYR 595           HD2      TYR 595  72.131   8.198   7.772
 1197    HE1  TYR 595           HE1      TYR 595  72.350   5.309  11.785
 1198    HE2  TYR 595           HE2      TYR 595  74.299   7.839   8.943
 1199    HH   TYR 595           HH       TYR 595  74.586   6.712  11.975
 1200    H    CYS 596           HN       CYS 596  69.553   9.528   5.995
 1201    HA   CYS 596           HA       CYS 596  66.738   9.493   5.180
 1202    HB2  CYS 596           HB2      CYS 596  69.061   9.409   3.234
 1203    HB3  CYS 596           HB1      CYS 596  67.481  10.145   3.019
 1204    H    GLN 597           HN       GLN 597  65.917   7.777   3.640
 1205    HA   GLN 597           HA       GLN 597  66.835   5.206   4.441
 1206    HB2  GLN 597           HB2      GLN 597  64.677   5.108   3.551
 1207    HB3  GLN 597           HB1      GLN 597  65.045   6.244   2.284
 1208    HG2  GLN 597           HG2      GLN 597  64.856   4.263   1.067
 1209    HG3  GLN 597           HG1      GLN 597  66.579   4.287   1.386
 1210   HE21  GLN 597          HE21      GLN 597  66.266   3.614   4.253
 1211   HE22  GLN 597          HE22      GLN 597  65.817   1.999   4.312
 1212    H    ASN 598           HN       ASN 598  67.325   6.982   1.399
 1213    HA   ASN 598           HA       ASN 598  69.168   5.341   0.134
 1214    HB2  ASN 598           HB2      ASN 598  69.675   8.305   0.210
 1215    HB3  ASN 598           HB1      ASN 598  69.730   7.201  -1.160
 1216   HD21  ASN 598          HD21      ASN 598  67.318   5.955  -1.095
 1217   HD22  ASN 598          HD22      ASN 598  66.056   7.070  -1.251
 1218    H    CYS 599           HN       CYS 599  69.633   7.283   2.999
 1219    HA   CYS 599           HA       CYS 599  72.553   6.979   2.942
 1220    HB2  CYS 599           HB2      CYS 599  70.583   8.226   4.859
 1221    HB3  CYS 599           HB1      CYS 599  72.256   7.959   5.333
 1222    H    PHE 600           HN       PHE 600  69.972   5.987   5.237
 1223    HA   PHE 600           HA       PHE 600  71.538   4.142   6.700
 1224    HB2  PHE 600           HB2      PHE 600  69.504   4.528   7.749
 1225    HB3  PHE 600           HB1      PHE 600  68.609   4.566   6.236
 1226    HD1  PHE 600           HD1      PHE 600  69.919   2.448   8.938
 1227    HD2  PHE 600           HD2      PHE 600  67.866   2.473   5.164
 1228    HE1  PHE 600           HE1      PHE 600  69.197   0.104   9.312
 1229    HE2  PHE 600           HE2      PHE 600  67.146   0.131   5.539
 1230    HZ   PHE 600           HZ       PHE 600  67.811  -1.054   7.612
 1231    H    LEU 601           HN       LEU 601  69.309   3.440   3.975
 1232    HA   LEU 601           HA       LEU 601  69.833   0.712   3.744
 1233    HB2  LEU 601           HB2      LEU 601  68.494   0.939   1.918
 1234    HB3  LEU 601           HB1      LEU 601  68.496   2.661   2.243
 1235    HG   LEU 601           HG       LEU 601  70.552   2.850   0.775
 1236   HD11  LEU 601          HD11      LEU 601  70.264   0.546  -0.846
 1237   HD12  LEU 601          HD12      LEU 601  70.287  -0.062   0.805
 1238   HD13  LEU 601          HD13      LEU 601  71.616   0.931   0.213
 1239   HD21  LEU 601          HD21      LEU 601  68.153   3.256   0.033
 1240   HD22  LEU 601          HD22      LEU 601  68.174   1.629  -0.641
 1241   HD23  LEU 601          HD23      LEU 601  69.280   2.853  -1.260
 1242    H    LYS 602           HN       LYS 602  71.754   3.422   2.493
 1243    HA   LYS 602           HA       LYS 602  73.673   1.967   1.051
 1244    HB2  LYS 602           HB2      LYS 602  73.417   4.616   1.821
 1245    HB3  LYS 602           HB1      LYS 602  74.837   4.139   2.718
 1246    HG2  LYS 602           HG2      LYS 602  74.495   3.702  -0.262
 1247    HG3  LYS 602           HG1      LYS 602  75.311   5.089   0.435
 1248    HD2  LYS 602           HD2      LYS 602  77.227   3.854   0.432
 1249    HD3  LYS 602           HD1      LYS 602  76.511   2.879   1.710
 1250    HE2  LYS 602           HE2      LYS 602  77.350   1.561  -0.263
 1251    HE3  LYS 602           HE1      LYS 602  75.652   1.296   0.110
 1252    HZ1  LYS 602           HZ1      LYS 602  74.979   2.348  -1.759
 1253    HZ2  LYS 602           HZ2      LYS 602  76.508   1.861  -2.318
 1254    HZ3  LYS 602           HZ3      LYS 602  76.271   3.447  -1.754
 1255    H    LEU 603           HN       LEU 603  73.180   2.194   4.488
 1256    HA   LEU 603           HA       LEU 603  75.789   0.951   5.105
 1257    HB2  LEU 603           HB2      LEU 603  73.665   1.445   7.166
 1258    HB3  LEU 603           HB1      LEU 603  75.416   1.595   7.308
 1259    HG   LEU 603           HG       LEU 603  73.577   3.452   5.769
 1260   HD11  LEU 603          HD11      LEU 603  73.631   3.538   8.326
 1261   HD12  LEU 603          HD12      LEU 603  73.981   5.039   7.470
 1262   HD13  LEU 603          HD13      LEU 603  75.297   4.088   8.154
 1263   HD21  LEU 603          HD21      LEU 603  75.644   4.815   5.471
 1264   HD22  LEU 603          HD22      LEU 603  75.764   3.257   4.658
 1265   HD23  LEU 603          HD23      LEU 603  76.583   3.512   6.196
 1266    H    PHE 604           HN       PHE 604  72.374   0.183   5.889
 1267    HA   PHE 604           HA       PHE 604  73.174  -2.674   6.243
 1268    HB2  PHE 604           HB2      PHE 604  70.987  -0.925   7.316
 1269    HB3  PHE 604           HB1      PHE 604  70.633  -2.642   7.140
 1270    HD1  PHE 604           HD1      PHE 604  73.100  -0.251   8.636
 1271    HD2  PHE 604           HD2      PHE 604  71.437  -4.213   8.713
 1272    HE1  PHE 604           HE1      PHE 604  74.340  -0.732  10.726
 1273    HE2  PHE 604           HE2      PHE 604  72.679  -4.691  10.805
 1274    HZ   PHE 604           HZ       PHE 604  74.131  -2.951  11.811
 1275    H    CYS 605           HN       CYS 605  72.846  -1.456   3.563
 1276    HA   CYS 605           HA       CYS 605  70.448  -1.904   2.246
 1277    HB2  CYS 605           HB2      CYS 605  72.330  -1.158   0.956
 1278    HB3  CYS 605           HB1      CYS 605  73.262  -2.596   1.363
 1279    HG   CYS 605           HG       CYS 605  72.298  -3.118  -0.960
  Start of MODEL   20
    1    H    MET   1           HT1      MET   1  87.406 -26.560   9.514
    2    HA   MET   1           HA       MET   1  88.841 -27.887   8.240
    3    HB2  MET   1           HB2      MET   1  89.713 -25.714   9.515
    4    HB3  MET   1           HB1      MET   1  90.762 -26.873  10.327
    5    HG2  MET   1           HG2      MET   1  91.527 -27.686   8.092
    6    HG3  MET   1           HG1      MET   1  90.548 -26.429   7.335
    7    HE1  MET   1           HE1      MET   1  91.514 -24.312   6.620
    8    HE2  MET   1           HE2      MET   1  92.634 -25.563   6.087
    9    HE3  MET   1           HE3      MET   1  93.259 -24.054   6.748
   10    H    ALA   2           HN       ALA   2  91.488 -28.558   9.686
   11    HA   ALA   2           HA       ALA   2  90.939 -30.777  11.448
   12    HB1  ALA   2           HB1      ALA   2  91.762 -31.527   8.639
   13    HB2  ALA   2           HB2      ALA   2  90.103 -31.659   9.224
   14    HB3  ALA   2           HB3      ALA   2  91.381 -32.619   9.969
   15    H    LEU   3           HN       LEU   3  93.076 -29.258   9.108
   16    HA   LEU   3           HA       LEU   3  95.547 -30.371   9.493
   17    HB2  LEU   3           HB2      LEU   3  94.790 -27.444   9.483
   18    HB3  LEU   3           HB1      LEU   3  96.464 -27.985   9.429
   19    HG   LEU   3           HG       LEU   3  94.356 -28.900   7.455
   20   HD11  LEU   3          HD11      LEU   3  94.527 -26.549   7.111
   21   HD12  LEU   3          HD12      LEU   3  95.586 -27.275   5.901
   22   HD13  LEU   3          HD13      LEU   3  96.273 -26.565   7.363
   23   HD21  LEU   3          HD21      LEU   3  96.100 -30.433   7.268
   24   HD22  LEU   3          HD22      LEU   3  97.330 -29.265   7.745
   25   HD23  LEU   3          HD23      LEU   3  96.639 -29.208   6.126
   26    H    ASP   4           HN       ASP   4  94.939 -27.469  11.296
   27    HA   ASP   4           HA       ASP   4  95.747 -26.810  13.410
   28    HB2  ASP   4           HB2      ASP   4  93.631 -27.908  13.966
   29    HB3  ASP   4           HB1      ASP   4  94.442 -29.473  13.976
   30    H    GLY   5           HN       GLY   5  97.496 -28.566  11.719
   31    HA2  GLY   5           HA2      GLY   5  98.951 -30.393  13.391
   32    HA3  GLY   5           HA1      GLY   5  99.544 -29.665  11.895
   33    H    ILE   6           HN       ILE   6  98.696 -27.065  13.283
   34    HA   ILE   6           HA       ILE   6 101.276 -26.647  14.741
   35    HB   ILE   6           HB       ILE   6 100.362 -24.124  14.038
   36   HG12  ILE   6          HG12      ILE   6  98.526 -25.360  12.726
   37   HG13  ILE   6          HG11      ILE   6  99.443 -24.130  11.870
   38   HG21  ILE   6          HG21      ILE   6 102.189 -26.007  12.569
   39   HG22  ILE   6          HG22      ILE   6 102.626 -24.737  13.714
   40   HG23  ILE   6          HG23      ILE   6 101.995 -24.311  12.124
   41   HD11  ILE   6          HD11      ILE   6 100.335 -25.635  10.423
   42   HD12  ILE   6          HD12      ILE   6  99.027 -26.686  10.958
   43   HD13  ILE   6          HD13      ILE   6 100.626 -26.837  11.679
   44    H    ARG   7           HN       ARG   7  98.885 -24.145  14.951
   45    HA   ARG   7           HA       ARG   7  97.635 -25.181  17.357
   46    HB2  ARG   7           HB2      ARG   7  98.551 -23.290  18.768
   47    HB3  ARG   7           HB1      ARG   7  99.677 -24.579  18.384
   48    HG2  ARG   7           HG2      ARG   7  99.672 -22.377  16.393
   49    HG3  ARG   7           HG1      ARG   7 100.193 -21.891  18.003
   50    HD2  ARG   7           HD2      ARG   7 101.841 -23.745  18.012
   51    HD3  ARG   7           HD1      ARG   7 101.333 -24.174  16.383
   52    HE   ARG   7           HE       ARG   7 102.091 -21.412  16.446
   53   HH11  ARG   7          HH11      ARG   7 104.098 -20.848  15.578
   54   HH12  ARG   7          HH12      ARG   7 105.306 -22.069  15.358
   55   HH21  ARG   7          HH21      ARG   7 103.327 -24.629  16.603
   56   HH22  ARG   7          HH22      ARG   7 104.870 -24.210  15.937
   57    H    MET   8           HN       MET   8  98.227 -21.795  17.325
   58    HA   MET   8           HA       MET   8  95.832 -21.229  15.700
   59    HB2  MET   8           HB2      MET   8  95.379 -19.730  18.081
   60    HB3  MET   8           HB1      MET   8  94.422 -21.051  17.449
   61    HG2  MET   8           HG2      MET   8  95.654 -22.695  18.670
   62    HG3  MET   8           HG1      MET   8  96.894 -21.553  19.148
   63    HE1  MET   8           HE1      MET   8  96.128 -22.988  21.460
   64    HE2  MET   8           HE2      MET   8  94.655 -23.603  20.714
   65    HE3  MET   8           HE3      MET   8  94.563 -22.740  22.247
   66    HA   PRO   9           HA       PRO   9  97.978 -16.900  16.685
   67    HB2  PRO   9           HB2      PRO   9 100.557 -18.138  17.636
   68    HB3  PRO   9           HB1      PRO   9  99.883 -16.535  18.008
   69    HG2  PRO   9           HG2      PRO   9  99.681 -18.460  19.774
   70    HG3  PRO   9           HG1      PRO   9  98.291 -17.407  19.440
   71    HD2  PRO   9           HD2      PRO   9  98.730 -20.241  18.588
   72    HD3  PRO   9           HD1      PRO   9  97.248 -19.408  19.048
   73    H    ASP  10           HN       ASP  10  99.640 -19.841  15.865
   74    HA   ASP  10           HA       ASP  10 100.734 -18.630  13.349
   75    HB2  ASP  10           HB2      ASP  10 102.277 -19.843  15.020
   76    HB3  ASP  10           HB1      ASP  10 101.471 -21.324  14.508
   77    H    GLY  11           HN       GLY  11  98.657 -21.073  14.694
   78    HA2  GLY  11           HA2      GLY  11  98.156 -22.346  12.096
   79    HA3  GLY  11           HA1      GLY  11  97.376 -22.760  13.616
   80    H    CYS  12           HN       CYS  12  97.359 -19.491  13.283
   81    HA   CYS  12           HA       CYS  12  95.270 -18.929  11.447
   82    HB2  CYS  12           HB2      CYS  12  93.748 -20.248  12.698
   83    HB3  CYS  12           HB1      CYS  12  94.432 -19.717  14.233
   84    HG   CYS  12           HG       CYS  12  93.270 -17.404  13.908
   85    H    TYR  13           HN       TYR  13  94.904 -17.810  14.736
   86    HA   TYR  13           HA       TYR  13  96.718 -15.721  14.975
