*HEADER    PROTEIN BINDING                         20-JAN-06   2FS1              
*TITLE     SOLUTION STRUCTURE OF PSD-1                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PSD-1;                                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   4 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: XL-10;                                     
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PG58                                      
*KEYWDS    SOLUTION STRUCTURE, PSD-1                                             
*EXPDTA    NMR, 21 STRUCTURES                                                    
*AUTHOR    Y.HE, D.A.ROZAK, N.SARI, Y.CHEN, P.BRYAN, J.ORBAN                     
*REVDAT   1   05-DEC-06 2FS1    0                                                


!CNS table made by NOEID from peak list: /fast/satchmo/hey/CNS/GAS-1/gas-1_13cnoesy:1.list
!On Mon Sep 26 12:11:55 2005
!Using these strengths for these volumes: 
!   2.5 0.7 0.5 > 9000000
!   3.0 1.2 1.0 > 3000000
!   4.0 2.2 1.5 > 1200000
!and including assignments only if there were 3 or less
!possible assignments found by NOEID.

assign ((  resid 4 and name HA ))
       ((  resid 4 and name HB ))3.0 1.2 1.0
assign ((  resid 4 and name HA ))
       ((  resid 4 and name QG1 ))2.5 0.7 0.5
assign ((  resid 4 and name HA ))
       ((  resid 4 and name HN ))2.5 0.7 0.5
assign ((  resid 4 and name HA ))
       ((  resid 5 and name HB2 ))4.0 2.2 1.5
assign ((  resid 4 and name HB ))
       ((  resid 4 and name HA ))3.0 1.2 1.0
assign ((  resid 4 and name HB ))
       ((  resid 4 and name QG1 ))3.0 1.2 1.0
assign ((  resid 4 and name HB ))
       ((  resid 4 and name HN ))3.0 1.2 1.0
assign ((  resid 5 and name HA ))
       ((  resid 5 and name HB3 ))3.0 1.2 1.0
assign ((  resid 5 and name HA ))
       ((  resid 5 and name HN ))4.0 2.2 1.5
assign ((  resid 5 and name HB2 ))
       ((  resid 5 and name HA ))3.0 1.2 1.0
assign ((  resid 5 and name HB3 ))
       ((  resid 5 and name HA ))3.0 1.2 1.0
assign ((  resid 5 and name HB2 ))
       ((  resid 5 and name HN ))3.0 1.2 1.0
assign ((  resid 5 and name HB3 ))
       ((  resid 5 and name HN ))3.0 1.2 1.0
assign ((  resid 5 and name HB2 ))
       ((  resid 8 and name QB ))4.0 2.2 1.5
assign ((  resid 5 and name HB3 ))
       ((  resid 8 and name QB ))4.0 2.2 1.5
assign ((  resid 6 and name QB ))
       ((  resid 6 and name HA ))2.5 0.7 0.5
assign ((  resid 7 and name HA ))
       ((  resid 7 and name QB ))3.0 1.2 1.0
assign ((  resid 7 and name QB ))
       ((  resid 4 and name HB ))4.0 2.2 1.5
assign ((  resid 7 and name QB ))
       ((  resid 7 and name HA ))2.5 0.7 0.5
assign ((  resid 7 and name QB ))
       ((  resid 7 and name HN ))3.0 1.2 1.0
assign ((  resid 7 and name QB ))
       ((  resid 8 and name HA ))3.0 1.2 1.0
assign ((  resid 7 and name QB ))
       ((  resid 8 and name QB ))3.0 1.2 1.0
assign ((  resid 7 and name QB ))
       ((  resid 8 and name HN ))3.0 1.2 1.0
assign ((  resid 8 and name QB ))
       ((  resid 8 and name HA ))2.5 0.7 0.5
assign ((  resid 8 and name QB ))
       ((  resid 8 and name HN ))3.0 1.2 1.0
assign ((  resid 8 and name QB ))
       ((  resid 39 and name HB ))4.0 2.2 1.5
assign ((  resid 8 and name QB ))
       ((  resid 39 and name QG1 ))4.0 2.2 1.5
assign ((  resid 9 and name HA ))
       ((  resid 9 and name QB ))2.5 0.7 0.5
assign ((  resid 9 and name HA ))
       ((  resid 9 and name QD2 ))2.5 0.7 0.5
assign ((  resid 9 and name HA ))
       ((  resid 9 and name HG ))2.5 0.7 0.5
assign ((  resid 9 and name HA ))
       ((  resid 10 and name HN ))3.0 1.2 1.0
assign ((  resid 9 and name HA ))
       ((  resid 39 and name HA ))3.0 1.2 1.0
assign ((  resid 9 and name HA ))
       ((  resid 39 and name QG1 ))2.5 0.7 0.5
assign ((  resid 9 and name QB ))
       ((  resid 9 and name QD1 ))3.0 1.2 1.0
assign ((  resid 9 and name QB ))
       ((  resid 9 and name QD2 ))3.0 1.2 1.0
assign ((  resid 9 and name QD1 ))
       ((  resid 6 and name HA ))2.5 0.7 0.5
assign ((  resid 9 and name QD2 ))
       ((  resid 9 and name HA ))2.5 0.7 0.5
assign ((  resid 9 and name QD1 ))
       ((  resid 9 and name QB ))2.5 0.7 0.5
assign ((  resid 9 and name QD2 ))
       ((  resid 9 and name QB ))3.0 1.2 1.0
assign ((  resid 9 and name QD1 ))
       ((  resid 9 and name QD2 ))2.5 0.7 0.5
assign ((  resid 9 and name QD1 ))
       ((  resid 9 and name HG ))2.5 0.7 0.5
assign ((  resid 9 and name QD2 ))
       ((  resid 9 and name HG ))2.5 0.7 0.5
assign ((  resid 9 and name QD1 ))
       ((  resid 38 and name HN ))3.0 1.2 1.0
assign ((  resid 9 and name QD2 ))
       ((  resid 38 and name HN ))4.0 2.2 1.5
assign ((  resid 9 and name QD2 ))
       ((  resid 39 and name HA ))2.5 0.7 0.5
assign ((  resid 9 and name QD2 ))
       ((  resid 39 and name QG1 ))3.0 2.2 1.5
assign ((  resid 9 and name QD2 ))
       ((  resid 42 and name HB ))3.0 1.2 1.0
assign ((  resid 9 and name HG ))
       ((  resid 9 and name QB ))3.0 1.2 1.0
assign ((  resid 10 and name HA ))
       ((  resid 9 and name QB ))3.0 1.2 1.0
assign ((  resid 10 and name HA ))
       ((  resid 10 and name QB ))2.5 0.7 0.5
assign ((  resid 10 and name HA ))
       ((  resid 11 and name HN ))3.0 1.2 1.0
assign ((  resid 10 and name QB ))
       ((  resid 9 and name QB ))3.0 1.2 1.0
assign ((  resid 10 and name QB ))
       ((  resid 10 and name HA ))2.5 0.7 0.5
assign ((  resid 10 and name QB ))
       ((  resid 10 and name HN ))2.5 0.7 0.5
assign ((  resid 11 and name HA ))
       ((  resid 11 and name HG2 ))2.5 0.7 0.5
assign ((  resid 11 and name HA ))
       ((  resid 14 and name QB ))2.5 0.7 0.5
assign ((  resid 11 and name HA ))
       ((  resid 14 and name HN ))3.0 1.2 1.0
assign ((  resid 11 and name HA ))
       ((  resid 15 and name HN ))2.5 0.7 0.5
assign ((  resid 11 and name QB ))
       ((  resid 11 and name HA ))2.5 0.7 0.5
assign ((  resid 11 and name QB ))
       ((  resid 11 and name HG2 ))2.5 0.7 0.5
assign ((  resid 11 and name QB ))
       ((  resid 12 and name HN ))2.5 0.7 0.5
assign ((  resid 11 and name QB ))
       ((  resid 15 and name QB ))3.0 1.2 1.0
assign ((  resid 11 and name HG1 ))
       ((  resid 11 and name HA ))3.0 1.2 1.0
assign ((  resid 11 and name HG2 ))
       ((  resid 11 and name HA ))3.0 1.2 1.0
assign ((  resid 11 and name HG2 ))
       ((  resid 11 and name HA ))3.0 1.2 1.0
assign ((  resid 11 and name HG1 ))
       ((  resid 11 and name QB ))2.5 0.7 0.5
assign ((  resid 11 and name HG2 ))
       ((  resid 11 and name QB ))2.5 0.7 0.5
assign ((  resid 11 and name HG1 ))
       ((  resid 15 and name QB ))4.0 2.2 1.5
assign ((  resid 11 and name HG2 ))
       ((  resid 15 and name QB ))4.0 2.2 1.5
assign ((  resid 11 and name HG1 ))
       ((  resid 15 and name HN ))3.0 1.2 1.0
assign ((  resid 11 and name HG2 ))
       ((  resid 15 and name HN ))3.0 1.2 1.0
assign ((  resid 12 and name HA ))
       ((  resid 12 and name QB ))2.5 0.7 0.5
assign ((  resid 12 and name HA ))
       ((  resid 12 and name HN ))2.5 0.7 0.5
assign ((  resid 12 and name HA ))
       ((  resid 16 and name HN ))4.0 2.2 1.5
assign ((  resid 12 and name HA ))
       ((  resid 42 and name QG1 ))4.0 2.2 1.5
assign ((  resid 12 and name QB ))
       ((  resid 9 and name HA ))2.5 0.7 0.5
assign ((  resid 12 and name QB ))
       ((  resid 9 and name QD2 ))3.0 1.2 1.0
assign ((  resid 12 and name QB ))
       ((  resid 11 and name QB ))3.0 1.2 1.0
assign ((  resid 12 and name QB ))
       ((  resid 11 and name HN ))3.0 1.2 1.0
assign ((  resid 12 and name QB ))
       ((  resid 12 and name HA ))2.5 0.7 0.5
assign ((  resid 12 and name QB ))
       ((  resid 12 and name HN ))2.5 0.7 0.5
assign ((  resid 12 and name QB ))
       ((  resid 13 and name HA ))4.0 2.2 1.5
assign ((  resid 12 and name QB ))
       ((  resid 14 and name HN ))4.0 2.2 1.5
assign ((  resid 12 and name QB ))
       ((  resid 39 and name HA ))3.0 1.2 1.0
assign ((  resid 12 and name QB ))
       ((  resid 39 and name QG1 ))2.5 0.7 0.5
assign ((  resid 12 and name QB ))
       ((  resid 42 and name HB ))3.0 1.2 1.0
assign ((  resid 12 and name QB ))
       ((  resid 42 and name QG1 ))2.5 0.7 0.5
assign ((  resid 13 and name HA ))
       ((  resid 13 and name HB2 ))2.5 0.7 0.5
assign ((  resid 13 and name HA ))
       ((  resid 14 and name HN ))3.0 1.2 1.0
assign ((  resid 13 and name HA ))
       ((  resid 16 and name QB ))2.5 0.7 0.5
assign ((  resid 13 and name HA ))
       ((  resid 17 and name HN ))3.0 1.2 1.0
assign ((  resid 13 and name HA ))
       ((  resid 33 and name HB ))4.0 2.2 1.5
assign ((  resid 13 and name HA ))
       ((  resid 33 and name QD1 ))2.5 0.7 0.5
assign ((  resid 13 and name HA ))
       ((  resid 33 and name QG2 ))2.5 0.7 0.5
assign ((  resid 13 and name HA ))
       ((  resid 42 and name QG1 ))2.5 0.7 0.5
assign ((  resid 13 and name HB2 ))
       ((  resid 10 and name HA ))4.0 2.2 1.5
assign ((  resid 13 and name HB3 ))
       ((  resid 10 and name HA ))4.0 2.2 1.5
assign ((  resid 13 and name HB2 ))
       ((  resid 12 and name QB ))3.0 1.2 1.0
assign ((  resid 13 and name HB2 ))
       ((  resid 13 and name HA ))3.0 1.2 1.0
assign ((  resid 13 and name HB3 ))
       ((  resid 13 and name HA ))3.0 1.2 1.0
assign ((  resid 13 and name HB2 ))
       ((  resid 13 and name HN ))3.0 1.2 1.0
assign ((  resid 13 and name HB3 ))
       ((  resid 13 and name HN ))3.0 1.2 1.0
assign ((  resid 13 and name HB2 ))
       ((  resid 14 and name HN ))4.0 2.2 1.5
assign ((  resid 13 and name HB3 ))
       ((  resid 14 and name HN ))4.0 2.2 1.5
assign ((  resid 13 and name HB2 ))
       ((  resid 33 and name QD1 ))4.0 2.2 1.5
assign ((  resid 13 and name HB3 ))
       ((  resid 33 and name QD1 ))4.0 2.2 1.5
assign ((  resid 13 and name HB2 ))
       ((  resid 33 and name QG2 ))3.0 1.2 1.0
assign ((  resid 13 and name HB3 ))
       ((  resid 33 and name QG2 ))3.0 1.2 1.0
assign ((  resid 13 and name HB3 ))
       ((  resid 34 and name HA ))4.5 1.7 1.5
assign ((  resid 13 and name QG ))
       ((  resid 42 and name HA ))4.0 2.2 1.5
assign ((  resid 14 and name HA ))
       ((  resid 14 and name QB ))2.5 0.7 0.5
assign ((  resid 14 and name QB ))
       ((  resid 11 and name HN ))3.0 1.2 1.0
assign ((  resid 14 and name QB ))
       ((  resid 14 and name HA ))2.5 0.7 0.5
assign ((  resid 14 and name QB ))
       ((  resid 15 and name HN ))3.0 1.2 1.0
assign ((  resid 14 and name QG ))
       ((  resid 17 and name QG2 ))4.0 2.2 1.5
assign ((  resid 15 and name HA ))
       ((  resid 15 and name QB ))2.5 0.7 0.5
assign ((  resid 15 and name HA ))