   87    HB2  TYR  13           HB2      TYR  13  94.690 -15.182  12.891
   88    HB3  TYR  13           HB1      TYR  13  94.690 -13.939  14.136
   89    HD1  TYR  13           HD1      TYR  13  96.061 -14.720  11.047
   90    HD2  TYR  13           HD2      TYR  13  97.257 -13.359  14.944
   91    HE1  TYR  13           HE1      TYR  13  98.102 -13.704  10.068
   92    HE2  TYR  13           HE2      TYR  13  99.296 -12.345  13.963
   93    HH   TYR  13           HH       TYR  13 100.519 -12.087  12.129
   94    H    ALA  14           HN       ALA  14  93.205 -16.185  15.026
   95    HA   ALA  14           HA       ALA  14  92.721 -16.627  17.683
   96    HB1  ALA  14           HB1      ALA  14  92.062 -14.105  18.319
   97    HB2  ALA  14           HB2      ALA  14  93.362 -13.736  17.185
   98    HB3  ALA  14           HB3      ALA  14  93.690 -14.715  18.614
   99    H    ASP  15           HN       ASP  15  91.795 -14.392  15.116
  100    HA   ASP  15           HA       ASP  15  89.233 -15.750  14.824
  101    HB2  ASP  15           HB2      ASP  15  88.913 -14.124  16.736
  102    HB3  ASP  15           HB1      ASP  15  89.218 -12.825  15.584
  103    H    GLY  16           HN       GLY  16  91.814 -14.201  13.533
  104    HA2  GLY  16           HA2      GLY  16  92.250 -13.649  11.277
  105    HA3  GLY  16           HA1      GLY  16  90.542 -13.922  10.921
  106    H    THR  17           HN       THR  17  91.815 -11.801  13.430
  107    HA   THR  17           HA       THR  17  90.213  -9.579  12.360
  108    HB   THR  17           HB       THR  17  91.273  -8.425  14.443
  109    HG1  THR  17           HG1      THR  17  92.933 -10.068  14.576
  110   HG21  THR  17          HG21      THR  17  89.018  -9.052  14.620
  111   HG22  THR  17          HG22      THR  17  89.785  -9.894  15.968
  112   HG23  THR  17          HG23      THR  17  89.389 -10.773  14.491
  113    H    TRP  18           HN       TRP  18  91.005  -8.148  11.001
  114    HA   TRP  18           HA       TRP  18  93.866  -7.364  11.120
  115    HB2  TRP  18           HB2      TRP  18  93.374  -7.226   8.425
  116    HB3  TRP  18           HB1      TRP  18  94.178  -8.580   9.201
  117    HD1  TRP  18           HD1      TRP  18  90.630  -7.499   8.132
  118    HE1  TRP  18           HE1      TRP  18  89.286  -9.628   7.566
  119    HE3  TRP  18           HE3      TRP  18  94.050 -11.071   9.408
  120    HZ2  TRP  18           HZ2      TRP  18  89.617 -12.466   7.648
  121    HZ3  TRP  18           HZ3      TRP  18  93.510 -13.476   9.155
  122    HH2  TRP  18           HH2      TRP  18  91.300 -14.178   8.277
  123    H    GLU  19           HN       GLU  19  93.914  -5.191  11.346
  124    HA   GLU  19           HA       GLU  19  91.478  -3.634  10.939
  125    HB2  GLU  19           HB2      GLU  19  93.568  -1.784  11.340
  126    HB3  GLU  19           HB1      GLU  19  92.492  -2.415  12.579
  127    HG2  GLU  19           HG2      GLU  19  94.848  -2.716  13.200
  128    HG3  GLU  19           HG1      GLU  19  94.034  -4.268  12.996
  129    H    LEU  20           HN       LEU  20  90.934  -2.516   9.140
  130    HA   LEU  20           HA       LEU  20  92.748  -2.679   6.836
  131    HB2  LEU  20           HB2      LEU  20  89.935  -2.552   7.182
  132    HB3  LEU  20           HB1      LEU  20  90.352  -1.026   6.415
  133    HG   LEU  20           HG       LEU  20  89.894  -2.558   4.650
  134   HD11  LEU  20          HD11      LEU  20  92.252  -1.243   4.732
  135   HD12  LEU  20          HD12      LEU  20  91.752  -2.241   3.368
  136   HD13  LEU  20          HD13      LEU  20  92.853  -2.897   4.572
  137   HD21  LEU  20          HD21      LEU  20  91.395  -4.496   6.381
  138   HD22  LEU  20          HD22      LEU  20  91.457  -4.742   4.641
  139   HD23  LEU  20          HD23      LEU  20  89.904  -4.719   5.470
  140    H    SER  21           HN       SER  21  93.995  -0.989   6.122
  141    HA   SER  21           HA       SER  21  94.250   1.320   7.883
  142    HB2  SER  21           HB2      SER  21  96.061   0.045   6.401
  143    HB3  SER  21           HB1      SER  21  95.571   1.236   5.198
  144    HG   SER  21           HG       SER  21  95.926   2.290   7.697
  145    H    VAL  22           HN       VAL  22  93.734   3.449   7.404
  146    HA   VAL  22           HA       VAL  22  92.303   3.974   4.854
  147    HB   VAL  22           HB       VAL  22  91.173   4.429   7.623
  148   HG11  VAL  22          HG11      VAL  22  89.342   5.669   6.385
  149   HG12  VAL  22          HG12      VAL  22  90.431   5.762   5.001
  150   HG13  VAL  22          HG13      VAL  22  90.860   6.552   6.522
  151   HG21  VAL  22          HG21      VAL  22  89.241   3.295   6.611
  152   HG22  VAL  22          HG22      VAL  22  90.693   2.307   6.426
  153   HG23  VAL  22          HG23      VAL  22  90.080   3.246   5.058
  154    H    HIS  23           HN       HIS  23  93.619   5.405   3.975
  155    HA   HIS  23           HA       HIS  23  95.029   7.426   5.559
  156    HB2  HIS  23           HB2      HIS  23  94.856   6.615   2.676
  157    HB3  HIS  23           HB1      HIS  23  95.524   8.203   3.063
  158    HD1  HIS  23           HD1      HIS  23  97.986   8.174   3.421
  159    HD2  HIS  23           HD2      HIS  23  96.268   4.504   4.400
  160    HE1  HIS  23           HE1      HIS  23  99.890   6.654   4.111
  161    H    VAL  24           HN       VAL  24  93.626   8.946   6.412
  162    HA   VAL  24           HA       VAL  24  91.299   9.837   4.926
  163    HB   VAL  24           HB       VAL  24  92.460  11.490   7.158
  164   HG11  VAL  24          HG11      VAL  24  90.216  11.906   6.007
  165   HG12  VAL  24          HG12      VAL  24  90.149  11.749   7.763
  166   HG13  VAL  24          HG13      VAL  24  89.665  10.401   6.744
  167   HG21  VAL  24          HG21      VAL  24  92.910   9.310   8.040
  168   HG22  VAL  24          HG22      VAL  24  91.389   8.668   7.414
  169   HG23  VAL  24          HG23      VAL  24  91.380   9.808   8.761
  170    H    THR  25           HN       THR  25  91.756  10.808   3.014
  171    HA   THR  25           HA       THR  25  94.114  12.362   2.526
  172    HB   THR  25           HB       THR  25  93.279  12.634   0.350
  173    HG1  THR  25           HG1      THR  25  91.275  13.153  -0.023
  174   HG21  THR  25          HG21      THR  25  91.687  10.237   1.280
  175   HG22  THR  25          HG22      THR  25  93.445  10.208   1.155
  176   HG23  THR  25          HG23      THR  25  92.464  10.481  -0.284
  177    H    ASP  26           HN       ASP  26  90.723  13.534   2.452
  178    HA   ASP  26           HA       ASP  26  91.270  16.270   2.452
  179    HB2  ASP  26           HB2      ASP  26  89.003  15.433   2.215
  180    HB3  ASP  26           HB1      ASP  26  89.029  14.804   3.863
  181    H    LEU  27           HN       LEU  27  92.119  14.086   4.894
  182    HA   LEU  27           HA       LEU  27  92.430  16.315   6.887
  183    HB2  LEU  27           HB2      LEU  27  91.401  13.567   7.106
  184    HB3  LEU  27           HB1      LEU  27  92.550  13.969   8.366
  185    HG   LEU  27           HG       LEU  27  90.265  15.832   7.696
  186   HD11  LEU  27          HD11      LEU  27  89.106  14.694   9.684
  187   HD12  LEU  27          HD12      LEU  27  90.238  13.363   9.439
  188   HD13  LEU  27          HD13      LEU  27  89.104  13.805   8.161
  189   HD21  LEU  27          HD21      LEU  27  91.589  15.308  10.363
  190   HD22  LEU  27          HD22      LEU  27  90.684  16.732   9.851
  191   HD23  LEU  27          HD23      LEU  27  92.293  16.426   9.196
  192    H    ASN  28           HN       ASN  28  93.887  13.727   5.128
  193    HA   ASN  28           HA       ASN  28  96.144  13.251   4.738
  194    HB2  ASN  28           HB2      ASN  28  96.393  15.800   5.166
  195    HB3  ASN  28           HB1      ASN  28  96.967  15.338   6.761
  196   HD21  ASN  28          HD21      ASN  28  97.997  12.755   5.415
  197   HD22  ASN  28          HD22      ASN  28  99.478  13.227   4.743
  198    H    ARG  29           HN       ARG  29  94.439  12.444   7.296
  199    HA   ARG  29           HA       ARG  29  96.685  11.572   9.013
  200    HB2  ARG  29           HB2      ARG  29  93.699  11.305   9.367
  201    HB3  ARG  29           HB1      ARG  29  94.921  10.857  10.558
  202    HG2  ARG  29           HG2      ARG  29  95.692  13.156  10.702
  203    HG3  ARG  29           HG1      ARG  29  94.586  13.638   9.424
  204    HD2  ARG  29           HD2      ARG  29  93.408  14.231  11.369
  205    HD3  ARG  29           HD1      ARG  29  92.735  12.649  10.970
  206    HE   ARG  29           HE       ARG  29  93.731  11.795  12.933
  207   HH11  ARG  29          HH11      ARG  29  94.957  12.005  14.821
  208   HH12  ARG  29          HH12      ARG  29  95.953  13.405  15.039
  209   HH21  ARG  29          HH21      ARG  29  95.073  14.831  12.003
  210   HH22  ARG  29          HH22      ARG  29  96.019  15.005  13.443
  211    H    ASP  30           HN       ASP  30  96.064   9.298   9.969
  212    HA   ASP  30           HA       ASP  30  95.235   7.414   7.836
  213    HB2  ASP  30           HB2      ASP  30  97.845   7.341   9.369
  214    HB3  ASP  30           HB1      ASP  30  97.163   5.919   8.578
  215    H    VAL  31           HN       VAL  31  93.655   6.257   8.693
  216    HA   VAL  31           HA       VAL  31  93.741   5.628  11.631
  217    HB   VAL  31           HB       VAL  31  91.281   5.905   9.908
  218   HG11  VAL  31          HG11      VAL  31  90.963   4.565  11.908
  219   HG12  VAL  31          HG12      VAL  31  90.212   6.141  12.169
  220   HG13  VAL  31          HG13      VAL  31  91.778   5.779  12.893
  221   HG21  VAL  31          HG21      VAL  31  92.456   8.074   9.995
  222   HG22  VAL  31          HG22      VAL  31  92.578   7.946  11.749
  223   HG23  VAL  31          HG23      VAL  31  91.000   8.130  10.987
  224    H    THR  32           HN       THR  32  92.790   3.599  12.218
  225    HA   THR  32           HA       THR  32  92.583   1.590  10.012
  226    HB   THR  32           HB       THR  32  93.717   0.324  12.337
  227    HG1  THR  32           HG1      THR  32  95.715   1.927  11.826
  228   HG21  THR  32          HG21      THR  32  94.063  -0.114   9.788
  229   HG22  THR  32          HG22      THR  32  95.426  -0.365  10.875
  230   HG23  THR  32          HG23      THR  32  95.327   1.112   9.915
  231    H    LEU  33           HN       LEU  33  90.894   0.187  10.292
  232    HA   LEU  33           HA       LEU  33  89.292   0.404  12.816
  233    HB2  LEU  33           HB2      LEU  33  88.582   0.144   9.911
  234    HB3  LEU  33           HB1      LEU  33  87.487  -0.526  11.101
  235    HG   LEU  33           HG       LEU  33  87.019   1.868  10.348
  236   HD11  LEU  33          HD11      LEU  33  87.495   1.770  13.325
  237   HD12  LEU  33          HD12      LEU  33  86.277   0.737  12.574
  238   HD13  LEU  33          HD13      LEU  33  86.155   2.487  12.433
  239   HD21  LEU  33          HD21      LEU  33  88.383   3.631  11.090
  240   HD22  LEU  33          HD22      LEU  33  89.537   2.440  10.505
  241   HD23  LEU  33          HD23      LEU  33  89.249   2.619  12.235
  242    H    ARG  34           HN       ARG  34  89.659  -1.382  14.006
  243    HA   ARG  34           HA       ARG  34  90.709  -3.840  13.068
  244    HB2  ARG  34           HB2      ARG  34  90.649  -3.064  15.478
  245    HB3  ARG  34           HB1      ARG  34  88.933  -3.459  15.488
  246    HG2  ARG  34           HG2      ARG  34  90.099  -5.370  16.379
  247    HG3  ARG  34           HG1      ARG  34  89.537  -5.794  14.762
  248    HD2  ARG  34           HD2      ARG  34  91.670  -5.787  13.866
  249    HD3  ARG  34           HD1      ARG  34  92.289  -4.623  15.035
  250    HE   ARG  34           HE       ARG  34  91.557  -7.189  16.224
  251   HH11  ARG  34          HH11      ARG  34  93.283  -8.404  17.029
  252   HH12  ARG  34          HH12      ARG  34  94.905  -7.973  16.599
  253   HH21  ARG  34          HH21      ARG  34  93.949  -5.284  14.629
  254   HH22  ARG  34          HH22      ARG  34  95.282  -6.206  15.240
  255    H    VAL  35           HN       VAL  35  89.624  -4.771  11.388
  256    HA   VAL  35           HA       VAL  35  86.764  -5.539  11.853
  257    HB   VAL  35           HB       VAL  35  86.425  -5.216   9.403
  258   HG11  VAL  35          HG11      VAL  35  86.492  -2.676   9.524
  259   HG12  VAL  35          HG12      VAL  35  87.293  -2.858  11.087
  260   HG13  VAL  35          HG13      VAL  35  85.653  -3.469  10.858
  261   HG21  VAL  35          HG21      VAL  35  88.128  -3.711   8.270
  262   HG22  VAL  35          HG22      VAL  35  88.658  -5.368   8.554
  263   HG23  VAL  35          HG23      VAL  35  89.217  -4.071   9.606
  264    H    THR  36           HN       THR  36  86.250  -7.114   9.849
  265    HA   THR  36           HA       THR  36  88.470  -9.057   9.480
  266    HB   THR  36           HB       THR  36  86.724 -10.880   9.964
  267    HG1  THR  36           HG1      THR  36  85.473  -8.582  11.024
  268   HG21  THR  36          HG21      THR  36  87.957  -9.101  12.041
  269   HG22  THR  36          HG22      THR  36  88.376 -10.752  11.592
  270   HG23  THR  36          HG23      THR  36  86.923 -10.439  12.533
  271    H    GLY  37           HN       GLY  37  87.529 -10.809   7.876
  272    HA2  GLY  37           HA2      GLY  37  86.479  -9.341   5.594
  273    HA3  GLY  37           HA1      GLY  37  86.918 -11.051   5.618
  274    H    GLU  38           HN       GLU  38  84.676  -9.150   7.595
  275    HA   GLU  38           HA       GLU  38  82.393 -10.686   6.511
  276    HB2  GLU  38           HB2      GLU  38  81.707 -11.570   8.569
  277    HB3  GLU  38           HB1      GLU  38  83.446 -11.810   8.600
  278    HG2  GLU  38           HG2      GLU  38  83.173 -10.845  10.697
  279    HG3  GLU  38           HG1      GLU  38  83.397  -9.383   9.739
  280    H    VAL  39           HN       VAL  39  83.757  -7.791   7.517
  281    HA   VAL  39           HA       VAL  39  81.269  -6.599   8.478
  282    HB   VAL  39           HB       VAL  39  82.516  -4.760   9.127
  283   HG11  VAL  39          HG11      VAL  39  84.734  -6.783   9.011
  284   HG12  VAL  39          HG12      VAL  39  83.328  -7.028  10.044
  285   HG13  VAL  39          HG13      VAL  39  84.362  -5.624  10.288
  286   HG21  VAL  39          HG21      VAL  39  84.797  -4.256   8.097
  287   HG22  VAL  39          HG22      VAL  39  83.424  -4.009   7.027
  288   HG23  VAL  39          HG23      VAL  39  84.416  -5.461   6.869
  289    H    HIS  40           HN       HIS  40  80.161  -4.912   7.409
  290    HA   HIS  40           HA       HIS  40  80.393  -5.040   4.450
  291    HB2  HIS  40           HB2      HIS  40  78.306  -3.245   5.095
  292    HB3  HIS  40           HB1      HIS  40  78.116  -4.939   4.657
  293    HD1  HIS  40           HD1      HIS  40  77.710  -2.599   7.459
  294    HD2  HIS  40           HD2      HIS  40  78.065  -6.727   7.001
  295    HE1  HIS  40           HE1      HIS  40  76.934  -3.631   9.638
  296    H    ILE  41           HN       ILE  41  81.109  -3.275   3.232
  297    HA   ILE  41           HA       ILE  41  82.888  -1.400   4.332
  298    HB   ILE  41           HB       ILE  41  81.101  -0.796   1.964
  299   HG12  ILE  41          HG12      ILE  41  83.772  -2.214   1.845
  300   HG13  ILE  41          HG11      ILE  41  82.242  -3.087   1.875
  301   HG21  ILE  41          HG21      ILE  41  83.965  -0.017   2.568
  302   HG22  ILE  41          HG22      ILE  41  82.572   1.017   2.884
  303   HG23  ILE  41          HG23      ILE  41  82.968   0.552   1.236
  304   HD11  ILE  41          HD11      ILE  41  82.394  -0.865  -0.091
  305   HD12  ILE  41          HD12      ILE  41  81.682  -2.468  -0.243
  306   HD13  ILE  41          HD13      ILE  41  83.423  -2.260  -0.420
  307    H    GLY  42           HN       GLY  42  79.467  -0.985   3.545
  308    HA2  GLY  42           HA2      GLY  42  79.120   1.660   4.381
  309    HA3  GLY  42           HA1      GLY  42  77.859   0.441   4.448
  310    H    GLY  43           HN       GLY  43  79.967  -1.080   6.143
  311    HA2  GLY  43           HA2      GLY  43  78.883  -0.224   8.724
  312    HA3  GLY  43           HA1      GLY  43  80.009  -1.559   8.450
  313    H    VAL  44           HN       VAL  44  81.944  -0.115   6.985
  314    HA   VAL  44           HA       VAL  44  83.495   1.022   9.125
  315    HB   VAL  44           HB       VAL  44  83.799   0.606   6.175
  316   HG11  VAL  44          HG11      VAL  44  85.960   1.958   6.233
  317   HG12  VAL  44          HG12      VAL  44  85.360   2.700   7.716
  318   HG13  VAL  44          HG13      VAL  44  84.479   2.914   6.204
  319   HG21  VAL  44          HG21      VAL  44  85.744   0.285   8.473
  320   HG22  VAL  44          HG22      VAL  44  85.883  -0.412   6.858
  321   HG23  VAL  44          HG23      VAL  44  84.613  -0.967   7.950
  322    H    MET  45           HN       MET  45  81.608   2.458   6.429
  323    HA   MET  45           HA       MET  45  82.221   5.181   6.865
  324    HB2  MET  45           HB2      MET  45  79.479   4.008   6.276
  325    HB3  MET  45           HB1      MET  45  79.940   5.691   6.047
  326    HG2  MET  45           HG2      MET  45  81.838   4.675   4.532
  327    HG3  MET  45           HG1      MET  45  80.764   3.281   4.458
  328    HE1  MET  45           HE1      MET  45  78.559   3.235   2.766
  329    HE2  MET  45           HE2      MET  45  77.488   4.611   3.028
  330    HE3  MET  45           HE3      MET  45  78.161   3.759   4.409
  331    H    LEU  46           HN       LEU  46  80.218   2.936   8.641
  332    HA   LEU  46           HA       LEU  46  79.095   4.944  10.432
  333    HB2  LEU  46           HB2      LEU  46  78.206   2.540   9.771
  334    HB3  LEU  46           HB1      LEU  46  79.226   2.010  11.105
  335    HG   LEU  46           HG       LEU  46  78.004   4.005  12.401
  336   HD11  LEU  46          HD11      LEU  46  75.713   4.343  11.684
  337   HD12  LEU  46          HD12      LEU  46  75.903   3.181  10.372
  338   HD13  LEU  46          HD13      LEU  46  76.770   4.718  10.323
  339   HD21  LEU  46          HD21      LEU  46  76.817   1.281  11.800
  340   HD22  LEU  46          HD22      LEU  46  76.212   2.347  13.069
  341   HD23  LEU  46          HD23      LEU  46  77.858   1.721  13.155
  342    H    LYS  47           HN       LYS  47  81.264   2.156  11.118
  343    HA   LYS  47           HA       LYS  47  82.067   2.924  13.687
  344    HB2  LYS  47           HB2      LYS  47  83.877   1.627  11.631
  345    HB3  LYS  47           HB1      LYS  47  84.026   1.521  13.384
  346    HG2  LYS  47           HG2      LYS  47  81.914   0.319  13.537
  347    HG3  LYS  47           HG1      LYS  47  81.646   0.520  11.807
  348    HD2  LYS  47           HD2      LYS  47  83.877  -0.703  11.468
  349    HD3  LYS  47           HD1      LYS  47  83.769  -1.140  13.173
  350    HE2  LYS  47           HE2      LYS  47  81.605  -1.724  11.133
  351    HE3  LYS  47           HE1      LYS  47  82.835  -2.885  11.632
  352    HZ1  LYS  47           HZ1      LYS  47  80.545  -1.847  13.114
  353    HZ2  LYS  47           HZ2      LYS  47  81.965  -2.145  13.999
  354    HZ3  LYS  47           HZ3      LYS  47  81.228  -3.400  13.121
  355    H    LEU  48           HN       LEU  48  83.988   3.563  10.711
  356    HA   LEU  48           HA       LEU  48  85.981   5.130  11.802
  357    HB2  LEU  48           HB2      LEU  48  85.095   4.574   9.237
  358    HB3  LEU  48           HB1      LEU  48  84.842   6.306   9.315
  359    HG   LEU  48           HG       LEU  48  87.504   5.614  10.381
  360   HD11  LEU  48          HD11      LEU  48  88.542   4.779   8.388
  361   HD12  LEU  48          HD12      LEU  48  87.030   4.900   7.488
  362   HD13  LEU  48          HD13      LEU  48  87.198   3.702   8.772
  363   HD21  LEU  48          HD21      LEU  48  86.527   7.289   8.068
  364   HD22  LEU  48          HD22      LEU  48  88.216   7.188   8.561
  365   HD23  LEU  48          HD23      LEU  48  87.010   7.855   9.666
  366    H    VAL  49           HN       VAL  49  82.892   6.375  10.600
  367    HA   VAL  49           HA       VAL  49  83.167   9.050  11.497
  368    HB   VAL  49           HB       VAL  49  80.807   7.243  11.005
  369   HG11  VAL  49          HG11      VAL  49  80.740  10.107  11.942
  370   HG12  VAL  49          HG12      VAL  49  79.956   8.716  12.693
  371   HG13  VAL  49          HG13      VAL  49  79.388   9.311  11.138
  372   HG21  VAL  49          HG21      VAL  49  80.532   8.540   9.022
  373   HG22  VAL  49          HG22      VAL  49  82.261   8.217   9.148
  374   HG23  VAL  49          HG23      VAL  49  81.623   9.795   9.613
  375    H    GLU  50           HN       GLU  50  81.552   6.302  13.163
  376    HA   GLU  50           HA       GLU  50  80.738   7.523  15.505
  377    HB2  GLU  50           HB2      GLU  50  81.981   4.800  15.089
  378    HB3  GLU  50           HB1      GLU  50  81.390   5.311  16.665
  379    HG2  GLU  50           HG2      GLU  50  79.703   5.341  14.150
  380    HG3  GLU  50           HG1      GLU  50  79.715   4.013  15.306
  381    H    LYS  51           HN       LYS  51  84.045   6.492  14.734
  382    HA   LYS  51           HA       LYS  51  85.102   7.200  17.319
  383    HB2  LYS  51           HB2      LYS  51  86.530   6.906  14.674
  384    HB3  LYS  51           HB1      LYS  51  87.281   6.901  16.271
  385    HG2  LYS  51           HG2      LYS  51  85.704   4.974  16.853
  386    HG3  LYS  51           HG1      LYS  51  85.347   4.882  15.132
  387    HD2  LYS  51           HD2      LYS  51  88.002   4.444  16.507
  388    HD3  LYS  51           HD1      LYS  51  87.079   3.308  15.538
  389    HE2  LYS  51           HE2      LYS  51  88.774   4.020  14.067
  390    HE3  LYS  51           HE1      LYS  51  87.394   5.013  13.611
  391    HZ1  LYS  51           HZ1      LYS  51  88.929   6.166  15.731
  392    HZ2  LYS  51           HZ2      LYS  51  88.426   6.853  14.261
  393    HZ3  LYS  51           HZ3      LYS  51  89.850   5.930  14.327
  394    H    LEU  52           HN       LEU  52  84.515   8.992  14.361
  395    HA   LEU  52           HA       LEU  52  86.222  11.212  14.905
  396    HB2  LEU  52           HB2      LEU  52  84.752  10.436  12.774
  397    HB3  LEU  52           HB1      LEU  52  83.635  11.617  13.445
  398    HG   LEU  52           HG       LEU  52  85.509  13.272  13.480
  399   HD11  LEU  52          HD11      LEU  52  87.342  12.436  11.638
  400   HD12  LEU  52          HD12      LEU  52  86.997  10.909  12.450
  401   HD13  LEU  52          HD13      LEU  52  87.573  12.291  13.377
  402   HD21  LEU  52          HD21      LEU  52  84.514  12.023  10.920
  403   HD22  LEU  52          HD22      LEU  52  85.582  13.424  10.874
  404   HD23  LEU  52          HD23      LEU  52  84.017  13.538  11.676
  405    H    ASP  53           HN       ASP  53  82.723  10.896  15.278
  406    HA   ASP  53           HA       ASP  53  81.246  11.752  16.845
  407    HB2  ASP  53           HB2      ASP  53  83.218  10.977  18.330
  408    HB3  ASP  53           HB1      ASP  53  83.572  12.688  18.493
  409    H    VAL  54           HN       VAL  54  81.002  13.290  15.046
  410    HA   VAL  54           HA       VAL  54  80.829  15.975  16.017
  411    HB   VAL  54           HB       VAL  54  83.217  16.027  15.675
  412   HG11  VAL  54          HG11      VAL  54  83.334  14.055  14.202
  413   HG12  VAL  54          HG12      VAL  54  84.230  15.421  13.530
  414   HG13  VAL  54          HG13      VAL  54  82.642  15.008  12.886
  415   HG21  VAL  54          HG21      VAL  54  81.885  18.006  14.902
  416   HG22  VAL  54          HG22      VAL  54  81.898  17.334  13.274
  417   HG23  VAL  54          HG23      VAL  54  83.409  17.817  14.037
  418    H    LYS  55           HN       LYS  55  79.337  17.085  14.761
  419    HA   LYS  55           HA       LYS  55  77.889  15.650  12.732
  420    HB2  LYS  55           HB2      LYS  55  77.223  17.679  14.326
  421    HB3  LYS  55           HB1      LYS  55  77.715  18.635  12.934
  422    HG2  LYS  55           HG2      LYS  55  75.339  18.205  12.813
  423    HG3  LYS  55           HG1      LYS  55  76.127  17.341  11.513
  424    HD2  LYS  55           HD2      LYS  55  75.612  15.268  12.395
  425    HD3  LYS  55           HD1      LYS  55  75.790  15.816  14.055
  426    HE2  LYS  55           HE2      LYS  55  73.603  16.621  14.172
  427    HE3  LYS  55           HE1      LYS  55  73.483  16.833  12.427