       ((  resid 16 and name HN ))3.0 1.2 1.0
assign ((  resid 15 and name HA ))
       ((  resid 17 and name HN ))3.0 1.2 1.0
assign ((  resid 15 and name HA ))
       ((  resid 18 and name QB ))2.5 0.7 0.5
assign ((  resid 15 and name QB ))
       ((  resid 11 and name QB ))3.0 1.2 1.0
assign ((  resid 15 and name QB ))
       ((  resid 16 and name HN ))2.5 0.7 0.5
assign ((  resid 16 and name QB ))
       ((  resid 13 and name HA ))3.0 1.2 1.0
assign ((  resid 16 and name QB ))
       ((  resid 16 and name HA ))2.5 0.7 0.5
assign ((  resid 16 and name QB ))
       ((  resid 16 and name HN ))2.5 0.7 0.5
assign ((  resid 16 and name QB ))
       ((  resid 17 and name HA ))4.0 2.2 1.5
assign ((  resid 16 and name QB ))
       ((  resid 42 and name HB ))4.0 2.2 1.5
assign ((  resid 16 and name QB ))
       ((  resid 42 and name QG1 ))2.5 0.7 0.5
assign ((  resid 16 and name QB ))
       ((  resid 46 and name HB2 ))3.0 1.2 1.0
assign ((  resid 18 and name HA ))
       ((  resid 18 and name QE ))4.0 2.2 1.5
assign ((  resid 18 and name HA ))
       ((  resid 18 and name QG ))2.5 0.7 0.5
assign ((  resid 18 and name HA ))
       ((  resid 22 and name HN ))3.0 1.2 1.0
assign ((  resid 18 and name QB ))
       ((  resid 15 and name HA ))2.5 0.7 0.5
assign ((  resid 18 and name QB ))
       ((  resid 17 and name QG2 ))4.0 2.2 1.5
assign ((  resid 18 and name QB ))
       ((  resid 17 and name HN ))3.0 1.2 1.0
assign ((  resid 18 and name QB ))
       ((  resid 18 and name HA ))2.5 0.7 0.5
assign ((  resid 19 and name HA ))
       ((  resid 18 and name HA ))4.0 2.2 1.5
assign ((  resid 19 and name HA ))
       ((  resid 19 and name QB ))2.5 0.7 0.5
assign ((  resid 19 and name HA ))
       ((  resid 19 and name QG ))2.5 0.7 0.5
assign ((  resid 19 and name HA ))
       ((  resid 19 and name HN ))3.0 1.2 1.0
assign ((  resid 19 and name HA ))
       ((  resid 21 and name HN ))3.0 1.2 1.0
assign ((  resid 19 and name HA ))
       ((  resid 22 and name HN ))2.5 0.7 0.5
assign ((  resid 19 and name QB ))
       ((  resid 19 and name HA ))2.5 0.7 0.5
assign ((  resid 19 and name QB ))
       ((  resid 19 and name HN ))2.5 0.7 0.5
assign ((  resid 19 and name QB ))
       ((  resid 20 and name QD1 ))4.0 2.2 1.5
assign ((  resid 19 and name QB ))
       ((  resid 46 and name QD ))3.0 1.2 1.0
assign ((  resid 19 and name QB ))
       ((  resid 46 and name HG2 ))3.0 1.2 1.0
assign ((  resid 20 and name HA ))
       ((  resid 20 and name QD1 ))2.5 0.7 0.5
assign ((  resid 20 and name HA ))
       ((  resid 23 and name HB2 ))4.0 2.2 1.5
assign ((  resid 20 and name HA ))
       ((  resid 23 and name HB3 ))4.0 2.2 1.5
assign ((  resid 20 and name HA ))
       ((  resid 23 and name QD ))3.0 1.2 1.0
assign ((  resid 20 and name HA ))
       ((  resid 23 and name QE ))4.0 2.2 1.5
assign ((  resid 20 and name HA ))
       ((  resid 50 and name QD2 ))4.0 2.2 1.5
assign ((  resid 20 and name QB ))
       ((  resid 17 and name HN ))4.0 2.2 1.5
assign ((  resid 20 and name QB ))
       ((  resid 30 and name HA ))4.0 2.2 1.5
assign ((  resid 20 and name QB ))
       ((  resid 30 and name HN ))4.0 2.2 1.5
assign ((  resid 20 and name HG ))
       ((  resid 20 and name QB ))3.0 1.2 1.0
assign ((  resid 20 and name HG ))
       ((  resid 20 and name QD1 ))3.0 1.2 1.0
assign ((  resid 20 and name HG ))
       ((  resid 30 and name HA ))4.0 2.2 1.5
assign ((  resid 21 and name QB ))
       ((  resid 21 and name QE ))4.5 1.7 1.5
assign ((  resid 21 and name QB ))
       ((  resid 22 and name HN ))3.0 1.2 1.0
assign ((  resid 21 and name QE ))
       ((  resid 22 and name QB ))3.0 1.2 1.0
assign ((  resid 22 and name HA ))
       ((  resid 22 and name QB ))2.5 0.7 0.5
assign ((  resid 22 and name HA ))
       ((  resid 23 and name HN ))3.0 1.2 1.0
assign ((  resid 22 and name QB ))
       ((  resid 19 and name HA ))3.0 1.2 1.0
assign ((  resid 22 and name QB ))
       ((  resid 22 and name QG ))2.5 0.7 0.5
assign ((  resid 23 and name HA ))
       ((  resid 23 and name HB2 ))3.0 1.2 1.0
assign ((  resid 23 and name HA ))
       ((  resid 23 and name HB3 ))4.0 2.2 1.5
assign ((  resid 23 and name HA ))
       ((  resid 23 and name QD ))4.0 2.2 1.5
assign ((  resid 23 and name HA ))
       ((  resid 23 and name HN ))4.0 2.2 1.5
assign ((  resid 23 and name HB2 ))
       ((  resid 20 and name HA ))4.0 2.2 1.5
assign ((  resid 23 and name HB3 ))
       ((  resid 20 and name HA ))4.0 2.2 1.5
assign ((  resid 23 and name HB2 ))
       ((  resid 20 and name HG ))4.0 2.2 1.5
assign ((  resid 23 and name HB2 ))
       ((  resid 23 and name HA ))3.0 1.2 1.0
assign ((  resid 23 and name HB3 ))
       ((  resid 23 and name HA ))3.0 1.2 1.0
assign ((  resid 23 and name HB3 ))
       ((  resid 23 and name HB2 ))2.5 0.7 0.5
assign ((  resid 23 and name HB2 ))
       ((  resid 23 and name HB3 ))2.5 0.7 0.5
assign ((  resid 23 and name HB2 ))
       ((  resid 23 and name QD ))3.0 1.2 1.0
assign ((  resid 23 and name HB3 ))
       ((  resid 23 and name QD ))3.0 1.2 1.0
assign ((  resid 23 and name HB3 ))
       ((  resid 23 and name QE ))4.0 2.2 1.5
assign ((  resid 23 and name HB2 ))
       ((  resid 23 and name HN ))3.0 1.2 1.0
assign ((  resid 23 and name HB2 ))
       ((  resid 24 and name HN ))4.0 2.2 1.5
assign ((  resid 23 and name HB3 ))
       ((  resid 25 and name HB ))4.0 2.2 1.5
assign ((  resid 23 and name HB3 ))
       ((  resid 25 and name QD1 ))3.0 1.2 1.0
assign ((  resid 23 and name HB3 ))
       ((  resid 25 and name QG1 ))4.0 2.2 1.5
assign ((  resid 23 and name HB2 ))
       ((  resid 25 and name QG2 ))4.5 1.7 1.5
assign ((  resid 23 and name HB2 ))
       ((  resid 53 and name QD1 ))3.0 1.2 1.0
assign ((  resid 23 and name HB2 ))
       ((  resid 53 and name QD2 ))4.0 2.2 1.5
assign ((  resid 24 and name HA1 ))
       ((  resid 24 and name HN ))3.0 1.2 1.0
assign ((  resid 24 and name HA2 ))
       ((  resid 24 and name HN ))3.0 1.2 1.0
assign ((  resid 24 and name HA1 ))
       ((  resid 25 and name HN ))4.0 2.2 1.5
assign ((  resid 24 and name HA2 ))
       ((  resid 25 and name HN ))4.0 2.2 1.5
assign ((  resid 25 and name HA ))
       ((  resid 24 and name HN ))4.5 2.2 1.5
assign ((  resid 25 and name HA ))
       ((  resid 25 and name HB ))2.5 0.7 0.5
assign ((  resid 25 and name HA ))
       ((  resid 25 and name QD1 ))3.0 1.2 1.0
assign ((  resid 25 and name HA ))
       ((  resid 25 and name QG1 ))3.0 1.2 1.0
assign ((  resid 25 and name HA ))
       ((  resid 25 and name QG2 ))2.5 0.7 0.5
assign ((  resid 25 and name HA ))
       ((  resid 25 and name HN ))3.0 1.2 1.0
assign ((  resid 25 and name HA ))
       ((  resid 26 and name HN ))2.5 0.7 0.5
assign ((  resid 25 and name HB ))
       ((  resid 25 and name HA ))3.0 1.2 1.0
assign ((  resid 25 and name HB ))
       ((  resid 25 and name QG1 ))3.0 1.2 1.0
assign ((  resid 25 and name HB ))
       ((  resid 25 and name HN ))3.0 1.2 1.0
assign ((  resid 25 and name HB ))
       ((  resid 26 and name HN ))3.0 1.2 1.0
assign ((  resid 25 and name HB ))
       ((  resid 29 and name HB2 ))4.0 2.2 1.5
assign ((  resid 25 and name QD1 ))
       ((  resid 23 and name HB2 ))4.0 2.2 1.5
assign ((  resid 25 and name QD1 ))
       ((  resid 23 and name HB3 ))4.0 2.2 1.5
assign ((  resid 25 and name QD1 ))
       ((  resid 23 and name QD ))3.0 1.2 1.0
assign ((  resid 25 and name QD1 ))
       ((  resid 25 and name HA ))3.0 1.2 1.0
assign ((  resid 25 and name QD1 ))
       ((  resid 25 and name HB ))2.5 0.7 0.5
assign ((  resid 25 and name QD1 ))
       ((  resid 25 and name QG1 ))2.5 0.7 0.5
assign ((  resid 25 and name QD1 ))
       ((  resid 25 and name QG2 ))2.5 0.7 0.5
assign ((  resid 25 and name QD1 ))
       ((  resid 29 and name HB2 ))3.0 1.2 1.0
assign ((  resid 25 and name QG1 ))
       ((  resid 25 and name HA ))3.0 1.2 1.0
assign ((  resid 25 and name QG1 ))
       ((  resid 25 and name HB ))3.0 1.2 1.0
assign ((  resid 25 and name QG1 ))
       ((  resid 25 and name HN ))3.0 1.2 1.0
assign ((  resid 25 and name QG1 ))
       ((  resid 50 and name QD1 ))3.0 1.2 1.0
assign ((  resid 25 and name QG2 ))
       ((  resid 23 and name HB2 ))4.0 2.2 1.5
assign ((  resid 25 and name QG2 ))
       ((  resid 23 and name HB3 ))4.0 2.2 1.5
assign ((  resid 25 and name QG2 ))
       ((  resid 25 and name HA ))2.5 0.7 0.5
assign ((  resid 25 and name QG2 ))
       ((  resid 25 and name HB ))2.5 0.7 0.5
assign ((  resid 25 and name QG2 ))
       ((  resid 25 and name QD1 ))2.5 0.7 0.5
assign ((  resid 25 and name QG2 ))
       ((  resid 25 and name HN ))3.0 1.2 1.0
assign ((  resid 25 and name QG2 ))
       ((  resid 26 and name HN ))3.0 1.2 1.0
assign ((  resid 25 and name QG2 ))
       ((  resid 50 and name QD2 ))2.5 0.7 0.5
assign ((  resid 26 and name HA2 ))
       ((  resid 26 and name HA1 ))2.5 0.7 0.5
assign ((  resid 26 and name HA1 ))
       ((  resid 26 and name HA2 ))2.5 0.7 0.5
assign ((  resid 26 and name HA1 ))
       ((  resid 26 and name HN ))3.0 1.2 1.0
assign ((  resid 26 and name HA2 ))
       ((  resid 26 and name HN ))3.0 1.2 1.0
assign ((  resid 26 and name HA1 ))
       ((  resid 27 and name QB ))4.0 2.2 1.5
assign ((  resid 26 and name HA2 ))
       ((  resid 27 and name QB ))4.0 2.2 1.5
assign ((  resid 26 and name HA1 ))
       ((  resid 27 and name HN ))3.0 1.2 1.0
assign ((  resid 26 and name HA2 ))
       ((  resid 27 and name HN ))2.5 0.7 0.5
assign ((  resid 27 and name HA ))
       ((  resid 27 and name QB ))2.5 0.7 0.5
assign ((  resid 27 and name HA ))
       ((  resid 27 and name HN ))3.0 1.2 1.0
assign ((  resid 27 and name HA ))
       ((  resid 29 and name HN ))3.0 1.2 1.0
assign ((  resid 27 and name QB ))
       ((  resid 27 and name HA ))2.5 0.7 0.5
assign ((  resid 27 and name QB ))
       ((  resid 27 and name HN ))3.0 1.2 1.0
assign ((  resid 27 and name QB ))
       ((  resid 30 and name QD1 ))4.0 2.2 1.5
assign ((  resid 27 and name QB ))
       ((  resid 30 and name QG1 ))4.5 1.7 1.5
assign ((  resid 28 and name HA ))
       ((  resid 28 and name HB2 ))2.5 0.7 0.5
assign ((  resid 28 and name HA ))
       ((  resid 28 and name HB3 ))3.0 1.2 1.0
assign ((  resid 28 and name HA ))
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assign ((  resid 28 and name HA ))
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assign ((  resid 28 and name HA ))
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assign ((  resid 28 and name HA ))
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assign ((  resid 28 and name HA ))
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assign ((  resid 28 and name HB2 ))