  428    HZ1  LYS  55           HZ1      LYS  55  72.432  14.772  13.754
  429    HZ2  LYS  55           HZ2      LYS  55  73.937  14.115  13.318
  430    HZ3  LYS  55           HZ3      LYS  55  72.886  14.708  12.122
  431    H    LYS  56           HN       LYS  56  80.746  15.923  12.092
  432    HA   LYS  56           HA       LYS  56  80.968  17.922   9.979
  433    HB2  LYS  56           HB2      LYS  56  82.961  17.156  11.235
  434    HB3  LYS  56           HB1      LYS  56  82.725  15.525  10.601
  435    HG2  LYS  56           HG2      LYS  56  83.337  16.141   8.422
  436    HG3  LYS  56           HG1      LYS  56  82.936  17.837   8.675
  437    HD2  LYS  56           HD2      LYS  56  85.346  17.645   8.587
  438    HD3  LYS  56           HD1      LYS  56  84.889  18.008  10.249
  439    HE2  LYS  56           HE2      LYS  56  85.233  15.151   9.346
  440    HE3  LYS  56           HE1      LYS  56  86.628  16.117   9.827
  441    HZ1  LYS  56           HZ1      LYS  56  85.939  15.095  11.779
  442    HZ2  LYS  56           HZ2      LYS  56  84.290  15.331  11.451
  443    HZ3  LYS  56           HZ3      LYS  56  85.267  16.648  11.894
  444    H    ASP  57           HN       ASP  57  81.593  17.150   7.712
  445    HA   ASP  57           HA       ASP  57  79.484  15.809   6.469
  446    HB2  ASP  57           HB2      ASP  57  81.293  15.325   4.646
  447    HB3  ASP  57           HB1      ASP  57  80.909  16.998   5.036
  448    H    TRP  58           HN       TRP  58  78.813  13.799   7.030
  449    HA   TRP  58           HA       TRP  58  80.835  11.659   7.546
  450    HB2  TRP  58           HB2      TRP  58  77.901  11.945   8.215
  451    HB3  TRP  58           HB1      TRP  58  78.768  10.438   8.404
  452    HD1  TRP  58           HD1      TRP  58  81.184  13.026   9.284
  453    HE1  TRP  58           HE1      TRP  58  81.272  13.381  11.826
  454    HE3  TRP  58           HE3      TRP  58  76.884  10.639  10.669
  455    HZ2  TRP  58           HZ2      TRP  58  79.697  12.748  14.151
  456    HZ3  TRP  58           HZ3      TRP  58  76.202  10.541  13.042
  457    HH2  TRP  58           HH2      TRP  58  77.607  11.595  14.786
  458    H    SER  59           HN       SER  59  77.530  11.113   6.514
  459    HA   SER  59           HA       SER  59  78.010   9.111   4.666
  460    HB2  SER  59           HB2      SER  59  75.767  10.165   5.403
  461    HB3  SER  59           HB1      SER  59  75.979  11.235   4.031
  462    HG   SER  59           HG       SER  59  74.802   9.301   3.537
  463    H    ASP  60           HN       ASP  60  77.924  12.603   3.912
  464    HA   ASP  60           HA       ASP  60  78.337  12.596   1.177
  465    HB2  ASP  60           HB2      ASP  60  78.185  14.691   2.367
  466    HB3  ASP  60           HB1      ASP  60  79.650  14.338   3.282
  467    H    HIS  61           HN       HIS  61  80.429  11.357   3.599
  468    HA   HIS  61           HA       HIS  61  82.783  11.307   1.852
  469    HB2  HIS  61           HB2      HIS  61  83.995  10.833   3.761
  470    HB3  HIS  61           HB1      HIS  61  82.583  11.531   4.541
  471    HD1  HIS  61           HD1      HIS  61  81.335  10.034   6.148
  472    HD2  HIS  61           HD2      HIS  61  83.880   7.856   3.667
  473    HE1  HIS  61           HE1      HIS  61  81.249   7.639   6.960
  474    H    ALA  62           HN       ALA  62  83.917   9.198   1.627
  475    HA   ALA  62           HA       ALA  62  82.471   6.718   1.800
  476    HB1  ALA  62           HB1      ALA  62  82.504   8.186  -0.834
  477    HB2  ALA  62           HB2      ALA  62  81.169   7.325  -0.066
  478    HB3  ALA  62           HB3      ALA  62  82.495   6.422  -0.798
  479    H    LEU  63           HN       LEU  63  83.897   4.936   1.154
  480    HA   LEU  63           HA       LEU  63  86.743   5.817   1.086
  481    HB2  LEU  63           HB2      LEU  63  85.779   2.963   1.286
  482    HB3  LEU  63           HB1      LEU  63  87.331   3.622   1.763
  483    HG   LEU  63           HG       LEU  63  86.095   3.258   3.762
  484   HD11  LEU  63          HD11      LEU  63  85.783   6.204   3.182
  485   HD12  LEU  63          HD12      LEU  63  87.344   5.439   3.477
  486   HD13  LEU  63          HD13      LEU  63  86.111   5.434   4.734
  487   HD21  LEU  63          HD21      LEU  63  83.822   5.087   3.158
  488   HD22  LEU  63          HD22      LEU  63  83.846   3.570   4.048
  489   HD23  LEU  63          HD23      LEU  63  83.796   3.550   2.292
  490    H    TRP  64           HN       TRP  64  88.165   5.178  -0.533
  491    HA   TRP  64           HA       TRP  64  86.999   3.835  -2.947
  492    HB2  TRP  64           HB2      TRP  64  87.173   5.742  -4.179
  493    HB3  TRP  64           HB1      TRP  64  87.570   6.603  -2.721
  494    HD1  TRP  64           HD1      TRP  64  89.734   4.249  -4.950
  495    HE1  TRP  64           HE1      TRP  64  91.911   5.497  -5.510
  496    HE3  TRP  64           HE3      TRP  64  88.801   8.728  -2.686
  497    HZ2  TRP  64           HZ2      TRP  64  93.078   8.070  -5.127
  498    HZ3  TRP  64           HZ3      TRP  64  90.455  10.570  -2.822
  499    HH2  TRP  64           HH2      TRP  64  92.591  10.247  -4.038
  500    H    TRP  65           HN       TRP  65  88.347   2.376  -3.871
  501    HA   TRP  65           HA       TRP  65  90.899   1.824  -2.481
  502    HB2  TRP  65           HB2      TRP  65  89.010   0.117  -2.958
  503    HB3  TRP  65           HB1      TRP  65  89.589   0.137  -4.615
  504    HD1  TRP  65           HD1      TRP  65  92.653   0.577  -2.820
  505    HE1  TRP  65           HE1      TRP  65  93.837  -1.653  -2.375
  506    HE3  TRP  65           HE3      TRP  65  88.806  -2.675  -3.685
  507    HZ2  TRP  65           HZ2      TRP  65  93.254  -4.442  -2.352
  508    HZ3  TRP  65           HZ3      TRP  65  89.159  -5.113  -3.448
  509    HH2  TRP  65           HH2      TRP  65  91.374  -6.004  -2.782
  510    H    GLU  66           HN       GLU  66  92.285   3.447  -3.510
  511    HA   GLU  66           HA       GLU  66  92.332   3.960  -6.293
  512    HB2  GLU  66           HB2      GLU  66  94.736   4.679  -5.918
  513    HB3  GLU  66           HB1      GLU  66  93.545   5.454  -4.878
  514    HG2  GLU  66           HG2      GLU  66  94.031   3.886  -3.098
  515    HG3  GLU  66           HG1      GLU  66  95.178   3.045  -4.125
  516    H    LYS  67           HN       LYS  67  93.526   1.155  -4.571
  517    HA   LYS  67           HA       LYS  67  95.437   0.319  -6.541
  518    HB2  LYS  67           HB2      LYS  67  93.632  -1.330  -4.786
  519    HB3  LYS  67           HB1      LYS  67  94.844  -2.016  -5.833
  520    HG2  LYS  67           HG2      LYS  67  95.392  -1.551  -3.299
  521    HG3  LYS  67           HG1      LYS  67  96.604  -1.316  -4.520
  522    HD2  LYS  67           HD2      LYS  67  96.215   1.072  -4.519
  523    HD3  LYS  67           HD1      LYS  67  94.859   0.879  -3.406
  524    HE2  LYS  67           HE2      LYS  67  96.850   1.577  -2.171
  525    HE3  LYS  67           HE1      LYS  67  96.403  -0.068  -1.718
  526    HZ1  LYS  67           HZ1      LYS  67  98.113  -0.143  -3.952
  527    HZ2  LYS  67           HZ2      LYS  67  98.366  -0.783  -2.399
  528    HZ3  LYS  67           HZ3      LYS  67  98.829   0.814  -2.749
  529    H    LYS  68           HN       LYS  68  92.121   0.782  -6.447
  530    HA   LYS  68           HA       LYS  68  91.658  -0.622  -9.041
  531    HB2  LYS  68           HB2      LYS  68  89.437  -0.285  -7.040
  532    HB3  LYS  68           HB1      LYS  68  89.636  -1.513  -8.286
  533    HG2  LYS  68           HG2      LYS  68  91.478  -1.386  -5.875
  534    HG3  LYS  68           HG1      LYS  68  89.950  -2.239  -5.841
  535    HD2  LYS  68           HD2      LYS  68  90.608  -3.704  -7.621
  536    HD3  LYS  68           HD1      LYS  68  92.046  -2.739  -7.956
  537    HE2  LYS  68           HE2      LYS  68  93.192  -3.572  -6.127
  538    HE3  LYS  68           HE1      LYS  68  91.734  -3.844  -5.184
  539    HZ1  LYS  68           HZ1      LYS  68  93.132  -5.746  -6.509
  540    HZ2  LYS  68           HZ2      LYS  68  91.856  -5.419  -7.582
  541    HZ3  LYS  68           HZ3      LYS  68  91.525  -5.896  -5.986
  542    H    ARG  69           HN       ARG  69  91.491   2.283  -7.240
  543    HA   ARG  69           HA       ARG  69  90.520   4.378  -7.697
  544    HB2  ARG  69           HB2      ARG  69  90.723   3.209 -10.496
  545    HB3  ARG  69           HB1      ARG  69  90.121   4.830 -10.190
  546    HG2  ARG  69           HG2      ARG  69  92.378   5.272 -10.573
  547    HG3  ARG  69           HG1      ARG  69  92.378   5.097  -8.822
  548    HD2  ARG  69           HD2      ARG  69  94.165   3.723  -9.466
  549    HD3  ARG  69           HD1      ARG  69  92.841   2.571  -9.332
  550    HE   ARG  69           HE       ARG  69  93.010   3.631 -12.011
  551   HH11  ARG  69          HH11      ARG  69  93.793   2.226 -13.604
  552   HH12  ARG  69          HH12      ARG  69  94.669   0.808 -13.133
  553   HH21  ARG  69          HH21      ARG  69  94.415   1.454  -9.736
  554   HH22  ARG  69          HH22      ARG  69  95.021   0.371 -10.944
  555    H    THR  70           HN       THR  70  88.846   2.475  -6.690
  556    HA   THR  70           HA       THR  70  86.309   2.746  -8.283
  557    HB   THR  70           HB       THR  70  87.312   0.445  -7.696
  558    HG1  THR  70           HG1      THR  70  85.173   0.749  -8.377
  559   HG21  THR  70          HG21      THR  70  87.198  -0.386  -5.531
  560   HG22  THR  70          HG22      THR  70  85.975   0.789  -5.044
  561   HG23  THR  70          HG23      THR  70  87.655   1.291  -5.229
  562    H    TRP  71           HN       TRP  71  84.447   2.316  -6.491
  563    HA   TRP  71           HA       TRP  71  84.848   4.232  -4.242
  564    HB2  TRP  71           HB2      TRP  71  82.177   4.453  -4.718
  565    HB3  TRP  71           HB1      TRP  71  83.356   5.530  -5.454
  566    HD1  TRP  71           HD1      TRP  71  81.764   2.095  -6.289
  567    HE1  TRP  71           HE1      TRP  71  81.403   1.968  -8.789
  568    HE3  TRP  71           HE3      TRP  71  83.728   6.598  -7.666
  569    HZ2  TRP  71           HZ2      TRP  71  81.865   3.563 -11.133
  570    HZ3  TRP  71           HZ3      TRP  71  83.750   7.268 -10.053
  571    HH2  TRP  71           HH2      TRP  71  82.822   5.758 -11.786
  572    H    LEU  72           HN       LEU  72  85.053   2.743  -2.630
  573    HA   LEU  72           HA       LEU  72  83.855   0.178  -2.707
  574    HB2  LEU  72           HB2      LEU  72  84.766   1.750  -0.309
  575    HB3  LEU  72           HB1      LEU  72  84.523   0.012  -0.358
  576    HG   LEU  72           HG       LEU  72  86.378   1.424  -2.274
  577   HD11  LEU  72          HD11      LEU  72  87.308   1.979  -0.185
  578   HD12  LEU  72          HD12      LEU  72  88.197   0.547  -0.710
  579   HD13  LEU  72          HD13      LEU  72  86.919   0.398   0.497
  580   HD21  LEU  72          HD21      LEU  72  85.638  -1.402  -1.718
  581   HD22  LEU  72          HD22      LEU  72  87.365  -1.116  -1.884
  582   HD23  LEU  72          HD23      LEU  72  86.269  -0.662  -3.187
  583    H    LEU  73           HN       LEU  73  81.722   0.446  -3.232
  584    HA   LEU  73           HA       LEU  73  79.920   1.374  -1.027
  585    HB2  LEU  73           HB2      LEU  73  78.201   1.782  -2.839
  586    HB3  LEU  73           HB1      LEU  73  79.574   2.881  -2.860
  587    HG   LEU  73           HG       LEU  73  80.567   1.115  -4.570
  588   HD11  LEU  73          HD11      LEU  73  78.707   0.271  -6.059
  589   HD12  LEU  73          HD12      LEU  73  77.595   0.618  -4.734
  590   HD13  LEU  73          HD13      LEU  73  78.876  -0.575  -4.524
  591   HD21  LEU  73          HD21      LEU  73  78.430   3.150  -5.207
  592   HD22  LEU  73          HD22      LEU  73  79.445   2.387  -6.432
  593   HD23  LEU  73          HD23      LEU  73  80.174   3.403  -5.192
  594    H    LYS  74           HN       LYS  74  81.188  -1.326  -2.182
  595    HA   LYS  74           HA       LYS  74  78.865  -2.923  -2.811
  596    HB2  LYS  74           HB2      LYS  74  81.289  -4.277  -1.670
  597    HB3  LYS  74           HB1      LYS  74  80.303  -4.724  -3.053
  598    HG2  LYS  74           HG2      LYS  74  82.266  -2.427  -2.985
  599    HG3  LYS  74           HG1      LYS  74  82.585  -3.998  -3.682
  600    HD2  LYS  74           HD2      LYS  74  81.446  -3.535  -5.605
  601    HD3  LYS  74           HD1      LYS  74  80.079  -2.857  -4.736
  602    HE2  LYS  74           HE2      LYS  74  80.857  -0.986  -5.866
  603    HE3  LYS  74           HE1      LYS  74  81.719  -0.825  -4.355
  604    HZ1  LYS  74           HZ1      LYS  74  83.521  -2.196  -5.491
  605    HZ2  LYS  74           HZ2      LYS  74  83.353  -0.572  -5.960
  606    HZ3  LYS  74           HZ3      LYS  74  82.728  -1.812  -6.940
  607    H    THR  75           HN       THR  75  78.405  -1.487  -0.317
  608    HA   THR  75           HA       THR  75  78.902  -3.079   1.981
  609    HB   THR  75           HB       THR  75  77.913  -1.130   2.709
  610    HG1  THR  75           HG1      THR  75  76.412  -2.203   3.694
  611   HG21  THR  75          HG21      THR  75  76.481  -1.223   0.074
  612   HG22  THR  75          HG22      THR  75  77.476   0.062   0.768
  613   HG23  THR  75          HG23      THR  75  75.842  -0.209   1.366
  614    H    HIS  76           HN       HIS  76  77.217  -3.908  -0.783
  615    HA   HIS  76           HA       HIS  76  75.017  -5.412   0.194
  616    HB2  HIS  76           HB2      HIS  76  75.561  -4.847  -2.231
  617    HB3  HIS  76           HB1      HIS  76  76.716  -6.179  -2.188
  618    HD1  HIS  76           HD1      HIS  76  73.092  -5.436  -2.427
  619    HD2  HIS  76           HD2      HIS  76  75.487  -8.782  -1.764
  620    HE1  HIS  76           HE1      HIS  76  71.596  -7.459  -2.724
  621    H    TRP  77           HN       TRP  77  77.913  -7.027  -1.124
  622    HA   TRP  77           HA       TRP  77  77.476  -9.262   0.737
  623    HB2  TRP  77           HB2      TRP  77  79.703  -8.816  -1.248
  624    HB3  TRP  77           HB1      TRP  77  79.382 -10.315  -0.392
  625    HD1  TRP  77           HD1      TRP  77  78.286  -8.245  -3.318
  626    HE1  TRP  77           HE1      TRP  77  76.480  -9.504  -4.625
  627    HE3  TRP  77           HE3      TRP  77  77.325 -12.054  -0.059
  628    HZ2  TRP  77           HZ2      TRP  77  74.823 -11.822  -4.346
  629    HZ3  TRP  77           HZ3      TRP  77  75.626 -13.774  -0.605
  630    HH2  TRP  77           HH2      TRP  77  74.374 -13.663  -2.743
  631    H    THR  78           HN       THR  78  80.810  -9.054   0.329
  632    HA   THR  78           HA       THR  78  81.248  -7.242   2.618
  633    HB   THR  78           HB       THR  78  82.478  -9.821   3.284
  634    HG1  THR  78           HG1      THR  78  80.550 -10.469   2.088
  635   HG21  THR  78          HG21      THR  78  82.245  -8.344   5.080
  636   HG22  THR  78          HG22      THR  78  80.906  -9.460   5.338
  637   HG23  THR  78          HG23      THR  78  80.600  -7.882   4.639
  638    H    LEU  79           HN       LEU  79  83.449  -6.706   2.883
  639    HA   LEU  79           HA       LEU  79  85.023  -6.467   0.638
  640    HB2  LEU  79           HB2      LEU  79  86.850  -6.035   2.035
  641    HB3  LEU  79           HB1      LEU  79  85.445  -5.349   2.732
  642    HG   LEU  79           HG       LEU  79  86.737  -7.910   3.558
  643   HD11  LEU  79          HD11      LEU  79  87.521  -6.728   5.488
  644   HD12  LEU  79          HD12      LEU  79  86.549  -5.315   5.078
  645   HD13  LEU  79          HD13      LEU  79  87.943  -5.746   4.083
  646   HD21  LEU  79          HD21      LEU  79  84.445  -8.169   4.175
  647   HD22  LEU  79          HD22      LEU  79  84.267  -6.448   4.476
  648   HD23  LEU  79          HD23      LEU  79  85.148  -7.450   5.623
  649    H    ASP  80           HN       ASP  80  85.194  -9.124   2.963
  650    HA   ASP  80           HA       ASP  80  87.219 -10.684   1.861
  651    HB2  ASP  80           HB2      ASP  80  85.570 -11.098   3.819
  652    HB3  ASP  80           HB1      ASP  80  84.558 -11.885   2.626
  653    H    LYS  81           HN       LYS  81  83.932 -10.178   0.704
  654    HA   LYS  81           HA       LYS  81  84.052 -12.252  -1.285
  655    HB2  LYS  81           HB2      LYS  81  81.839 -11.819  -1.356
  656    HB3  LYS  81           HB1      LYS  81  82.072 -10.390  -0.383
  657    HG2  LYS  81           HG2      LYS  81  82.555 -10.327  -3.360
  658    HG3  LYS  81           HG1      LYS  81  80.949 -10.146  -2.705
  659    HD2  LYS  81           HD2      LYS  81  81.925  -8.287  -1.244
  660    HD3  LYS  81           HD1      LYS  81  83.327  -8.358  -2.277
  661    HE2  LYS  81           HE2      LYS  81  81.702  -8.111  -4.245
  662    HE3  LYS  81           HE1      LYS  81  80.518  -7.639  -3.032
  663    HZ1  LYS  81           HZ1      LYS  81  81.768  -5.766  -4.048
  664    HZ2  LYS  81           HZ2      LYS  81  83.173  -6.361  -3.301
  665    HZ3  LYS  81           HZ3      LYS  81  81.864  -5.835  -2.357
  666    H    TYR  82           HN       TYR  82  85.087  -8.975  -1.102
  667    HA   TYR  82           HA       TYR  82  85.748  -8.857  -3.963
  668    HB2  TYR  82           HB2      TYR  82  85.226  -6.881  -2.224
  669    HB3  TYR  82           HB1      TYR  82  86.969  -6.948  -1.986
  670    HD1  TYR  82           HD1      TYR  82  88.244  -7.355  -4.434
  671    HD2  TYR  82           HD2      TYR  82  84.548  -5.266  -3.773
  672    HE1  TYR  82           HE1      TYR  82  88.576  -6.099  -6.542
  673    HE2  TYR  82           HE2      TYR  82  84.884  -4.008  -5.881
  674    HH   TYR  82           HH       TYR  82  87.652  -4.696  -8.008
  675    H    GLY  83           HN       GLY  83  87.561  -9.071  -0.867
  676    HA2  GLY  83           HA2      GLY  83  89.375 -10.882  -0.895
  677    HA3  GLY  83           HA1      GLY  83  89.873 -10.241  -2.460
  678    H    ILE  84           HN       ILE  84  88.809  -7.835  -0.431
  679    HA   ILE  84           HA       ILE  84  91.275  -6.430  -0.255
  680    HB   ILE  84           HB       ILE  84  88.709  -6.368   1.279
  681   HG12  ILE  84          HG12      ILE  84  89.634  -4.314  -0.704
  682   HG13  ILE  84          HG11      ILE  84  88.873  -5.808  -1.249
  683   HG21  ILE  84          HG21      ILE  84  90.403  -5.299   2.670
  684   HG22  ILE  84          HG22      ILE  84  89.262  -4.124   2.036
  685   HG23  ILE  84          HG23      ILE  84  90.867  -4.270   1.309
  686   HD11  ILE  84          HD11      ILE  84  87.583  -4.124   0.892
  687   HD12  ILE  84          HD12      ILE  84  86.842  -5.308  -0.181
  688   HD13  ILE  84          HD13      ILE  84  87.351  -3.746  -0.817
  689    H    GLN  85           HN       GLN  85  92.472  -5.969   1.797
  690    HA   GLN  85           HA       GLN  85  92.094  -7.700   4.092
  691    HB2  GLN  85           HB2      GLN  85  93.386  -9.000   2.105
  692    HB3  GLN  85           HB1      GLN  85  94.764  -8.171   2.816
  693    HG2  GLN  85           HG2      GLN  85  94.774 -10.094   4.126
  694    HG3  GLN  85           HG1      GLN  85  93.694  -9.095   5.098
  695   HE21  GLN  85          HE21      GLN  85  91.339  -9.224   3.607
  696   HE22  GLN  85          HE22      GLN  85  90.774 -10.816   3.574
  697    H    ALA  86           HN       ALA  86  94.576  -7.549   5.240
  698    HA   ALA  86           HA       ALA  86  94.733  -4.814   6.091
  699    HB1  ALA  86           HB1      ALA  86  96.794  -7.010   6.347
  700    HB2  ALA  86           HB2      ALA  86  95.428  -6.795   7.445
  701    HB3  ALA  86           HB3      ALA  86  96.684  -5.561   7.349
  702    H    ASP  87           HN       ASP  87  96.319  -6.645   3.599
  703    HA   ASP  87           HA       ASP  87  98.510  -4.770   3.219
  704    HB2  ASP  87           HB2      ASP  87  98.869  -7.023   2.550
  705    HB3  ASP  87           HB1      ASP  87  97.377  -7.072   1.630
  706    H    ALA  88           HN       ALA  88  95.233  -4.775   2.534
  707    HA   ALA  88           HA       ALA  88  95.445  -3.080   0.106
  708    HB1  ALA  88           HB1      ALA  88  93.737  -4.862   0.235
  709    HB2  ALA  88           HB2      ALA  88  92.985  -3.267   0.119
  710    HB3  ALA  88           HB3      ALA  88  93.075  -4.097   1.673
  711    H    LYS  89           HN       LYS  89  95.887  -0.929   0.571
  712    HA   LYS  89           HA       LYS  89  94.801   0.231   3.093
  713    HB2  LYS  89           HB2      LYS  89  96.580   1.724   1.178
  714    HB3  LYS  89           HB1      LYS  89  96.397   1.935   2.917
  715    HG2  LYS  89           HG2      LYS  89  97.605  -0.536   1.647
  716    HG3  LYS  89           HG1      LYS  89  98.538   0.834   2.208
  717    HD2  LYS  89           HD2      LYS  89  98.049   0.444   4.464
  718    HD3  LYS  89           HD1      LYS  89  96.615  -0.500   4.089
  719    HE2  LYS  89           HE2      LYS  89  98.445  -1.959   4.845
  720    HE3  LYS  89           HE1      LYS  89  97.997  -2.291   3.171
  721    HZ1  LYS  89           HZ1      LYS  89 100.448  -1.180   4.244
  722    HZ2  LYS  89           HZ2      LYS  89  99.861  -0.409   2.847
  723    HZ3  LYS  89           HZ3      LYS  89 100.191  -2.076   2.827
  724    H    LEU  90           HN       LEU  90  92.944   1.168   3.015
  725    HA   LEU  90           HA       LEU  90  91.889   2.263   0.466
  726    HB2  LEU  90           HB2      LEU  90  90.329   2.209   3.032
  727    HB3  LEU  90           HB1      LEU  90  89.752   2.044   1.376
  728    HG   LEU  90           HG       LEU  90  91.380   0.006   2.905
  729   HD11  LEU  90          HD11      LEU  90  89.199  -0.128   3.763
  730   HD12  LEU  90          HD12      LEU  90  89.195  -1.332   2.475
  731   HD13  LEU  90          HD13      LEU  90  88.463   0.249   2.207
  732   HD21  LEU  90          HD21      LEU  90  92.002  -0.226   0.626
  733   HD22  LEU  90          HD22      LEU  90  90.370   0.134   0.055
  734   HD23  LEU  90          HD23      LEU  90  90.714  -1.410   0.842
  735    H    GLN  91           HN       GLN  91  90.516   4.347   0.912
  736    HA   GLN  91           HA       GLN  91  91.986   6.210   2.721
  737    HB2  GLN  91           HB2      GLN  91  91.057   6.926  -0.072
  738    HB3  GLN  91           HB1      GLN  91  92.020   7.920   1.016
  739    HG2  GLN  91           HG2      GLN  91  93.958   6.649   0.668
  740    HG3  GLN  91           HG1      GLN  91  93.071   5.247   0.122
  741   HE21  GLN  91          HE21      GLN  91  91.851   8.129  -1.168
  742   HE22  GLN  91          HE22      GLN  91  92.586   8.025  -2.676
  743    H    PHE  92           HN       PHE  92  90.693   8.151   3.188
  744    HA   PHE  92           HA       PHE  92  87.739   7.713   2.885
  745    HB2  PHE  92           HB2      PHE  92  88.257   7.268   5.173
  746    HB3  PHE  92           HB1      PHE  92  89.363   8.617   5.276
  747    HD1  PHE  92           HD1      PHE  92  88.322  11.027   4.970
  748    HD2  PHE  92           HD2      PHE  92  86.021   7.500   5.824
  749    HE1  PHE  92           HE1      PHE  92  86.483  12.435   5.826
  750    HE2  PHE  92           HE2      PHE  92  84.191   8.917   6.696
  751    HZ   PHE  92           HZ       PHE  92  84.414  11.382   6.688
  752    H    THR  93           HN       THR  93  86.795   9.363   1.813
  753    HA   THR  93           HA       THR  93  88.006  12.090   1.982
  754    HB   THR  93           HB       THR  93  88.919  11.275  -0.072
  755    HG1  THR  93           HG1      THR  93  88.180  12.852  -1.242
  756   HG21  THR  93          HG21      THR  93  87.742   9.258  -0.447
  757   HG22  THR  93          HG22      THR  93  87.294  10.285  -1.809
  758   HG23  THR  93          HG23      THR  93  86.178  10.075  -0.459
  759    HA   PRO  94           HA       PRO  94  83.746  13.230   2.543
  760    HB2  PRO  94           HB2      PRO  94  83.731  15.776   1.445
  761    HB3  PRO  94           HB1      PRO  94  84.388  15.390   3.049
  762    HG2  PRO  94           HG2      PRO  94  85.829  15.728   0.452
  763    HG3  PRO  94           HG1      PRO  94  86.267  16.315   2.068
  764    HD2  PRO  94           HD2      PRO  94  87.436  14.125   1.014
  765    HD3  PRO  94           HD1      PRO  94  87.077  14.232   2.751
  766    H    TYR 541           HT1      TYR 541  52.379  38.525   9.873
  767    HA   TYR 541           HA       TYR 541  53.728  38.399  11.648
  768    HB2  TYR 541           HB2      TYR 541  52.896  40.709  12.333