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assign ((  resid 28 and name HB3 ))
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assign ((  resid 28 and name HB2 ))
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assign ((  resid 28 and name HB3 ))
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assign ((  resid 28 and name HB3 ))
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assign ((  resid 28 and name HB2 ))
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assign ((  resid 28 and name HB2 ))
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assign ((  resid 28 and name HB3 ))
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assign ((  resid 28 and name HB2 ))
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assign ((  resid 28 and name HB3 ))
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assign ((  resid 28 and name HB2 ))
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assign ((  resid 28 and name HB3 ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HA ))
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assign ((  resid 29 and name HB2 ))
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assign ((  resid 29 and name HB2 ))
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assign ((  resid 29 and name HB2 ))
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assign ((  resid 29 and name HB3 ))
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assign ((  resid 29 and name HB2 ))
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assign ((  resid 29 and name HB2 ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HA ))
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assign ((  resid 30 and name HB ))
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assign ((  resid 30 and name HB ))
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assign ((  resid 30 and name HB ))
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assign ((  resid 30 and name HB ))
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assign ((  resid 30 and name QG1 ))
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assign ((  resid 30 and name QG1 ))
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assign ((  resid 30 and name QG1 ))
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assign ((  resid 30 and name QG1 ))
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assign ((  resid 30 and name QG1 ))
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assign ((  resid 30 and name QG1 ))
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assign ((  resid 30 and name QG2 ))
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assign ((  resid 30 and name QG2 ))
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assign ((  resid 30 and name QG2 ))
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assign ((  resid 31 and name HA ))
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assign ((  resid 31 and name HA ))
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assign ((  resid 31 and name HA ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QB ))
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assign ((  resid 31 and name QE ))
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assign ((  resid 31 and name QG ))
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assign ((  resid 31 and name QG ))
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assign ((  resid 32 and name HA ))
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assign ((  resid 32 and name HA ))
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assign ((  resid 32 and name HA ))
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assign ((  resid 32 and name HB2 ))
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assign ((  resid 32 and name HB2 ))
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assign ((  resid 32 and name HB3 ))
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assign ((  resid 32 and name HB3 ))
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assign ((  resid 32 and name HB2 ))
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assign ((  resid 32 and name HB2 ))
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assign ((  resid 32 and name HB3 ))
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assign ((  resid 32 and name HB2 ))
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assign ((  resid 32 and name HB3 ))
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assign ((  resid 32 and name HB3 ))
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assign ((  resid 32 and name QD1 ))
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assign ((  resid 32 and name QD1 ))
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assign ((  resid 32 and name QD1 ))
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assign ((  resid 32 and name QD1 ))
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assign ((  resid 32 and name QD1 ))
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assign ((  resid 32 and name HG ))
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assign ((  resid 32 and name HG ))
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assign ((  resid 32 and name HG ))
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assign ((  resid 32 and name HG ))
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assign ((  resid 33 and name HA ))
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assign ((  resid 33 and name HA ))
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assign ((  resid 33 and name HA ))
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assign ((  resid 33 and name HA ))
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assign ((  resid 33 and name HA ))
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assign ((  resid 33 and name HA ))
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assign ((  resid 33 and name HB ))
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assign ((  resid 33 and name HB ))
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assign ((  resid 33 and name HB ))
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assign ((  resid 33 and name HB ))
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assign ((  resid 33 and name HB ))
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assign ((  resid 33 and name HB ))
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assign ((  resid 33 and name QG1 ))
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assign ((  resid 33 and name QG1 ))
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assign ((  resid 33 and name QG1 ))
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assign ((  resid 33 and name QG1 ))
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assign ((  resid 33 and name QG1 ))
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assign ((  resid 33 and name QG1 ))
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assign ((  resid 34 and name HA ))
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assign ((  resid 34 and name HA ))
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assign ((  resid 34 and name HA ))
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assign ((  resid 34 and name HA ))
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assign ((  resid 34 and name HA ))
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assign ((  resid 34 and name QB ))
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assign ((  resid 34 and name QB ))
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assign ((  resid 34 and name QB ))
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assign ((  resid 34 and name QB ))
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assign ((  resid 36 and name HA ))
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assign ((  resid 36 and name HA ))
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assign ((  resid 36 and name HA ))
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assign ((  resid 36 and name HA ))
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assign ((  resid 36 and name HA ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 36 and name QB ))
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assign ((  resid 37 and name HB2 ))
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assign ((  resid 37 and name HB3 ))
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assign ((  resid 37 and name HB2 ))
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assign ((  resid 37 and name HB2 ))
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assign ((  resid 37 and name HB3 ))
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assign ((  resid 37 and name HB3 ))
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assign ((  resid 37 and name HB3 ))
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assign ((  resid 37 and name QE ))
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assign ((  resid 38 and name QG2 ))
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assign ((  resid 38 and name QG2 ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HA ))
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assign ((  resid 39 and name HB ))
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assign ((  resid 39 and name HB ))
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assign ((  resid 39 and name HB ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 39 and name QG1 ))
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assign ((  resid 40 and name HA ))
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assign ((  resid 40 and name HA ))
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assign ((  resid 40 and name HA ))
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assign ((  resid 40 and name HA ))
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assign ((  resid 41 and name HA# ))
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assign ((  resid 42 and name HB ))
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assign ((  resid 42 and name HB ))
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assign ((  resid 42 and name HB ))
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assign ((  resid 42 and name HB ))
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assign ((  resid 42 and name HB ))
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assign ((  resid 42 and name QG1 ))
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assign ((  resid 42 and name QG1 ))