  769    HB3  TYR 541           HB1      TYR 541  51.696  39.885  13.329
  770    HD1  TYR 541           HD1      TYR 541  52.261  39.317  15.534
  771    HD2  TYR 541           HD2      TYR 541  55.386  39.868  12.636
  772    HE1  TYR 541           HE1      TYR 541  53.963  39.005  17.309
  773    HE2  TYR 541           HE2      TYR 541  57.088  39.555  14.414
  774    HH   TYR 541           HH       TYR 541  56.213  39.414  17.790
  775    H    HIS 542           HN       HIS 542  51.969  36.384  10.912
  776    HA   HIS 542           HA       HIS 542  51.653  34.980  13.473
  777    HB2  HIS 542           HB2      HIS 542  49.448  36.356  12.426
  778    HB3  HIS 542           HB1      HIS 542  49.170  34.708  11.888
  779    HD1  HIS 542           HD1      HIS 542  48.747  36.870  14.767
  780    HD2  HIS 542           HD2      HIS 542  49.341  32.783  14.201
  781    HE1  HIS 542           HE1      HIS 542  48.059  35.741  16.927
  782    H    GLU 543           HN       GLU 543  50.224  34.492  10.241
  783    HA   GLU 543           HA       GLU 543  51.886  31.999   9.959
  784    HB2  GLU 543           HB2      GLU 543  49.954  31.123   8.609
  785    HB3  GLU 543           HB1      GLU 543  49.564  31.390  10.309
  786    HG2  GLU 543           HG2      GLU 543  48.536  33.545   9.768
  787    HG3  GLU 543           HG1      GLU 543  48.983  33.354   8.072
  788    H    ARG 544           HN       ARG 544  51.223  35.063   8.717
  789    HA   ARG 544           HA       ARG 544  51.268  34.766   5.934
  790    HB2  ARG 544           HB2      ARG 544  52.917  36.851   7.379
  791    HB3  ARG 544           HB1      ARG 544  52.118  36.992   5.814
  792    HG2  ARG 544           HG2      ARG 544  50.751  36.731   8.503
  793    HG3  ARG 544           HG1      ARG 544  50.818  38.180   7.512
  794    HD2  ARG 544           HD2      ARG 544  49.764  36.545   5.678
  795    HD3  ARG 544           HD1      ARG 544  49.202  35.689   7.109
  796    HE   ARG 544           HE       ARG 544  48.033  38.037   6.044
  797   HH11  ARG 544          HH11      ARG 544  46.887  39.545   7.244
  798   HH12  ARG 544          HH12      ARG 544  47.015  39.542   8.971
  799   HH21  ARG 544          HH21      ARG 544  49.183  36.851   9.078
  800   HH22  ARG 544          HH22      ARG 544  48.319  38.027  10.004
  801    H    ARG 545           HN       ARG 545  54.066  34.846   8.161
  802    HA   ARG 545           HA       ARG 545  56.101  34.574   6.237
  803    HB2  ARG 545           HB2      ARG 545  55.850  33.693   9.117
  804    HB3  ARG 545           HB1      ARG 545  57.320  33.414   8.192
  805    HG2  ARG 545           HG2      ARG 545  57.595  35.497   9.371
  806    HG3  ARG 545           HG1      ARG 545  57.377  35.858   7.665
  807    HD2  ARG 545           HD2      ARG 545  55.160  36.601   7.974
  808    HD3  ARG 545           HD1      ARG 545  55.033  35.835   9.558
  809    HE   ARG 545           HE       ARG 545  57.081  37.679   9.867
  810   HH11  ARG 545          HH11      ARG 545  56.717  39.810  10.526
  811   HH12  ARG 545          HH12      ARG 545  55.166  40.532  10.258
  812   HH21  ARG 545          HH21      ARG 545  53.819  37.713   8.752
  813   HH22  ARG 545          HH22      ARG 545  53.524  39.344   9.254
  814    H    GLY 546           HN       GLY 546  56.405  31.850   8.182
  815    HA2  GLY 546           HA2      GLY 546  55.430  30.022   6.000
  816    HA3  GLY 546           HA1      GLY 546  57.017  29.818   6.734
  817    H    SER 547           HN       SER 547  57.106  29.158   9.005
  818    HA   SER 547           HA       SER 547  54.719  28.442  10.473
  819    HB2  SER 547           HB2      SER 547  56.020  26.433   8.678
  820    HB3  SER 547           HB1      SER 547  55.473  25.870  10.255
  821    HG   SER 547           HG       SER 547  54.026  26.825   8.067
  822    H    LEU 548           HN       LEU 548  55.482  28.661  12.554
  823    HA   LEU 548           HA       LEU 548  58.229  28.838  13.169
  824    HB2  LEU 548           HB2      LEU 548  55.702  28.703  14.700
  825    HB3  LEU 548           HB1      LEU 548  57.115  28.163  15.598
  826    HG   LEU 548           HG       LEU 548  58.258  30.326  14.871
  827   HD11  LEU 548          HD11      LEU 548  57.000  31.053  13.022
  828   HD12  LEU 548          HD12      LEU 548  56.537  32.162  14.305
  829   HD13  LEU 548          HD13      LEU 548  55.467  30.835  13.857
  830   HD21  LEU 548          HD21      LEU 548  57.059  29.899  17.107
  831   HD22  LEU 548          HD22      LEU 548  55.746  30.866  16.438
  832   HD23  LEU 548          HD23      LEU 548  57.350  31.574  16.643
  833    H    CYS 549           HN       CYS 549  59.779  27.400  13.757
  834    HA   CYS 549           HA       CYS 549  59.147  24.534  13.469
  835    HB2  CYS 549           HB2      CYS 549  61.240  25.090  12.521
  836    HB3  CYS 549           HB1      CYS 549  61.633  26.207  13.814
  837    H    SER 550           HN       SER 550  58.048  23.853  15.240
  838    HA   SER 550           HA       SER 550  58.117  24.915  17.813
  839    HB2  SER 550           HB2      SER 550  56.387  23.398  17.325
  840    HB3  SER 550           HB1      SER 550  57.506  22.105  16.907
  841    HG   SER 550           HG       SER 550  56.568  22.909  19.344
  842    H    GLY 551           HN       GLY 551  59.524  24.976  19.342
  843    HA2  GLY 551           HA2      GLY 551  61.210  23.868  20.795
  844    HA3  GLY 551           HA1      GLY 551  61.836  23.067  19.346
  845    H    CYS 552           HN       CYS 552  61.451  25.341  17.663
  846    HA   CYS 552           HA       CYS 552  63.734  27.059  18.543
  847    HB2  CYS 552           HB2      CYS 552  62.631  26.137  15.899
  848    HB3  CYS 552           HB1      CYS 552  63.555  27.626  15.981
  849    H    GLN 553           HN       GLN 553  60.481  26.917  17.253
  850    HA   GLN 553           HA       GLN 553  58.844  28.487  17.001
  851    HB2  GLN 553           HB2      GLN 553  60.254  29.694  19.362
  852    HB3  GLN 553           HB1      GLN 553  58.681  30.226  18.763
  853    HG2  GLN 553           HG2      GLN 553  59.302  27.376  19.541
  854    HG3  GLN 553           HG1      GLN 553  58.542  28.530  20.619
  855   HE21  GLN 553          HE21      GLN 553  58.101  26.752  17.588
  856   HE22  GLN 553          HE22      GLN 553  56.409  26.882  17.547
  857    H    LYS 554           HN       LYS 554  60.413  28.736  15.133
  858    HA   LYS 554           HA       LYS 554  60.653  31.643  14.623
  859    HB2  LYS 554           HB2      LYS 554  62.797  29.618  13.936
  860    HB3  LYS 554           HB1      LYS 554  62.799  31.295  13.413
  861    HG2  LYS 554           HG2      LYS 554  62.768  30.426  16.313
  862    HG3  LYS 554           HG1      LYS 554  64.231  30.854  15.434
  863    HD2  LYS 554           HD2      LYS 554  62.946  33.079  14.892
  864    HD3  LYS 554           HD1      LYS 554  61.936  32.621  16.260
  865    HE2  LYS 554           HE2      LYS 554  63.684  34.018  17.130
  866    HE3  LYS 554           HE1      LYS 554  64.057  32.365  17.618
  867    HZ1  LYS 554           HZ1      LYS 554  65.281  32.493  15.254
  868    HZ2  LYS 554           HZ2      LYS 554  66.044  32.849  16.730
  869    HZ3  LYS 554           HZ3      LYS 554  65.440  34.104  15.758
  870    HA   PRO 555           HA       PRO 555  58.041  30.090  11.253
  871    HB2  PRO 555           HB2      PRO 555  59.283  32.279   9.688
  872    HB3  PRO 555           HB1      PRO 555  57.576  31.898   9.939
  873    HG2  PRO 555           HG2      PRO 555  58.873  33.958  11.220
  874    HG3  PRO 555           HG1      PRO 555  57.452  33.142  11.878
  875    HD2  PRO 555           HD2      PRO 555  60.240  33.030  12.833
  876    HD3  PRO 555           HD1      PRO 555  58.758  32.479  13.654
  877    H    ILE 556           HN       ILE 556  58.316  28.585   9.775
  878    HA   ILE 556           HA       ILE 556  61.035  27.967   8.756
  879    HB   ILE 556           HB       ILE 556  58.390  26.467   8.761
  880   HG12  ILE 556          HG12      ILE 556  60.945  25.585  10.099
  881   HG13  ILE 556          HG11      ILE 556  59.934  26.765  10.902
  882   HG21  ILE 556          HG21      ILE 556  59.512  25.790   6.778
  883   HG22  ILE 556          HG22      ILE 556  59.857  24.554   7.984
  884   HG23  ILE 556          HG23      ILE 556  61.080  25.756   7.587
  885   HD11  ILE 556          HD11      ILE 556  58.516  24.361   9.843
  886   HD12  ILE 556          HD12      ILE 556  58.274  25.237  11.354
  887   HD13  ILE 556          HD13      ILE 556  59.600  24.090  11.205
  888    H    THR 557           HN       THR 557  61.297  29.435   7.027
  889    HA   THR 557           HA       THR 557  59.108  29.644   5.016
  890    HB   THR 557           HB       THR 557  60.091  31.663   4.342
  891    HG1  THR 557           HG1      THR 557  62.379  30.378   5.150
  892   HG21  THR 557          HG21      THR 557  59.203  31.561   6.732
  893   HG22  THR 557          HG22      THR 557  60.303  32.897   6.380
  894   HG23  THR 557          HG23      THR 557  60.886  31.478   7.252
  895    H    GLY 558           HN       GLY 558  59.359  27.690   3.948
  896    HA2  GLY 558           HA2      GLY 558  60.697  27.501   1.589
  897    HA3  GLY 558           HA1      GLY 558  61.912  26.919   2.736
  898    H    ARG 559           HN       ARG 559  61.604  24.958   3.745
  899    HA   ARG 559           HA       ARG 559  59.263  23.310   2.868
  900    HB2  ARG 559           HB2      ARG 559  62.182  22.694   3.309
  901    HB3  ARG 559           HB1      ARG 559  60.996  21.415   3.570
  902    HG2  ARG 559           HG2      ARG 559  60.903  23.040   1.038
  903    HG3  ARG 559           HG1      ARG 559  62.078  21.746   1.184
  904    HD2  ARG 559           HD2      ARG 559  60.437  20.086   1.359
  905    HD3  ARG 559           HD1      ARG 559  59.187  21.213   1.867
  906    HE   ARG 559           HE       ARG 559  59.813  20.400  -0.833
  907   HH11  ARG 559          HH11      ARG 559  59.151  21.560  -2.629
  908   HH12  ARG 559          HH12      ARG 559  58.569  23.179  -2.437
  909   HH21  ARG 559          HH21      ARG 559  58.980  23.209   1.001
  910   HH22  ARG 559          HH22      ARG 559  58.473  24.111  -0.389
  911    H    CYS 560           HN       CYS 560  58.342  21.962   4.568
  912    HA   CYS 560           HA       CYS 560  59.340  22.489   7.307
  913    HB2  CYS 560           HB2      CYS 560  57.057  23.059   8.100
  914    HB3  CYS 560           HB1      CYS 560  57.742  24.271   7.010
  915    HG   CYS 560           HG       CYS 560  55.828  22.104   5.830
  916    H    ILE 561           HN       ILE 561  59.393  20.749   8.454
  917    HA   ILE 561           HA       ILE 561  57.931  18.342   7.576
  918    HB   ILE 561           HB       ILE 561  59.987  18.832   9.753
  919   HG12  ILE 561          HG12      ILE 561  60.083  17.568   7.020
  920   HG13  ILE 561          HG11      ILE 561  60.832  19.086   7.483
  921   HG21  ILE 561          HG21      ILE 561  60.103  16.438  10.037
  922   HG22  ILE 561          HG22      ILE 561  58.977  16.168   8.707
  923   HG23  ILE 561          HG23      ILE 561  58.406  16.887  10.218
  924   HD11  ILE 561          HD11      ILE 561  62.120  17.768   9.231
  925   HD12  ILE 561          HD12      ILE 561  62.576  17.456   7.555
  926   HD13  ILE 561          HD13      ILE 561  61.553  16.307   8.423
  927    H    THR 562           HN       THR 562  56.442  17.367   8.881
  928    HA   THR 562           HA       THR 562  55.422  18.974  11.189
  929    HB   THR 562           HB       THR 562  53.687  17.164   9.525
  930    HG1  THR 562           HG1      THR 562  54.550  19.776   9.076
  931   HG21  THR 562          HG21      THR 562  53.021  19.559  11.246
  932   HG22  THR 562          HG22      THR 562  53.027  17.901  11.857
  933   HG23  THR 562          HG23      THR 562  51.895  18.371  10.585
  934    H    ALA 563           HN       ALA 563  54.754  17.884  12.980
  935    HA   ALA 563           HA       ALA 563  55.500  14.993  13.133
  936    HB1  ALA 563           HB1      ALA 563  56.385  15.421  15.335
  937    HB2  ALA 563           HB2      ALA 563  55.794  17.085  15.290
  938    HB3  ALA 563           HB3      ALA 563  57.106  16.587  14.216