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assign ((  resid 42 and name QG1 ))
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assign ((  resid 43 and name HA ))
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assign ((  resid 43 and name QB ))
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assign ((  resid 43 and name QG ))
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assign ((  resid 43 and name QG ))
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assign ((  resid 43 and name QG ))
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assign ((  resid 44 and name HA ))
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assign ((  resid 44 and name HA ))
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assign ((  resid 44 and name HA ))
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assign ((  resid 44 and name HA ))
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assign ((  resid 44 and name HA ))
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assign ((  resid 44 and name HA ))
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assign ((  resid 44 and name QB ))
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assign ((  resid 44 and name QB ))
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assign ((  resid 45 and name HA ))
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assign ((  resid 45 and name HA ))
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assign ((  resid 45 and name HA ))
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assign ((  resid 45 and name QB ))
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assign ((  resid 45 and name QB ))
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assign ((  resid 45 and name QB ))
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assign ((  resid 45 and name QB ))
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assign ((  resid 45 and name QB ))
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assign ((  resid 45 and name QB ))
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assign ((  resid 46 and name HA ))
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assign ((  resid 46 and name HG2 ))
       ((  resid 46 and name QE ))4.0 2.2 1.5
assign ((  resid 46 and name HG2 ))
       ((  resid 46 and name HG1 ))2.5 0.7 0.5
assign ((  resid 46 and name HG1 ))
       ((  resid 46 and name HG2 ))2.5 0.7 0.5
assign ((  resid 46 and name HG1 ))
       ((  resid 46 and name HN ))4.0 2.2 1.5
assign ((  resid 46 and name HG2 ))
       ((  resid 46 and name HN ))4.5 1.7 1.5
assign ((  resid 47 and name HA ))
       ((  resid 46 and name QD ))2.5 0.7 0.5
assign ((  resid 47 and name HA ))
       ((  resid 46 and name QE ))2.5 0.7 0.5
assign ((  resid 47 and name HA ))
       ((  resid 46 and name HG2 ))3.0 1.2 1.0
assign ((  resid 47 and name HA ))
       ((  resid 46 and name HG2 ))3.0 1.2 1.0
assign ((  resid 47 and name HA ))
       ((  resid 47 and name QB ))2.5 0.7 0.5
assign ((  resid 47 and name HA ))
       ((  resid 47 and name HN ))3.0 1.2 1.0
assign ((  resid 47 and name HA ))
       ((  resid 49 and name QG1 ))3.0 1.2 1.0
assign ((  resid 47 and name HA ))
       ((  resid 50 and name HG ))3.0 1.2 1.0
assign ((  resid 47 and name HA ))
       ((  resid 51 and name HN ))4.0 2.2 1.5
assign ((  resid 47 and name QB ))
       ((  resid 44 and name HA ))3.0 1.2 1.0
assign ((  resid 47 and name QB ))
       ((  resid 46 and name QD ))3.0 1.2 1.0
assign ((  resid 47 and name QB ))
       ((  resid 47 and name HN ))2.5 0.7 0.5
assign ((  resid 47 and name QB ))
       ((  resid 48 and name QB ))4.0 2.2 1.5
assign ((  resid 48 and name HA ))
       ((  resid 47 and name QB ))4.0 2.2 1.5
assign ((  resid 48 and name HA ))
       ((  resid 48 and name QB ))2.5 0.7 0.5
assign ((  resid 48 and name HA ))
       ((  resid 48 and name HN ))3.0 1.2 1.0
assign ((  resid 48 and name HA ))
       ((  resid 49 and name HA ))4.0 2.2 1.5
assign ((  resid 48 and name HA ))
       ((  resid 51 and name QB ))2.5 0.7 0.5
assign ((  resid 48 and name HA ))
       ((  resid 51 and name HN ))2.5 0.7 0.5
assign ((  resid 49 and name HA ))
       ((  resid 49 and name HB ))2.5 0.7 0.5
assign ((  resid 49 and name HA ))
       ((  resid 49 and name QD1 ))4.0 2.2 1.5
assign ((  resid 49 and name HA ))
       ((  resid 49 and name HN ))3.0 1.2 1.0
assign ((  resid 49 and name HA ))
       ((  resid 50 and name HN ))4.0 2.2 1.5
assign ((  resid 49 and name HA ))
       ((  resid 52 and name QB ))3.0 1.2 1.0
assign ((  resid 49 and name HA ))
       ((  resid 52 and name HN ))4.0 2.2 1.5
assign ((  resid 49 and name HB ))
       ((  resid 46 and name HA ))3.0 1.2 1.0
assign ((  resid 49 and name HB ))
       ((  resid 49 and name HA ))3.0 1.2 1.0
assign ((  resid 49 and name HB ))
       ((  resid 49 and name QD1 ))2.5 0.7 0.5
assign ((  resid 49 and name HB ))
       ((  resid 49 and name HN ))3.0 1.2 1.0
assign ((  resid 49 and name HB ))
       ((  resid 50 and name HN ))3.0 1.2 1.0
assign ((  resid 49 and name QD1 ))
       ((  resid 20 and name HA ))4.0 2.2 1.5
assign ((  resid 49 and name QD1 ))
       ((  resid 20 and name QD1 ))2.5 0.7 0.5
assign ((  resid 49 and name QD1 ))
       ((  resid 29 and name HB2 ))3.0 1.2 1.0
assign ((  resid 49 and name QD1 ))
       ((  resid 29 and name QD ))3.0 1.2 1.0
assign ((  resid 49 and name QD1 ))
       ((  resid 46 and name HA ))3.0 1.2 1.0
assign ((  resid 49 and name QD1 ))
       ((  resid 46 and name HG2 ))2.5 0.7 0.5
assign ((  resid 49 and name QD1 ))
       ((  resid 49 and name HB ))2.5 0.7 0.5
assign ((  resid 49 and name QD1 ))
       ((  resid 49 and name HN ))3.0 1.2 1.0
assign ((  resid 49 and name QD1 ))
       ((  resid 50 and name HN ))4.0 2.2 1.5
assign ((  resid 50 and name HA ))
       ((  resid 49 and name HA ))4.0 2.2 1.5
assign ((  resid 50 and name HA ))
       ((  resid 49 and name QD1 ))3.0 1.2 1.0
assign ((  resid 50 and name HA ))
       ((  resid 50 and name HB2 ))2.5 0.7 0.5
assign ((  resid 50 and name HA ))
       ((  resid 50 and name HB3 ))3.0 1.2 1.0
assign ((  resid 50 and name HA ))
       ((  resid 50 and name QD2 ))2.5 0.7 0.5
assign ((  resid 50 and name HA ))
       ((  resid 50 and name HN ))3.0 1.2 1.0
assign ((  resid 50 and name HA ))
       ((  resid 52 and name HA ))4.0 2.2 1.5
assign ((  resid 50 and name HA ))
       ((  resid 52 and name HN ))4.0 2.2 1.5
assign ((  resid 50 and name HA ))
       ((  resid 53 and name HN ))4.0 2.2 1.5
assign ((  resid 50 and name HB2 ))
       ((  resid 47 and name HA ))3.0 1.2 1.0
assign ((  resid 50 and name HB3 ))
       ((  resid 47 and name HA ))4.0 2.2 1.5
assign ((  resid 50 and name HB2 ))
       ((  resid 50 and name HA ))3.0 1.2 1.0
assign ((  resid 50 and name HB3 ))
       ((  resid 50 and name HA ))3.0 1.2 1.0
assign ((  resid 50 and name HB3 ))
       ((  resid 50 and name HB2 ))2.5 0.7 0.5
assign ((  resid 50 and name HB2 ))
       ((  resid 50 and name HB3 ))2.5 0.7 0.5
assign ((  resid 50 and name HB2 ))
       ((  resid 50 and name QD1 ))3.0 1.2 1.0
assign ((  resid 50 and name HB3 ))
       ((  resid 50 and name QD1 ))2.5 0.7 0.5
assign ((  resid 50 and name HB2 ))
       ((  resid 50 and name QD2 ))3.0 1.2 1.0
assign ((  resid 50 and name HB3 ))
       ((  resid 50 and name QD2 ))3.0 1.2 1.0
assign ((  resid 50 and name HB2 ))
       ((  resid 50 and name HN ))3.0 1.2 1.0
assign ((  resid 50 and name HB3 ))
       ((  resid 50 and name HN ))3.0 1.2 1.0
assign ((  resid 50 and name HB2 ))
       ((  resid 51 and name HN ))4.0 2.2 1.5
assign ((  resid 50 and name HB3 ))
       ((  resid 51 and name HN ))4.0 2.2 1.5
assign ((  resid 50 and name QD1 ))
       ((  resid 23 and name QD ))4.5 1.7 1.5
assign ((  resid 50 and name QD1 ))
       ((  resid 47 and name HA ))2.5 0.7 0.5
assign ((  resid 50 and name QD1 ))
       ((  resid 50 and name HA ))4.0 2.2 1.5
assign ((  resid 50 and name QD2 ))
       ((  resid 19 and name HA ))4.0 2.2 1.5
assign ((  resid 50 and name QD2 ))
       ((  resid 19 and name QB ))4.0 2.2 1.5
assign ((  resid 50 and name QD2 ))
       ((  resid 23 and name QD ))4.0 2.2 1.5
assign ((  resid 50 and name QD2 ))
       ((  resid 23 and name QE ))4.0 2.2 1.5
assign ((  resid 50 and name QD2 ))
       ((  resid 50 and name HA ))2.5 0.7 0.5
assign ((  resid 50 and name QD2 ))
       ((  resid 50 and name HB2 ))2.5 0.7 0.5
assign ((  resid 50 and name QD2 ))
       ((  resid 50 and name QD1 ))2.5 0.7 0.5
assign ((  resid 50 and name QD2 ))
       ((  resid 50 and name HG ))2.5 0.7 0.5
assign ((  resid 50 and name QD2 ))
       ((  resid 50 and name HN ))4.0 2.2 1.5
assign ((  resid 50 and name HG ))
       ((  resid 50 and name HA ))3.0 1.2 1.0
assign ((  resid 50 and name HG ))
       ((  resid 50 and name HB2 ))3.0 1.2 1.0
assign ((  resid 50 and name HG ))
       ((  resid 50 and name HN ))4.0 2.2 1.5
assign ((  resid 51 and name HA ))
       ((  resid 52 and name HN ))3.0 1.2 1.0
assign ((  resid 51 and name QB ))
       ((  resid 51 and name HA ))2.5 0.7 0.5
assign ((  resid 51 and name QB ))
       ((  resid 51 and name QD ))2.5 0.7 0.5
assign ((  resid 51 and name QB ))
       ((  resid 51 and name HN ))2.5 0.7 0.5
assign ((  resid 51 and name QB ))
       ((  resid 52 and name HN ))3.0 1.2 1.0
assign ((  resid 51 and name QD ))
       ((  resid 51 and name QE ))2.5 0.7 0.5
assign ((  resid 51 and name QE ))
       ((  resid 51 and name QD ))2.5 0.7 0.5
assign ((  resid 51 and name QG ))
       ((  resid 51 and name QE ))4.0 2.2 1.5
assign ((  resid 52 and name HA ))
       ((  resid 51 and name HA ))4.0 2.2 1.5
assign ((  resid 52 and name HA ))
       ((  resid 51 and name QB ))4.0 2.2 1.5
assign ((  resid 52 and name HA ))
       ((  resid 52 and name QB ))2.5 0.7 0.5
assign ((  resid 52 and name HA ))
       ((  resid 52 and name HN ))2.5 0.7 0.5
assign ((  resid 52 and name QB ))
       ((  resid 49 and name HA ))3.0 1.2 1.0
assign ((  resid 52 and name QB ))
       ((  resid 52 and name HA ))2.5 0.7 0.5
assign ((  resid 52 and name QB ))
       ((  resid 52 and name HN ))2.5 0.7 0.5
assign ((  resid 55 and name HA ))
       ((  resid 55 and name HB ))3.0 1.2 1.0
assign ((  resid 55 and name QG2 ))
       ((  resid 55 and name HA ))2.5 0.7 0.5

!CNS table made by NOEID from peak list: /fast/satchmo/hey/CNS/GAS-1/gas-1_15NNOESY.list
!On Mon Sep 26 12:10:12 2005
!Using these strengths for these volumes: 
!   2.5 0.7 0.5 > 9000000
!   3.0 1.2 1.0 > 3000000
!   4.0 2.2 1.5 > 1200000
!and including assignments only if there were 3 or less
!possible assignments found by NOEID.

assign ((  resid 2 and name HN ))
       ((  resid 2 and name HA ))3.0 1.2 1.0
assign ((  resid 2 and name HN ))
       ((  resid 2 and name QB ))3.0 1.2 1.0
assign ((  resid 3 and name HN ))
       ((  resid 3 and name QB ))4.5 1.7 1.5
assign ((  resid 3 and name HN ))
       ((  resid 4 and name HB ))4.5 1.7 1.5
assign ((  resid 3 and name HN ))
       ((  resid 4 and name HN ))4.5 1.7 1.5
assign ((  resid 3 and name HN ))
       ((  resid 5 and name HN ))4.5 1.7 1.5
assign ((  resid 4 and name HN ))
       ((  resid 4 and name HA ))4.0 2.2 1.5
assign ((  resid 4 and name HN ))
       ((  resid 4 and name HB ))4.0 2.2 1.5
assign ((  resid 4 and name HN ))
       ((  resid 4 and name QG1 ))4.0 2.2 1.5
assign ((  resid 4 and name HN ))
       ((  resid 5 and name HA ))3.0 1.2 1.0
assign ((  resid 5 and name HN ))
       ((  resid 3 and name QB ))4.5 1.7 1.5
assign ((  resid 5 and name HN ))
       ((  resid 4 and name HA ))3.0 1.2 1.0
assign ((  resid 5 and name HN ))
       ((  resid 4 and name HB ))4.5 1.7 1.5
assign ((  resid 5 and name HN ))
       ((  resid 4 and name QG1 ))4.5 1.7 1.5
assign ((  resid 5 and name HN ))
       ((  resid 5 and name HA ))4.0 2.2 1.5
assign ((  resid 5 and name HN ))
       ((  resid 5 and name HB2 ))4.0 2.2 1.5
assign ((  resid 5 and name HN ))
       ((  resid 5 and name HB3 ))4.0 2.2 1.5
assign ((  resid 5 and name HN ))
       ((  resid 6 and name QB ))4.5 1.7 1.5
assign ((  resid 5 and name HN ))
       ((  resid 6 and name HN ))4.0 2.2 1.5
assign ((  resid 6 and name HN ))
       ((  resid 3 and name QB ))4.5 1.7 1.5
assign ((  resid 6 and name HN ))
       ((  resid 4 and name HB ))4.5 1.7 1.5
assign ((  resid 6 and name HN ))
       ((  resid 4 and name QG1 ))4.5 1.7 1.5
assign ((  resid 6 and name HN ))
       ((  resid 5 and name HA ))3.0 1.2 1.0
assign ((  resid 6 and name HN ))
       ((  resid 5 and name HB2 ))4.5 1.7 1.5
assign ((  resid 6 and name HN ))
       ((  resid 5 and name HB3 ))4.5 1.7 1.5
assign ((  resid 6 and name HN ))
       ((  resid 5 and name HN ))4.0 2.2 1.5
assign ((  resid 6 and name HN ))
       ((  resid 6 and name HA ))4.0 2.2 1.5
assign ((  resid 6 and name HN ))
       ((  resid 6 and name QB ))3.0 1.2 1.0
assign ((  resid 6 and name HN ))
       ((  resid 9 and name HN ))4.5 1.7 1.5
assign ((  resid 7 and name HN ))
       ((  resid 6 and name HA ))4.5 1.7 1.5
assign ((  resid 7 and name HN ))
       ((  resid 6 and name QB ))4.5 1.7 1.5
assign ((  resid 7 and name HN ))
       ((  resid 7 and name HA ))4.5 1.7 1.5
assign ((  resid 7 and name HN ))
       ((  resid 7 and name QB ))4.0 2.2 1.5
assign ((  resid 7 and name HN ))
       ((  resid 9 and name HN ))4.5 1.7 1.5
assign ((  resid 8 and name HN ))
       ((  resid 4 and name HB ))4.5 1.7 1.5
assign ((  resid 8 and name HN ))
       ((  resid 5 and name HA ))4.0 2.2 1.5
assign ((  resid 8 and name HN ))
       ((  resid 6 and name QB ))4.5 1.7 1.5
assign ((  resid 8 and name HN ))
       ((  resid 7 and name HA ))4.5 1.7 1.5
assign ((  resid 8 and name HN ))
       ((  resid 7 and name QB ))4.0 2.2 1.5
assign ((  resid 8 and name HN ))
       ((  resid 7 and name HN ))4.0 2.2 1.5
assign ((  resid 8 and name HN ))
       ((  resid 8 and name HA ))3.0 1.2 1.0
assign ((  resid 8 and name HN ))
       ((  resid 8 and name QB ))4.0 2.2 1.5
assign ((  resid 8 and name HN ))
       ((  resid 9 and name HN ))4.0 2.2 1.5
assign ((  resid 8 and name HN ))
       ((  resid 11 and name QB ))4.5 1.7 1.5
assign ((  resid 9 and name HN ))
       ((  resid 5 and name HA ))4.5 1.7 1.5
assign ((  resid 9 and name HN ))
       ((  resid 7 and name HA ))4.5 1.7 1.5
assign ((  resid 9 and name HN ))
       ((  resid 7 and name QB ))4.5 1.7 1.5
assign ((  resid 9 and name HN ))
       ((  resid 7 and name HN ))4.5 1.7 1.5
assign ((  resid 9 and name HN ))
       ((  resid 8 and name HA ))3.0 1.2 1.0
assign ((  resid 9 and name HN ))
       ((  resid 8 and name HN ))3.0 1.2 1.0
assign ((  resid 9 and name HN ))
       ((  resid 9 and name HA ))4.0 2.2 1.5
assign ((  resid 9 and name HN ))
       ((  resid 9 and name QB ))4.0 2.2 1.5
assign ((  resid 9 and name HN ))
       ((  resid 9 and name QD1 ))4.0 2.2 1.5
assign ((  resid 9 and name HN ))
       ((  resid 9 and name QD2 ))4.5 1.7 1.5
assign ((  resid 10 and name HN ))
       ((  resid 9 and name QB ))4.0 2.2 1.5
assign ((  resid 10 and name HN ))
       ((  resid 10 and name QB ))4.0 2.2 1.5
assign ((  resid 10 and name HN ))
       ((  resid 10 and name QB ))3.0 1.2 1.0
assign ((  resid 11 and name HN ))
       ((  resid 7 and name HA ))4.5 1.7 1.5
assign ((  resid 11 and name HN ))
       ((  resid 9 and name QD1 ))4.5 1.7 1.5
assign ((  resid 11 and name HN ))
       ((  resid 10 and name QB ))4.0 2.2 1.5
assign ((  resid 11 and name HN ))
       ((  resid 11 and name HA ))3.0 1.2 1.0
assign ((  resid 11 and name HN ))
       ((  resid 11 and name QB ))3.0 1.2 1.0
assign ((  resid 11 and name HN ))
       ((  resid 11 and name HG2 ))3.0 1.2 1.0
assign ((  resid 11 and name HN ))
       ((  resid 13 and name QG ))3.0 1.2 1.0
assign ((  resid 12 and name HN ))
       ((  resid 8 and name HA ))4.0 2.2 1.5
assign ((  resid 12 and name HN ))
       ((  resid 11 and name HA ))4.0 2.2 1.5
assign ((  resid 12 and name HN ))
       ((  resid 11 and name QB ))3.0 1.2 1.0
assign ((  resid 12 and name HN ))
       ((  resid 11 and name HG1 ))4.5 1.7 1.5
assign ((  resid 12 and name HN ))
       ((  resid 11 and name HG2 ))3.0 1.2 1.0
assign ((  resid 12 and name HN ))
       ((  resid 12 and name HA ))3.0 1.2 1.0
assign ((  resid 12 and name HN ))
       ((  resid 12 and name QB ))3.0 1.2 1.0
assign ((  resid 12 and name HN ))
       ((  resid 13 and name HA ))4.5 1.7 1.5
assign ((  resid 12 and name HN ))
       ((  resid 39 and name QG1 ))4.5 1.7 1.5
assign ((  resid 13 and name HN ))
       ((  resid 11 and name HG1 ))4.5 1.7 1.5
assign ((  resid 13 and name HN ))
       ((  resid 12 and name HA ))4.0 2.2 1.5
assign ((  resid 13 and name HN ))
       ((  resid 13 and name HA ))4.0 2.2 1.5
assign ((  resid 13 and name HN ))
       ((  resid 13 and name HB2 ))3.0 1.2 1.0
assign ((  resid 13 and name HN ))
       ((  resid 13 and name QG ))3.0 1.2 1.0
assign ((  resid 13 and name HN ))
       ((  resid 14 and name HN ))3.0 1.2 1.0
assign ((  resid 13 and name HN ))
       ((  resid 15 and name HN ))3.0 1.2 1.0
assign ((  resid 13 and name HN ))
       ((  resid 33 and name QG2 ))4.0 2.2 1.5
assign ((  resid 13 and name HN ))
       ((  resid 42 and name QG1 ))4.5 1.7 1.5
assign ((  resid 14 and name HN ))
       ((  resid 11 and name HA ))3.0 1.2 1.0
assign ((  resid 14 and name HN ))
       ((  resid 11 and name HG1 ))4.5 1.7 1.5
assign ((  resid 14 and name HN ))
       ((  resid 13 and name HB2 ))3.0 1.2 1.0
assign ((  resid 14 and name HN ))
       ((  resid 13 and name HN ))3.0 1.2 1.0
assign ((  resid 14 and name HN ))
       ((  resid 14 and name HA ))3.0 1.2 1.0
assign ((  resid 14 and name HN ))
       ((  resid 14 and name QB ))2.5 0.7 0.5
assign ((  resid 14 and name HN ))
       ((  resid 14 and name QG ))3.0 1.2 1.0
assign ((  resid 14 and name HN ))
       ((  resid 17 and name QG2 ))4.0 2.2 1.5
assign ((  resid 14 and name HN ))
       ((  resid 17 and name QG2 ))4.0 2.2 1.5
assign ((  resid 15 and name HN ))
       ((  resid 11 and name HA ))4.0 2.2 1.5
assign ((  resid 15 and name HN ))
       ((  resid 11 and name HG1 ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 12 and name HA ))4.0 2.2 1.5
assign ((  resid 15 and name HN ))
       ((  resid 13 and name HA ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 13 and name HA ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 13 and name QG ))3.0 1.2 1.0
assign ((  resid 15 and name HN ))
       ((  resid 13 and name QG ))3.0 1.2 1.0
assign ((  resid 15 and name HN ))
       ((  resid 14 and name HA ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 14 and name HA ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 14 and name QB ))4.0 2.2 1.5
assign ((  resid 15 and name HN ))
       ((  resid 14 and name QB ))3.0 1.2 1.0
assign ((  resid 15 and name HN ))
       ((  resid 15 and name HA ))4.0 2.2 1.5
assign ((  resid 15 and name HN ))
       ((  resid 15 and name QB ))3.0 1.2 1.0
assign ((  resid 15 and name HN ))
       ((  resid 15 and name QB ))3.0 1.2 1.0
assign ((  resid 15 and name HN ))
       ((  resid 17 and name QG2 ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 17 and name QG2 ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 17 and name HN ))4.5 1.7 1.5
assign ((  resid 15 and name HN ))
       ((  resid 17 and name HN ))4.5 1.7 1.5
assign ((  resid 16 and name HN ))
       ((  resid 13 and name HA ))4.5 1.7 1.5
assign ((  resid 16 and name HN ))
       ((  resid 16 and name HA ))3.0 1.2 1.0
assign ((  resid 16 and name HN ))
       ((  resid 16 and name QB ))3.0 1.2 1.0
assign ((  resid 16 and name HN ))
       ((  resid 17 and name QG2 ))4.0 2.2 1.5
assign ((  resid 16 and name HN ))
       ((  resid 17 and name HN ))3.0 1.2 1.0
assign ((  resid 17 and name HN ))
       ((  resid 13 and name HA ))4.0 2.2 1.5