  939    H    MET 564           HN       MET 564  54.589  15.715  16.065
  940    HA   MET 564           HA       MET 564  52.023  14.452  15.926
  941    HB2  MET 564           HB2      MET 564  52.879  16.224  18.204
  942    HB3  MET 564           HB1      MET 564  52.002  14.693  18.256
  943    HG2  MET 564           HG2      MET 564  54.152  13.635  17.302
  944    HG3  MET 564           HG1      MET 564  54.935  15.154  17.730
  945    HE1  MET 564           HE1      MET 564  52.604  12.423  18.833
  946    HE2  MET 564           HE2      MET 564  53.173  11.934  20.427
  947    HE3  MET 564           HE3      MET 564  54.178  11.636  19.011
  948    H    ALA 565           HN       ALA 565  52.483  16.902  14.378
  949    HA   ALA 565           HA       ALA 565  50.724  18.333  13.515
  950    HB1  ALA 565           HB1      ALA 565  49.184  17.803  15.482
  951    HB2  ALA 565           HB2      ALA 565  49.194  19.482  14.956
  952    HB3  ALA 565           HB3      ALA 565  50.088  19.014  16.398
  953    H    LYS 566           HN       LYS 566  53.320  18.422  15.587
  954    HA   LYS 566           HA       LYS 566  53.655  21.343  15.649
  955    HB2  LYS 566           HB2      LYS 566  55.138  18.938  16.621
  956    HB3  LYS 566           HB1      LYS 566  56.116  20.361  16.289
  957    HG2  LYS 566           HG2      LYS 566  54.938  21.679  17.867
  958    HG3  LYS 566           HG1      LYS 566  53.617  20.520  17.976
  959    HD2  LYS 566           HD2      LYS 566  56.393  19.601  18.696
  960    HD3  LYS 566           HD1      LYS 566  55.514  20.602  19.844
  961    HE2  LYS 566           HE2      LYS 566  53.825  19.000  20.150
  962    HE3  LYS 566           HE1      LYS 566  54.147  18.216  18.598
  963    HZ1  LYS 566           HZ1      LYS 566  56.457  18.128  20.222
  964    HZ2  LYS 566           HZ2      LYS 566  55.548  16.840  19.590
  965    HZ3  LYS 566           HZ3      LYS 566  55.140  17.513  21.095
  966    H    LYS 567           HN       LYS 567  55.608  22.319  14.600
  967    HA   LYS 567           HA       LYS 567  56.076  21.102  11.906
  968    HB2  LYS 567           HB2      LYS 567  56.771  23.923  12.654
  969    HB3  LYS 567           HB1      LYS 567  56.351  23.280  11.079
  970    HG2  LYS 567           HG2      LYS 567  54.450  23.639  13.425
  971    HG3  LYS 567           HG1      LYS 567  54.502  24.630  11.979
  972    HD2  LYS 567           HD2      LYS 567  53.868  21.647  11.999
  973    HD3  LYS 567           HD1      LYS 567  52.680  22.945  11.880
  974    HE2  LYS 567           HE2      LYS 567  54.048  23.759   9.842
  975    HE3  LYS 567           HE1      LYS 567  54.785  22.159   9.883
  976    HZ1  LYS 567           HZ1      LYS 567  51.957  22.012  10.138
  977    HZ2  LYS 567           HZ2      LYS 567  52.978  21.254   9.011
  978    HZ3  LYS 567           HZ3      LYS 567  52.399  22.824   8.716
  979    H    PHE 568           HN       PHE 568  58.442  21.781  11.098
  980    HA   PHE 568           HA       PHE 568  60.387  21.892  13.309
  981    HB2  PHE 568           HB2      PHE 568  59.597  19.345  12.003
  982    HB3  PHE 568           HB1      PHE 568  61.330  19.576  12.094
  983    HD1  PHE 568           HD1      PHE 568  58.262  18.918  13.959
  984    HD2  PHE 568           HD2      PHE 568  62.425  19.916  14.320
  985    HE1  PHE 568           HE1      PHE 568  58.213  18.259  16.350
  986    HE2  PHE 568           HE2      PHE 568  62.375  19.257  16.710
  987    HZ   PHE 568           HZ       PHE 568  60.270  18.429  17.725
  988    H    HIS 569           HN       HIS 569  62.216  22.858  12.584
  989    HA   HIS 569           HA       HIS 569  62.524  23.869   9.963
  990    HB2  HIS 569           HB2      HIS 569  64.429  23.245  12.187
  991    HB3  HIS 569           HB1      HIS 569  65.087  23.697  10.627
  992    HD2  HIS 569           HD2      HIS 569  63.650  26.310   9.753
  993    HE1  HIS 569           HE1      HIS 569  63.945  27.649  13.738
  994    HA   PRO 570           HA       PRO 570  62.952  19.676   8.179
  995    HB2  PRO 570           HB2      PRO 570  64.175  21.190   5.915
  996    HB3  PRO 570           HB1      PRO 570  62.853  20.013   5.894
  997    HG2  PRO 570           HG2      PRO 570  62.452  22.708   5.623
  998    HG3  PRO 570           HG1      PRO 570  61.247  21.613   6.309
  999    HD2  PRO 570           HD2      PRO 570  62.893  23.655   7.684
 1000    HD3  PRO 570           HD1      PRO 570  61.390  22.872   8.223
 1001    H    GLU 571           HN       GLU 571  65.309  22.048   8.870
 1002    HA   GLU 571           HA       GLU 571  67.609  20.343   8.195
 1003    HB2  GLU 571           HB2      GLU 571  67.792  22.955   9.678
 1004    HB3  GLU 571           HB1      GLU 571  68.931  22.240   8.539
 1005    HG2  GLU 571           HG2      GLU 571  67.159  22.518   6.753
 1006    HG3  GLU 571           HG1      GLU 571  66.240  23.461   7.932
 1007    H    HIS 572           HN       HIS 572  66.320  21.979  11.077
 1008    HA   HIS 572           HA       HIS 572  68.108  20.764  12.928
 1009    HB2  HIS 572           HB2      HIS 572  65.268  21.653  13.525
 1010    HB3  HIS 572           HB1      HIS 572  66.610  21.550  14.666
 1011    HD2  HIS 572           HD2      HIS 572  68.680  22.893  12.194
 1012    HE1  HIS 572           HE1      HIS 572  66.506  26.379  13.113
 1013    H    PHE 573           HN       PHE 573  65.806  19.264  11.050
 1014    HA   PHE 573           HA       PHE 573  65.779  16.896  12.907
 1015    HB2  PHE 573           HB2      PHE 573  63.524  18.119  12.612
 1016    HB3  PHE 573           HB1      PHE 573  63.566  17.523  10.959
 1017    HD1  PHE 573           HD1      PHE 573  63.701  16.427  14.518
 1018    HD2  PHE 573           HD2      PHE 573  62.982  15.277  10.442
 1019    HE1  PHE 573           HE1      PHE 573  62.880  14.216  15.286
 1020    HE2  PHE 573           HE2      PHE 573  62.160  13.067  11.210
 1021    HZ   PHE 573           HZ       PHE 573  62.109  12.536  13.632
 1022    H    VAL 574           HN       VAL 574  67.815  17.083  11.276
 1023    HA   VAL 574           HA       VAL 574  67.233  15.889   8.652
 1024    HB   VAL 574           HB       VAL 574  69.712  16.103   8.339
 1025   HG11  VAL 574          HG11      VAL 574  69.370  18.833   8.831
 1026   HG12  VAL 574          HG12      VAL 574  67.721  18.230   8.641
 1027   HG13  VAL 574          HG13      VAL 574  68.905  17.983   7.373
 1028   HG21  VAL 574          HG21      VAL 574  70.304  15.963  10.746
 1029   HG22  VAL 574          HG22      VAL 574  69.514  17.521  11.026
 1030   HG23  VAL 574          HG23      VAL 574  70.951  17.430  10.011
 1031    H    CYS 575           HN       CYS 575  68.983  14.164   7.994
 1032    HA   CYS 575           HA       CYS 575  68.758  11.862   9.816
 1033    HB2  CYS 575           HB2      CYS 575  68.699  10.879   7.765
 1034    HB3  CYS 575           HB1      CYS 575  69.340  12.326   6.998
 1035    H    ALA 576           HN       ALA 576  70.571  10.938  10.991
 1036    HA   ALA 576           HA       ALA 576  72.871  12.864  11.127
 1037    HB1  ALA 576           HB1      ALA 576  72.694  10.293  12.708
 1038    HB2  ALA 576           HB2      ALA 576  71.684  11.669  13.154
 1039    HB3  ALA 576           HB3      ALA 576  73.442  11.828  13.156
 1040    H    PHE 577           HN       PHE 577  73.306  12.222   8.856
 1041    HA   PHE 577           HA       PHE 577  75.618  10.540   8.770
 1042    HB2  PHE 577           HB2      PHE 577  73.335   9.135   8.110
 1043    HB3  PHE 577           HB1      PHE 577  73.829   9.722   6.538
 1044    HD1  PHE 577           HD1      PHE 577  74.939   7.984   5.370
 1045    HD2  PHE 577           HD2      PHE 577  75.804   8.501   9.560
 1046    HE1  PHE 577           HE1      PHE 577  76.672   6.235   5.240
 1047    HE2  PHE 577           HE2      PHE 577  77.525   6.746   9.409
 1048    HZ   PHE 577           HZ       PHE 577  77.959   5.608   7.259
 1049    H    CYS 578           HN       CYS 578  73.196  12.433   7.313
 1050    HA   CYS 578           HA       CYS 578  75.220  14.074   5.890
 1051    HB2  CYS 578           HB2      CYS 578  73.761  14.213   3.928
 1052    HB3  CYS 578           HB1      CYS 578  74.137  12.533   4.233
 1053    H    LEU 579           HN       LEU 579  74.899  15.352   7.776
 1054    HA   LEU 579           HA       LEU 579  72.545  16.179   8.929
 1055    HB2  LEU 579           HB2      LEU 579  74.107  18.450   9.221
 1056    HB3  LEU 579           HB1      LEU 579  74.192  17.027  10.238
 1057    HG   LEU 579           HG       LEU 579  76.388  17.901   9.285
 1058   HD11  LEU 579          HD11      LEU 579  75.464  15.177   9.638
 1059   HD12  LEU 579          HD12      LEU 579  77.041  15.880   9.988
 1060   HD13  LEU 579          HD13      LEU 579  76.708  15.232   8.387
 1061   HD21  LEU 579          HD21      LEU 579  75.086  17.872   6.853
 1062   HD22  LEU 579          HD22      LEU 579  76.046  16.396   6.769
 1063   HD23  LEU 579          HD23      LEU 579  76.828  17.940   7.075
 1064    H    LYS 580           HN       LYS 580  72.673  16.594   5.698
 1065    HA   LYS 580           HA       LYS 580  71.853  19.463   5.762
 1066    HB2  LYS 580           HB2      LYS 580  72.360  19.571   3.524
 1067    HB3  LYS 580           HB1      LYS 580  73.389  18.223   3.973
 1068    HG2  LYS 580           HG2      LYS 580  70.593  17.882   2.799
 1069    HG3  LYS 580           HG1      LYS 580  72.070  17.876   1.855
 1070    HD2  LYS 580           HD2      LYS 580  72.809  15.862   2.725
 1071    HD3  LYS 580           HD1      LYS 580  71.882  16.028   4.216
 1072    HE2  LYS 580           HE2      LYS 580  71.055  14.310   2.465
 1073    HE3  LYS 580           HE1      LYS 580  69.872  15.406   3.176
 1074    HZ1  LYS 580           HZ1      LYS 580  69.413  15.644   0.967
 1075    HZ2  LYS 580           HZ2      LYS 580  71.023  15.405   0.479
 1076    HZ3  LYS 580           HZ3      LYS 580  70.549  16.888   1.161
 1077    H    GLN 581           HN       GLN 581  70.261  16.283   4.956
 1078    HA   GLN 581           HA       GLN 581  67.765  17.624   5.585
 1079    HB2  GLN 581           HB2      GLN 581  68.278  18.347   3.249
 1080    HB3  GLN 581           HB1      GLN 581  67.966  16.686   2.748
 1081    HG2  GLN 581           HG2      GLN 581  65.885  17.821   2.501
 1082    HG3  GLN 581           HG1      GLN 581  65.726  16.920   3.997
 1083   HE21  GLN 581          HE21      GLN 581  66.161  18.187   6.051
 1084   HE22  GLN 581          HE22      GLN 581  65.824  19.842   6.051
 1085    H    LEU 582           HN       LEU 582  66.119  16.430   6.108
 1086    HA   LEU 582           HA       LEU 582  66.077  13.541   5.416
 1087    HB2  LEU 582           HB2      LEU 582  66.954  13.959   7.751
 1088    HB3  LEU 582           HB1      LEU 582  65.378  14.612   8.154
 1089    HG   LEU 582           HG       LEU 582  64.347  12.441   7.608
 1090   HD11  LEU 582          HD11      LEU 582  66.295  10.548   7.428
 1091   HD12  LEU 582          HD12      LEU 582  67.090  11.885   6.601
 1092   HD13  LEU 582          HD13      LEU 582  65.545  11.290   6.015
 1093   HD21  LEU 582          HD21      LEU 582  64.863  12.577   9.883
 1094   HD22  LEU 582          HD22      LEU 582  66.603  12.579   9.605
 1095   HD23  LEU 582          HD23      LEU 582  65.682  11.087   9.419
 1096    H    ASN 583           HN       ASN 583  63.770  12.678   5.933
 1097    HA   ASN 583           HA       ASN 583  61.683  14.802   5.766
 1098    HB2  ASN 583           HB2      ASN 583  62.266  12.714   3.657
 1099    HB3  ASN 583           HB1      ASN 583  60.647  13.379   3.842
 1100   HD21  ASN 583          HD21      ASN 583  61.932  13.866   1.459
 1101   HD22  ASN 583          HD22      ASN 583  62.420  15.485   1.374
 1102    H    LYS 584           HN       LYS 584  59.981  14.237   7.024
 1103    HA   LYS 584           HA       LYS 584  59.920  11.961   8.663
 1104    HB2  LYS 584           HB2      LYS 584  57.508  12.493   8.955
 1105    HB3  LYS 584           HB1      LYS 584  58.541  13.912   9.108
 1106    HG2  LYS 584           HG2      LYS 584  57.569  14.939   7.304
 1107    HG3  LYS 584           HG1      LYS 584  57.735  13.500   6.299
 1108    HD2  LYS 584           HD2      LYS 584  55.392  13.973   6.486
 1109    HD3  LYS 584           HD1      LYS 584  55.718  12.558   7.482