assign ((  resid 17 and name HN ))
       ((  resid 14 and name HA ))4.0 2.2 1.5
assign ((  resid 17 and name HN ))
       ((  resid 15 and name HA ))4.0 2.2 1.5
assign ((  resid 17 and name HN ))
       ((  resid 16 and name QB ))4.0 2.2 1.5
assign ((  resid 17 and name HN ))
       ((  resid 16 and name HN ))3.0 1.2 1.0
assign ((  resid 17 and name HN ))
       ((  resid 17 and name HA ))4.5 1.7 1.5
assign ((  resid 17 and name HN ))
       ((  resid 17 and name HB ))4.0 2.2 1.5
assign ((  resid 17 and name HN ))
       ((  resid 17 and name QG2 ))3.0 1.2 1.0
assign ((  resid 17 and name HN ))
       ((  resid 19 and name HN ))4.5 1.7 1.5
assign ((  resid 17 and name HN ))
       ((  resid 33 and name QD1 ))3.0 1.2 1.0
assign ((  resid 19 and name HN ))
       ((  resid 17 and name HA ))3.0 1.2 1.0
assign ((  resid 19 and name HN ))
       ((  resid 18 and name QB ))3.0 1.2 1.0
assign ((  resid 19 and name HN ))
       ((  resid 18 and name HN ))3.0 1.2 1.0
assign ((  resid 19 and name HN ))
       ((  resid 19 and name HA ))3.0 1.2 1.0
assign ((  resid 19 and name HN ))
       ((  resid 19 and name QB ))3.0 1.2 1.0
assign ((  resid 19 and name HN ))
       ((  resid 19 and name QG ))4.0 2.2 1.5
assign ((  resid 19 and name HN ))
       ((  resid 20 and name HN ))3.0 1.2 1.0
assign ((  resid 20 and name HN ))
       ((  resid 17 and name HA ))4.0 2.2 1.5
assign ((  resid 20 and name HN ))
       ((  resid 18 and name HA ))4.5 1.7 1.5
assign ((  resid 20 and name HN ))
       ((  resid 18 and name HN ))4.5 1.7 1.5
assign ((  resid 20 and name HN ))
       ((  resid 19 and name QB ))3.0 1.2 1.0
assign ((  resid 20 and name HN ))
       ((  resid 19 and name HN ))3.0 1.2 1.0
assign ((  resid 20 and name HN ))
       ((  resid 20 and name HA ))4.0 2.2 1.5
assign ((  resid 20 and name HN ))
       ((  resid 20 and name QB ))3.0 1.2 1.0
assign ((  resid 20 and name HN ))
       ((  resid 20 and name QD1 ))4.0 2.2 1.5
assign ((  resid 20 and name HN ))
       ((  resid 20 and name HG ))4.0 2.2 1.5
assign ((  resid 20 and name HN ))
       ((  resid 23 and name QD ))4.5 1.7 1.5
assign ((  resid 20 and name HN ))
       ((  resid 23 and name HN ))4.5 1.7 1.5
assign ((  resid 21 and name HN ))
       ((  resid 17 and name HA ))4.0 2.2 1.5
assign ((  resid 21 and name HN ))
       ((  resid 20 and name HN ))3.0 1.2 1.0
assign ((  resid 21 and name HN ))
       ((  resid 20 and name HN ))4.0 2.2 1.5
assign ((  resid 21 and name HN ))
       ((  resid 21 and name HA ))3.0 1.2 1.0
assign ((  resid 21 and name HN ))
       ((  resid 21 and name HA ))4.0 2.2 1.5
assign ((  resid 21 and name HN ))
       ((  resid 21 and name QB ))3.0 1.2 1.0
assign ((  resid 21 and name HN ))
       ((  resid 21 and name QE ))4.5 1.7 1.5
assign ((  resid 21 and name HN ))
       ((  resid 21 and name QE ))4.5 1.7 1.5
assign ((  resid 21 and name HN ))
       ((  resid 21 and name QG ))4.0 2.2 1.5
assign ((  resid 21 and name HN ))
       ((  resid 22 and name HN ))4.0 2.2 1.5
assign ((  resid 21 and name HN ))
       ((  resid 22 and name HN ))3.0 1.2 1.0
assign ((  resid 22 and name HN ))
       ((  resid 19 and name HA ))4.0 2.2 1.5
assign ((  resid 22 and name HN ))
       ((  resid 20 and name HA ))4.0 2.2 1.5
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assign ((  resid 22 and name HN ))
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assign ((  resid 22 and name HN ))
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assign ((  resid 22 and name HN ))
       ((  resid 22 and name QB ))3.0 1.2 1.0
assign ((  resid 22 and name HN ))
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assign ((  resid 22 and name HN ))
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assign ((  resid 23 and name HN ))
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assign ((  resid 23 and name HN ))
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assign ((  resid 23 and name HN ))
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assign ((  resid 23 and name HN ))
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assign ((  resid 23 and name HN ))
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assign ((  resid 24 and name HN ))
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assign ((  resid 24 and name HN ))
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assign ((  resid 24 and name HN ))
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assign ((  resid 24 and name HN ))
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assign ((  resid 24 and name HN ))
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assign ((  resid 25 and name HN ))
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assign ((  resid 25 and name HN ))
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assign ((  resid 26 and name HN ))
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assign ((  resid 27 and name HN ))
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assign ((  resid 27 and name HN ))
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assign ((  resid 27 and name HN ))
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assign ((  resid 28 and name HN ))
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assign ((  resid 28 and name HN ))
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assign ((  resid 28 and name HN ))
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assign ((  resid 28 and name HN ))
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assign ((  resid 29 and name HN ))
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assign ((  resid 29 and name HN ))
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assign ((  resid 29 and name HN ))
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assign ((  resid 29 and name HN ))
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assign ((  resid 29 and name HN ))
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assign ((  resid 30 and name HN ))
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assign ((  resid 30 and name HN ))
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assign ((  resid 30 and name HN ))
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assign ((  resid 30 and name HN ))
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assign ((  resid 30 and name HN ))
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assign ((  resid 31 and name HN ))
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assign ((  resid 31 and name HN ))
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assign ((  resid 31 and name HN ))
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assign ((  resid 31 and name HN ))
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assign ((  resid 32 and name HN ))
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assign ((  resid 32 and name HN ))
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assign ((  resid 32 and name HN ))
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assign ((  resid 32 and name HN ))
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assign ((  resid 33 and name HN ))
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assign ((  resid 34 and name HN ))
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assign ((  resid 36 and name HN ))
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       ((  resid 48 and name HA ))3.0 1.2 1.0
assign ((  resid 48 and name HN ))
       ((  resid 48 and name QB ))3.0 1.2 1.0
assign ((  resid 48 and name HN ))
       ((  resid 48 and name QG ))3.0 1.2 1.0
assign ((  resid 48 and name HN ))
       ((  resid 50 and name QD1 ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 45 and name HA ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 46 and name HA ))4.0 2.2 1.5
assign ((  resid 49 and name HN ))
       ((  resid 46 and name HG2 ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 47 and name HA ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 48 and name HA ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 48 and name QB ))4.0 2.2 1.5
assign ((  resid 49 and name HN ))
       ((  resid 48 and name QG ))4.0 2.2 1.5
assign ((  resid 49 and name HN ))
       ((  resid 48 and name HN ))3.0 1.2 1.0
assign ((  resid 49 and name HN ))
       ((  resid 49 and name HA ))4.0 2.2 1.5
assign ((  resid 49 and name HN ))
       ((  resid 49 and name QG1 ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 50 and name QD1 ))3.0 1.2 1.0
assign ((  resid 49 and name HN ))
       ((  resid 51 and name HN ))4.5 1.7 1.5
assign ((  resid 49 and name HN ))
       ((  resid 52 and name HN ))4.5 1.7 1.5
assign ((  resid 50 and name HN ))
       ((  resid 47 and name HA ))4.5 1.7 1.5
assign ((  resid 50 and name HN ))
       ((  resid 49 and name HA ))4.5 1.7 1.5
assign ((  resid 50 and name HN ))
       ((  resid 49 and name HA ))4.5 1.7 1.5
assign ((  resid 50 and name HN ))
       ((  resid 50 and name HA ))4.0 2.2 1.5
assign ((  resid 50 and name HN ))
       ((  resid 50 and name HB3 ))4.0 2.2 1.5
assign ((  resid 50 and name HN ))
       ((  resid 50 and name HB3 ))4.0 2.2 1.5
assign ((  resid 50 and name HN ))