 1110    HE2  LYS 584           HE2      LYS 584  54.283  14.103   8.719
 1111    HE3  LYS 584           HE1      LYS 584  55.869  14.041   9.482
 1112    HZ1  LYS 584           HZ1      LYS 584  54.545  16.237   8.218
 1113    HZ2  LYS 584           HZ2      LYS 584  56.113  15.999   7.608
 1114    HZ3  LYS 584           HZ3      LYS 584  55.873  16.240   9.273
 1115    H    GLY 585           HN       GLY 585  59.217  12.255   5.333
 1116    HA2  GLY 585           HA2      GLY 585  57.489   9.865   5.235
 1117    HA3  GLY 585           HA1      GLY 585  57.959  10.876   3.868
 1118    H    THR 586           HN       THR 586  60.757  10.734   5.048
 1119    HA   THR 586           HA       THR 586  61.491   7.953   4.248
 1120    HB   THR 586           HB       THR 586  63.088   8.684   2.694
 1121    HG1  THR 586           HG1      THR 586  64.059  10.234   4.022
 1122   HG21  THR 586          HG21      THR 586  60.948  10.825   2.512
 1123   HG22  THR 586          HG22      THR 586  60.721   9.158   1.981
 1124   HG23  THR 586          HG23      THR 586  61.919  10.181   1.185
 1125    H    PHE 587           HN       PHE 587  61.264   9.419   6.835
 1126    HA   PHE 587           HA       PHE 587  64.103   9.741   7.618
 1127    HB2  PHE 587           HB2      PHE 587  63.376  10.719   9.599
 1128    HB3  PHE 587           HB1      PHE 587  62.141  11.217   8.459
 1129    HD1  PHE 587           HD1      PHE 587  62.517  10.159  11.698
 1130    HD2  PHE 587           HD2      PHE 587  60.243   9.157   8.193
 1131    HE1  PHE 587           HE1      PHE 587  60.775   9.116  13.120
 1132    HE2  PHE 587           HE2      PHE 587  58.506   8.116   9.616
 1133    HZ   PHE 587           HZ       PHE 587  58.770   8.095  12.080
 1134    H    LYS 588           HN       LYS 588  65.137   7.938   7.823
 1135    HA   LYS 588           HA       LYS 588  63.937   5.547   9.109
 1136    HB2  LYS 588           HB2      LYS 588  65.602   5.933   6.872
 1137    HB3  LYS 588           HB1      LYS 588  66.699   5.364   8.090
 1138    HG2  LYS 588           HG2      LYS 588  65.737   3.547   6.670
 1139    HG3  LYS 588           HG1      LYS 588  65.489   3.322   8.389
 1140    HD2  LYS 588           HD2      LYS 588  63.528   2.869   6.691
 1141    HD3  LYS 588           HD1      LYS 588  63.190   3.629   8.225
 1142    HE2  LYS 588           HE2      LYS 588  62.818   5.730   7.235
 1143    HE3  LYS 588           HE1      LYS 588  63.793   5.339   5.838
 1144    HZ1  LYS 588           HZ1      LYS 588  61.827   3.475   5.792
 1145    HZ2  LYS 588           HZ2      LYS 588  61.889   4.880   4.838
 1146    HZ3  LYS 588           HZ3      LYS 588  61.019   4.878   6.297
 1147    H    GLU 589           HN       GLU 589  65.488   4.407  10.693
 1148    HA   GLU 589           HA       GLU 589  67.338   6.249  12.079
 1149    HB2  GLU 589           HB2      GLU 589  65.431   6.953  13.237
 1150    HB3  GLU 589           HB1      GLU 589  64.707   5.350  13.243
 1151    HG2  GLU 589           HG2      GLU 589  66.229   4.582  14.925
 1152    HG3  GLU 589           HG1      GLU 589  67.265   6.003  14.747
 1153    H    GLN 590           HN       GLN 590  68.565   5.254  13.659
 1154    HA   GLN 590           HA       GLN 590  68.463   2.390  14.126
 1155    HB2  GLN 590           HB2      GLN 590  69.690   2.820  11.835
 1156    HB3  GLN 590           HB1      GLN 590  70.999   3.411  12.841
 1157    HG2  GLN 590           HG2      GLN 590  71.654   1.211  12.867
 1158    HG3  GLN 590           HG1      GLN 590  70.441   1.068  14.136
 1159   HE21  GLN 590          HE21      GLN 590  71.439  -0.639  11.605
 1160   HE22  GLN 590          HE22      GLN 590  69.972  -1.222  10.981
 1161    H    ASN 591           HN       ASN 591  69.735   1.928  15.990
 1162    HA   ASN 591           HA       ASN 591  70.565   2.528  18.085
 1163    HB2  ASN 591           HB2      ASN 591  72.622   4.317  17.579
 1164    HB3  ASN 591           HB1      ASN 591  72.770   2.573  17.497
 1165   HD21  ASN 591          HD21      ASN 591  71.752   1.783  15.202
 1166   HD22  ASN 591          HD22      ASN 591  72.381   2.610  13.866
 1167    H    ASP 592           HN       ASP 592  68.424   4.307  16.843
 1168    HA   ASP 592           HA       ASP 592  67.140   6.046  17.784
 1169    HB2  ASP 592           HB2      ASP 592  69.456   6.938  19.481
 1170    HB3  ASP 592           HB1      ASP 592  67.729   7.056  19.807
 1171    H    LYS 593           HN       LYS 593  69.973   6.324  16.089
 1172    HA   LYS 593           HA       LYS 593  70.040   9.260  15.996
 1173    HB2  LYS 593           HB2      LYS 593  71.531   7.300  14.281
 1174    HB3  LYS 593           HB1      LYS 593  71.950   8.971  14.615
 1175    HG2  LYS 593           HG2      LYS 593  72.076   8.236  17.087
 1176    HG3  LYS 593           HG1      LYS 593  72.099   6.590  16.454
 1177    HD2  LYS 593           HD2      LYS 593  74.042   7.210  15.009
 1178    HD3  LYS 593           HD1      LYS 593  74.065   8.800  15.771
 1179    HE2  LYS 593           HE2      LYS 593  74.217   6.265  17.411
 1180    HE3  LYS 593           HE1      LYS 593  75.666   6.999  16.716
 1181    HZ1  LYS 593           HZ1      LYS 593  73.923   8.855  18.075
 1182    HZ2  LYS 593           HZ2      LYS 593  75.609   8.671  18.175
 1183    HZ3  LYS 593           HZ3      LYS 593  74.586   7.669  19.089
 1184    HA   PRO 594           HA       PRO 594  66.875   9.152  12.695
 1185    HB2  PRO 594           HB2      PRO 594  68.263  11.670  11.899
 1186    HB3  PRO 594           HB1      PRO 594  66.544  11.380  12.149
 1187    HG2  PRO 594           HG2      PRO 594  68.078  12.756  13.915
 1188    HG3  PRO 594           HG1      PRO 594  66.696  11.776  14.427
 1189    HD2  PRO 594           HD2      PRO 594  69.600  11.234  14.790
 1190    HD3  PRO 594           HD1      PRO 594  68.209  10.587  15.694
 1191    H    TYR 595           HN       TYR 595  67.009   9.074  10.229
 1192    HA   TYR 595           HA       TYR 595  69.639   9.002   8.979
 1193    HB2  TYR 595           HB2      TYR 595  68.359   6.493  10.001
 1194    HB3  TYR 595           HB1      TYR 595  69.202   6.406   8.472
 1195    HD1  TYR 595           HD1      TYR 595  71.559   7.803   8.585
 1196    HD2  TYR 595           HD2      TYR 595  69.628   5.778  11.833
 1197    HE1  TYR 595           HE1      TYR 595  73.729   7.550   9.734
 1198    HE2  TYR 595           HE2      TYR 595  71.820   5.524  12.968
 1199    HH   TYR 595           HH       TYR 595  74.822   6.640  11.436
 1200    H    CYS 596           HN       CYS 596  69.428   8.978   6.717
 1201    HA   CYS 596           HA       CYS 596  66.682   8.921   5.612
 1202    HB2  CYS 596           HB2      CYS 596  69.242   8.868   3.983
 1203    HB3  CYS 596           HB1      CYS 596  67.647   9.403   3.483
 1204    H    GLN 597           HN       GLN 597  66.061   7.174   4.097
 1205    HA   GLN 597           HA       GLN 597  66.969   4.629   5.018
 1206    HB2  GLN 597           HB2      GLN 597  64.849   4.519   4.023
 1207    HB3  GLN 597           HB1      GLN 597  65.296   5.597   2.729
 1208    HG2  GLN 597           HG2      GLN 597  65.163   3.564   1.598
 1209    HG3  GLN 597           HG1      GLN 597  66.864   3.605   2.005
 1210   HE21  GLN 597          HE21      GLN 597  66.305   3.080   4.902
 1211   HE22  GLN 597          HE22      GLN 597  65.886   1.459   4.998
 1212    H    ASN 598           HN       ASN 598  67.560   6.333   1.961
 1213    HA   ASN 598           HA       ASN 598  69.446   4.731   0.782
 1214    HB2  ASN 598           HB2      ASN 598  69.963   7.686   0.856
 1215    HB3  ASN 598           HB1      ASN 598  70.044   6.577  -0.506
 1216   HD21  ASN 598          HD21      ASN 598  67.664   5.370  -0.619
 1217   HD22  ASN 598          HD22      ASN 598  66.395   6.482  -0.754
 1218    H    CYS 599           HN       CYS 599  69.891   6.871   3.529
 1219    HA   CYS 599           HA       CYS 599  72.778   6.554   3.603
 1220    HB2  CYS 599           HB2      CYS 599  70.748   7.686   5.541
 1221    HB3  CYS 599           HB1      CYS 599  72.470   7.620   5.897
 1222    H    PHE 600           HN       PHE 600  70.234   5.606   5.926
 1223    HA   PHE 600           HA       PHE 600  71.823   3.883   7.479
 1224    HB2  PHE 600           HB2      PHE 600  69.880   4.217   8.622
 1225    HB3  PHE 600           HB1      PHE 600  68.977   4.521   7.147
 1226    HD1  PHE 600           HD1      PHE 600  67.971   2.645   5.874
 1227    HD2  PHE 600           HD2      PHE 600  69.922   2.026   9.649
 1228    HE1  PHE 600           HE1      PHE 600  66.906   0.414   6.058
 1229    HE2  PHE 600           HE2      PHE 600  68.852  -0.205   9.831
 1230    HZ   PHE 600           HZ       PHE 600  67.346  -1.011   8.037
 1231    H    LEU 601           HN       LEU 601  69.691   2.965   4.725
 1232    HA   LEU 601           HA       LEU 601  70.103   0.219   4.993
 1233    HB2  LEU 601           HB2      LEU 601  68.655   0.234   3.249
 1234    HB3  LEU 601           HB1      LEU 601  68.788   1.988   3.207
 1235    HG   LEU 601           HG       LEU 601  70.801   0.252   1.783
 1236   HD11  LEU 601          HD11      LEU 601  69.409   0.518  -0.258
 1237   HD12  LEU 601          HD12      LEU 601  68.113   1.116   0.774
 1238   HD13  LEU 601          HD13      LEU 601  68.699  -0.536   0.963
 1239   HD21  LEU 601          HD21      LEU 601  70.065   2.659   0.388
 1240   HD22  LEU 601          HD22      LEU 601  71.625   2.226   1.053
 1241   HD23  LEU 601          HD23      LEU 601  70.452   3.075   2.057
 1242    H    LYS 602           HN       LYS 602  71.926   2.560   3.011
 1243    HA   LYS 602           HA       LYS 602  73.825   0.902   1.884
 1244    HB2  LYS 602           HB2      LYS 602  73.617   3.464   1.746
 1245    HB3  LYS 602           HB1      LYS 602  74.614   3.499   3.194
 1246    HG2  LYS 602           HG2      LYS 602  76.443   2.487   2.090
 1247    HG3  LYS 602           HG1      LYS 602  75.457   1.982   0.721
 1248    HD2  LYS 602           HD2      LYS 602  75.188   4.221  -0.056
 1249    HD3  LYS 602           HD1      LYS 602  75.845   4.890   1.430
 1250    HE2  LYS 602           HE2      LYS 602  77.924   3.240   0.514
 1251    HE3  LYS 602           HE1      LYS 602  77.264   3.939  -0.963
 1252    HZ1  LYS 602           HZ1      LYS 602  78.892   5.418  -0.149
 1253    HZ2  LYS 602           HZ2      LYS 602  78.254   5.383   1.426
 1254    HZ3  LYS 602           HZ3      LYS 602  77.389   6.136   0.171
 1255    H    LEU 603           HN       LEU 603  73.465   1.674   5.257
 1256    HA   LEU 603           HA       LEU 603  76.114   0.502   5.907
 1257    HB2  LEU 603           HB2      LEU 603  74.344   1.370   8.121
 1258    HB3  LEU 603           HB1      LEU 603  76.053   1.699   7.853
 1259    HG   LEU 603           HG       LEU 603  73.749   3.018   6.390
 1260   HD11  LEU 603          HD11      LEU 603  75.691   4.271   8.313
 1261   HD12  LEU 603          HD12      LEU 603  74.146   3.598   8.835
 1262   HD13  LEU 603          HD13      LEU 603  74.183   4.939   7.690
 1263   HD21  LEU 603          HD21      LEU 603  76.056   2.734   5.171
 1264   HD22  LEU 603          HD22      LEU 603  76.646   3.898   6.346
 1265   HD23  LEU 603          HD23      LEU 603  75.347   4.340   5.244
 1266    H    PHE 604           HN       PHE 604  72.743   0.015   7.053
 1267    HA   PHE 604           HA       PHE 604  73.529  -2.726   7.923
 1268    HB2  PHE 604           HB2      PHE 604  71.222  -0.885   8.553
 1269    HB3  PHE 604           HB1      PHE 604  71.085  -2.614   8.873
 1270    HD1  PHE 604           HD1      PHE 604  72.917   0.490   9.736
 1271    HD2  PHE 604           HD2      PHE 604  72.397  -3.688  10.598
 1272    HE1  PHE 604           HE1      PHE 604  74.222   0.757  11.825
 1273    HE2  PHE 604           HE2      PHE 604  73.702  -3.417  12.688
 1274    HZ   PHE 604           HZ       PHE 604  74.615  -1.195  13.301
 1275    H    CYS 605           HN       CYS 605  72.969  -1.825   5.040
 1276    HA   CYS 605           HA       CYS 605  71.356  -4.192   4.358
 1277    HB2  CYS 605           HB2      CYS 605  70.487  -1.448   3.401
 1278    HB3  CYS 605           HB1      CYS 605  69.723  -2.988   3.016
 1279    HG   CYS 605           HG       CYS 605  69.808  -1.950   5.966