       ((  resid 50 and name QD1 ))3.0 1.2 1.0
assign ((  resid 50 and name HN ))
       ((  resid 50 and name QD1 ))4.0 2.2 1.5
assign ((  resid 50 and name HN ))
       ((  resid 50 and name QD2 ))4.5 1.7 1.5
assign ((  resid 50 and name HN ))
       ((  resid 50 and name QD2 ))4.0 2.2 1.5
assign ((  resid 50 and name HN ))
       ((  resid 51 and name HN ))3.0 1.2 1.0
assign ((  resid 50 and name HN ))
       ((  resid 52 and name HN ))4.5 1.7 1.5
assign ((  resid 51 and name HN ))
       ((  resid 49 and name HA ))4.5 1.7 1.5
assign ((  resid 51 and name HN ))
       ((  resid 50 and name HA ))4.5 1.7 1.5
assign ((  resid 51 and name HN ))
       ((  resid 50 and name HB2 ))4.0 2.2 1.5
assign ((  resid 51 and name HN ))
       ((  resid 50 and name QD1 ))4.5 1.7 1.5
assign ((  resid 51 and name HN ))
       ((  resid 50 and name QD2 ))4.5 1.7 1.5
assign ((  resid 51 and name HN ))
       ((  resid 51 and name HA ))3.0 1.2 1.0
assign ((  resid 51 and name HN ))
       ((  resid 51 and name QB ))3.0 1.2 1.0
assign ((  resid 51 and name HN ))
       ((  resid 51 and name QG ))4.0 2.2 1.5
assign ((  resid 52 and name HN ))
       ((  resid 49 and name HA ))4.5 1.7 1.5
assign ((  resid 52 and name HN ))
       ((  resid 50 and name HA ))4.5 1.7 1.5
assign ((  resid 52 and name HN ))
       ((  resid 50 and name QD1 ))4.5 1.7 1.5
assign ((  resid 52 and name HN ))
       ((  resid 51 and name HA ))4.0 2.2 1.5
assign ((  resid 52 and name HN ))
       ((  resid 51 and name QB ))4.0 2.2 1.5
assign ((  resid 52 and name HN ))
       ((  resid 51 and name HN ))3.0 1.2 1.0
assign ((  resid 52 and name HN ))
       ((  resid 52 and name HA ))4.0 2.2 1.5
assign ((  resid 52 and name HN ))
       ((  resid 52 and name QB ))3.0 1.2 1.0
assign ((  resid 53 and name HN ))
       ((  resid 49 and name HA ))4.5 1.7 1.5
assign ((  resid 53 and name HN ))
       ((  resid 50 and name HA ))4.0 2.2 1.5
assign ((  resid 53 and name HN ))
       ((  resid 51 and name HA ))4.0 2.2 1.5
assign ((  resid 53 and name HN ))
       ((  resid 52 and name HA ))3.0 1.2 1.0
assign ((  resid 53 and name HN ))
       ((  resid 52 and name QB ))4.0 2.2 1.5
assign ((  resid 55 and name HN ))
       ((  resid 55 and name HA ))4.0 2.2 1.5
assign ((  resid 55 and name HN ))
       ((  resid 55 and name HB ))3.0 1.2 1.0
assign ((  resid 55 and name HN ))
       ((  resid 55 and name QG2 ))4.5 1.7 1.5
assign ((  resid 55 and name HN ))
       ((  resid 56 and name HN ))4.0 2.2 1.5
assign ((  resid 56 and name HN ))
       ((  resid 55 and name HB ))4.0 2.2 1.5
assign ((  resid 56 and name HN ))
       ((  resid 55 and name QG2 ))4.5 1.7 1.5
assign ((  resid 56 and name HN ))
       ((  resid 55 and name HN ))4.0 2.2 1.5
!ASN7
assign  (resid 6   and name  C)  (resid 7   and name N) !PHI restraint
        (resid 7   and name CA)  (resid 7   and name C) 1.0  -65.4   25.0 2
assign  (resid 7   and name  N)  (resid 7   and name CA) !PSI restraint
        (resid 7   and name C)  (resid 8   and name N) 1.0  -38.9    8.5 2
!SER8
assign  (resid 7   and name  C)  (resid 8   and name N) !PHI restraint
        (resid 8   and name CA)  (resid 8   and name C) 1.0  -66.2   25.0 2
assign  (resid 8   and name  N)  (resid 8   and name CA) !PSI restraint
        (resid 8   and name C)  (resid 9   and name N) 1.0  -41.5    9.6 2
!LEU9
assign  (resid 8   and name  C)  (resid 9   and name N) !PHI restraint
        (resid 9   and name CA)  (resid 9   and name C) 1.0  -65.9   25.0 2
assign  (resid 9   and name  N)  (resid 9   and name CA) !PSI restraint
        (resid 9   and name C)  (resid 10  and name N) 1.0  -32.2   12.7 2
!GLN11
assign  (resid 10  and name  C)  (resid 11  and name N) !PHI restraint
        (resid 11  and name CA)  (resid 11  and name C) 1.0  -68.2   25.0 2
assign  (resid 11  and name  N)  (resid 11  and name CA) !PSI restraint
        (resid 11  and name C)  (resid 12  and name N) 1.0  -38.1   16.4 2
!LYS13
assign  (resid 12  and name  C)  (resid 13  and name N) !PHI restraint
        (resid 13  and name CA)  (resid 13  and name C) 1.0  -62.3   25.0 2
assign  (resid 13  and name  N)  (resid 13  and name CA) !PSI restraint
        (resid 13  and name C)  (resid 14  and name N) 1.0  -41.9   16.4 2
!GLU14
assign  (resid 13  and name  C)  (resid 14  and name N) !PHI restraint
        (resid 14  and name CA)  (resid 14  and name C) 1.0  -63.4   25.0 2
assign  (resid 14  and name  N)  (resid 14  and name CA) !PSI restraint
        (resid 14  and name C)  (resid 15  and name N) 1.0  -37.0   16.3 2
!ALA15
assign  (resid 14  and name  C)  (resid 15  and name N) !PHI restraint
        (resid 15  and name CA)  (resid 15  and name C) 1.0  -62.7   25.0 2
assign  (resid 15  and name  N)  (resid 15  and name CA) !PSI restraint
        (resid 15  and name C)  (resid 16  and name N) 1.0  -36.7   16.4 2
!ALA16
assign  (resid 15  and name  C)  (resid 16  and name N) !PHI restraint
        (resid 16  and name CA)  (resid 16  and name C) 1.0  -61.9   25.0 2
assign  (resid 16  and name  N)  (resid 16  and name CA) !PSI restraint
        (resid 16  and name C)  (resid 17  and name N) 1.0  -42.2   16.4 2
!ILE17
assign  (resid 16  and name  C)  (resid 17  and name N) !PHI restraint
        (resid 17  and name CA)  (resid 17  and name C) 1.0  -68.3   25.0 2
assign  (resid 17  and name  N)  (resid 17  and name CA) !PSI restraint
        (resid 17  and name C)  (resid 18  and name N) 1.0  -36.3   16.4 2
!LYS18
assign  (resid 17  and name  C)  (resid 18  and name N) !PHI restraint
        (resid 18  and name CA)  (resid 18  and name C) 1.0  -66.8   25.0 2
assign  (resid 18  and name  N)  (resid 18  and name CA) !PSI restraint
        (resid 18  and name C)  (resid 19  and name N) 1.0  -32.8   16.4 2
!GLU19
assign  (resid 18  and name  C)  (resid 19  and name N) !PHI restraint
        (resid 19  and name CA)  (resid 19  and name C) 1.0  -64.8   25.0 2
assign  (resid 19  and name  N)  (resid 19  and name CA) !PSI restraint
        (resid 19  and name C)  (resid 20  and name N) 1.0  -32.5   16.3 2
!LEU20
assign  (resid 19  and name  C)  (resid 20  and name N) !PHI restraint
        (resid 20  and name CA)  (resid 20  and name C) 1.0  -63.5   25.0 2
assign  (resid 20  and name  N)  (resid 20  and name CA) !PSI restraint
        (resid 20  and name C)  (resid 21  and name N) 1.0  -34.8   16.4 2
!LYS21
assign  (resid 20  and name  C)  (resid 21  and name N) !PHI restraint
        (resid 21  and name CA)  (resid 21  and name C) 1.0  -63.6   25.0 2
assign  (resid 21  and name  N)  (resid 21  and name CA) !PSI restraint
        (resid 21  and name C)  (resid 22  and name N) 1.0  -39.5   16.3 2
!GLN22
assign  (resid 21  and name  C)  (resid 22  and name N) !PHI restraint
        (resid 22  and name CA)  (resid 22  and name C) 1.0  -63.6   25.0 2
assign  (resid 22  and name  N)  (resid 22  and name CA) !PSI restraint
        (resid 22  and name C)  (resid 23  and name N) 1.0  -43.4   16.4 2
!TYR23
assign  (resid 22  and name  C)  (resid 23  and name N) !PHI restraint
        (resid 23  and name CA)  (resid 23  and name C) 1.0  -76.0   25.0 2
assign  (resid 23  and name  N)  (resid 23  and name CA) !PSI restraint
        (resid 23  and name C)  (resid 24  and name N) 1.0  -28.9   16.4 2
!ASP27
assign  (resid 26  and name  C)  (resid 27  and name N) !PHI restraint
        (resid 27  and name CA)  (resid 27  and name C) 1.0  -64.0   25.0 2
assign  (resid 27  and name  N)  (resid 27  and name CA) !PSI restraint
        (resid 27  and name C)  (resid 28  and name N) 1.0  -39.5   16.4 2
!TYR28
assign  (resid 27  and name  C)  (resid 28  and name N) !PHI restraint
        (resid 28  and name CA)  (resid 28  and name C) 1.0  -62.2   25.0 2
assign  (resid 28  and name  N)  (resid 28  and name CA) !PSI restraint
        (resid 28  and name C)  (resid 29  and name N) 1.0  -43.5   16.3 2
!TYR29
assign  (resid 28  and name  C)  (resid 29  and name N) !PHI restraint
        (resid 29  and name CA)  (resid 29  and name C) 1.0  -62.3   25.0 2
assign  (resid 29  and name  N)  (resid 29  and name CA) !PSI restraint
        (resid 29  and name C)  (resid 30  and name N) 1.0  -40.1   16.3 2
!ILE30
assign  (resid 29  and name  C)  (resid 30  and name N) !PHI restraint
        (resid 30  and name CA)  (resid 30  and name C) 1.0  -63.2   25.0 2
assign  (resid 30  and name  N)  (resid 30  and name CA) !PSI restraint
        (resid 30  and name C)  (resid 31  and name N) 1.0  -42.2   16.4 2
!LYS31
assign  (resid 30  and name  C)  (resid 31  and name N) !PHI restraint
        (resid 31  and name CA)  (resid 31  and name C) 1.0  -63.3   24.9 2
assign  (resid 31  and name  N)  (resid 31  and name CA) !PSI restraint
        (resid 31  and name C)  (resid 32  and name N) 1.0  -34.9   16.4 2
!ILE33
assign  (resid 32  and name  C)  (resid 33  and name N) !PHI restraint
        (resid 33  and name CA)  (resid 33  and name C) 1.0  -65.4   25.0 2
assign  (resid 33  and name  N)  (resid 33  and name CA) !PSI restraint
        (resid 33  and name C)  (resid 34  and name N) 1.0  -40.6   16.3 2
!ASN34
assign  (resid 33  and name  C)  (resid 34  and name N) !PHI restraint
        (resid 34  and name CA)  (resid 34  and name C) 1.0  -61.9   25.0 2
assign  (resid 34  and name  N)  (resid 34  and name CA) !PSI restraint
        (resid 34  and name C)  (resid 35  and name N) 1.0  -39.9   16.4 2
!ASN35
assign  (resid 34  and name  C)  (resid 35  and name N) !PHI restraint
        (resid 35  and name CA)  (resid 35  and name C) 1.0  -68.4   25.0 2
assign  (resid 35  and name  N)  (resid 35  and name CA) !PSI restraint
        (resid 35  and name C)  (resid 36  and name N) 1.0  -37.6   16.4 2
!GLY41
assign  (resid 40  and name  C)  (resid 41  and name N) !PHI restraint
        (resid 41  and name CA)  (resid 41  and name C) 1.0  -64.1   25.0 2
assign  (resid 41  and name  N)  (resid 41  and name CA) !PSI restraint
        (resid 41  and name C)  (resid 42  and name N) 1.0  -41.5   16.3 2
!VAL42
assign  (resid 41  and name  C)  (resid 42  and name N) !PHI restraint
        (resid 42  and name CA)  (resid 42  and name C) 1.0  -66.1   25.0 2
assign  (resid 42  and name  N)  (resid 42  and name CA) !PSI restraint
        (resid 42  and name C)  (resid 43  and name N) 1.0  -39.6   16.4 2
!GLU43
assign  (resid 42  and name  C)  (resid 43  and name N) !PHI restraint
        (resid 43  and name CA)  (resid 43  and name C) 1.0  -59.0   25.0 2
assign  (resid 43  and name  N)  (resid 43  and name CA) !PSI restraint
        (resid 43  and name C)  (resid 44  and name N) 1.0  -43.4   16.4 2
!SER44
assign  (resid 43  and name  C)  (resid 44  and name N) !PHI restraint
        (resid 44  and name CA)  (resid 44  and name C) 1.0  -67.5   25.0 2
assign  (resid 44  and name  N)  (resid 44  and name CA) !PSI restraint
        (resid 44  and name C)  (resid 45  and name N) 1.0  -39.4   16.4 2
!LEU45
assign  (resid 44  and name  C)  (resid 45  and name N) !PHI restraint
        (resid 45  and name CA)  (resid 45  and name C) 1.0  -68.3   25.0 2
assign  (resid 45  and name  N)  (resid 45  and name CA) !PSI restraint
        (resid 45  and name C)  (resid 46  and name N) 1.0  -43.1   16.3 2
!LYS46
assign  (resid 45  and name  C)  (resid 46  and name N) !PHI restraint
        (resid 46  and name CA)  (resid 46  and name C) 1.0  -62.7   25.0 2
assign  (resid 46  and name  N)  (resid 46  and name CA) !PSI restraint
        (resid 46  and name C)  (resid 47  and name N) 1.0  -41.3   16.4 2
!GLU48
assign  (resid 47  and name  C)  (resid 48  and name N) !PHI restraint
        (resid 48  and name CA)  (resid 48  and name C) 1.0  -64.2   25.0 2
assign  (resid 48  and name  N)  (resid 48  and name CA) !PSI restraint
        (resid 48  and name C)  (resid 49  and name N) 1.0  -42.4   16.4 2
!ILE49
assign  (resid 48  and name  C)  (resid 49  and name N) !PHI restraint
        (resid 49  and name CA)  (resid 49  and name C) 1.0  -69.8   25.0 2
assign  (resid 49  and name  N)  (resid 49  and name CA) !PSI restraint
        (resid 49  and name C)  (resid 50  and name N) 1.0  -44.8   16.4 2
!LYS51
assign  (resid 50  and name  C)  (resid 51  and name N) !PHI restraint
        (resid 51  and name CA)  (resid 51  and name C) 1.0  -66.8   25.0 2
assign  (resid 51  and name  N)  (resid 51  and name CA) !PSI restraint
        (resid 51  and name C)  (resid 52  and name N) 1.0  -35.0   16.3 2

!ASP5
assign  (resid 5   and name  O)  (resid 9   and name HN) 1.8 0.4 0.9
assign  (resid 5   and name  O)  (resid 9   and name  N) 2.8 0.4 0.9
!ALA6
assign  (resid 6   and name  O)  (resid 10  and name HN) 1.8 0.4 0.9
assign  (resid 6   and name  O)  (resid 10  and name  N) 2.8 0.4 0.9
!ASN7
assign  (resid 7   and name  O)  (resid 11  and name HN) 1.8 0.4 0.9
assign  (resid 7   and name  O)  (resid 11  and name  N) 2.8 0.4 0.9
!SER8
assign  (resid 8   and name  O)  (resid 12  and name HN) 1.8 0.4 0.9
assign  (resid 8   and name  O)  (resid 12  and name  N) 2.8 0.4 0.9
!LEU9
assign  (resid 9   and name  O)  (resid 13  and name HN) 1.8 0.4 0.9
assign  (resid 9   and name  O)  (resid 13  and name  N) 2.8 0.4 0.9
!ALA10
assign  (resid 10  and name  O)  (resid 14  and name HN) 1.8 0.4 0.9
assign  (resid 10  and name  O)  (resid 14  and name  N) 2.8 0.4 0.9
!GLN11
assign  (resid 11  and name  O)  (resid 15  and name HN) 1.8 0.4 0.9
assign  (resid 11  and name  O)  (resid 15  and name  N) 2.8 0.4 0.9
!ALA12
assign  (resid 12  and name  O)  (resid 16  and name HN) 1.8 0.4 0.9
assign  (resid 12  and name  O)  (resid 16  and name  N) 2.8 0.4 0.9
!LYS13
assign  (resid 13  and name  O)  (resid 17  and name HN) 1.8 0.4 0.9
assign  (resid 13  and name  O)  (resid 17  and name  N) 2.8 0.4 0.9
!GLU14
assign  (resid 14  and name  O)  (resid 18  and name HN) 1.8 0.4 0.9
assign  (resid 14  and name  O)  (resid 18  and name  N) 2.8 0.4 0.9
!ALA15
assign  (resid 15  and name  O)  (resid 19  and name HN) 1.8 0.4 0.9
assign  (resid 15  and name  O)  (resid 19  and name  N) 2.8 0.4 0.9
!ALA16
assign  (resid 16  and name  O)  (resid 20  and name HN) 1.8 0.4 0.9
assign  (resid 16  and name  O)  (resid 20  and name  N) 2.8 0.4 0.9
!ILE17
assign  (resid 17  and name  O)  (resid 21  and name HN) 1.8 0.4 0.9
assign  (resid 17  and name  O)  (resid 21  and name  N) 2.8 0.4 0.9
!LYS18
assign  (resid 18  and name  O)  (resid 22  and name HN) 1.8 0.4 0.9
assign  (resid 18  and name  O)  (resid 22  and name  N) 2.8 0.4 0.9
!GLU19
assign  (resid 19  and name  O)  (resid 23  and name HN) 1.8 0.4 0.9
assign  (resid 19  and name  O)  (resid 23  and name  N) 2.8 0.4 0.9
!ASP27
assign  (resid 27  and name  O)  (resid 31  and name HN) 1.8 0.4 0.9
assign  (resid 27  and name  O)  (resid 31  and name  N) 2.8 0.4 0.9
!TYR28
assign  (resid 28  and name  O)  (resid 32  and name HN) 1.8 0.4 0.9
assign  (resid 28  and name  O)  (resid 32  and name  N) 2.8 0.4 0.9
!TYR29
assign  (resid 29  and name  O)  (resid 33  and name HN) 1.8 0.4 0.9
assign  (resid 29  and name  O)  (resid 33  and name  N) 2.8 0.4 0.9
!ILE30
assign  (resid 30  and name  O)  (resid 34  and name HN) 1.8 0.4 0.9
assign  (resid 30  and name  O)  (resid 34  and name  N) 2.8 0.4 0.9
!VAL39
assign  (resid 39  and name  O)  (resid 43  and name HN) 1.8 0.4 0.9
assign  (resid 39  and name  O)  (resid 43  and name  N) 2.8 0.4 0.9
!GLU40
assign  (resid 40  and name  O)  (resid 44  and name HN) 1.8 0.4 0.9
assign  (resid 40  and name  O)  (resid 44  and name  N) 2.8 0.4 0.9
!GLY41
assign  (resid 41  and name  O)  (resid 45  and name HN) 1.8 0.4 0.9
assign  (resid 41  and name  O)  (resid 45  and name  N) 2.8 0.4 0.9
!VAL42
assign  (resid 42  and name  O)  (resid 46  and name HN) 1.8 0.4 0.9
assign  (resid 42  and name  O)  (resid 46  and name  N) 2.8 0.4 0.9
!GLU43
assign  (resid 43  and name  O)  (resid 47  and name HN) 1.8 0.4 0.9
assign  (resid 43  and name  O)  (resid 47  and name  N) 2.8 0.4 0.9
!SER44
assign  (resid 44  and name  O)  (resid 48  and name HN) 1.8 0.4 0.9
assign  (resid 44  and name  O)  (resid 48  and name  N) 2.8 0.4 0.9
!LEU45
assign  (resid 45  and name  O)  (resid 49  and name HN) 1.8 0.4 0.9
assign  (resid 45  and name  O)  (resid 49  and name  N) 2.8 0.4 0.9
!LYS46
assign  (resid 46  and name  O)  (resid 50  and name HN) 1.8 0.4 0.9
assign  (resid 46  and name  O)  (resid 50  and name  N) 2.8 0.4 0.9
!ASN47
assign  (resid 47  and name  O)  (resid 51  and name HN) 1.8 0.4 0.9
assign  (resid 47  and name  O)  (resid 51  and name  N) 2.8 0.4 0.9
!GLU48
assign  (resid 48  and name  O)  (resid 52  and name HN) 1.8 0.4 0.9
assign  (resid 48  and name  O)  (resid 52  and name  N) 2.8 0.4 0.9
       

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1   4.790  16.416   3.015
    2   2H    MET   1          2HT       MET   1   6.410  16.870   2.658
    3   3H    MET   1          3HT       MET   1   5.108  17.589   1.801
    4    HA   MET   1           HA       MET   1   5.375  17.821   4.709
    5   1HB   MET   1          2HB       MET   1   6.490  19.985   4.277
    6   2HB   MET   1          1HB       MET   1   7.456  18.615   3.754
    7   1HG   MET   1          2HG       MET   1   6.423  19.043   1.440
    8   2HG   MET   1          1HG       MET   1   5.980  20.619   2.095
    9   1HE   MET   1          1HE       MET   1   7.557  22.186   0.442
   10   2HE   MET   1          2HE       MET   1   8.904  22.688   1.461
   11   3HE   MET   1          3HE       MET   1   7.294  22.523   2.154
   12    H    GLU   2           H        GLU   2   3.080  17.448   2.943
   13    HA   GLU   2           HA       GLU   2   1.882  20.085   2.709
   14   1HB   GLU   2          2HB       GLU   2   0.659  17.381   2.139
   15   2HB   GLU   2          1HB       GLU   2   0.014  18.946   1.660
   16   1HG   GLU   2          2HG       GLU   2   2.525  18.989   0.577
   17   2HG   GLU   2          1HG       GLU   2   2.068  17.298   0.412
   18    H    ALA   3           H        ALA   3   1.488  17.133   4.614
   19    HA   ALA   3           HA       ALA   3   0.514  18.493   6.867
   20   1HB   ALA   3          1HB       ALA   3  -1.507  18.814   5.579
   21   2HB   ALA   3          2HB       ALA   3  -1.809  17.661   6.880
   22   3HB   ALA   3          3HB       ALA   3  -1.594  17.082   5.231
   23    H    VAL   4           H        VAL   4  -0.501  15.408   5.421
   24    HA   VAL   4           HA       VAL   4   1.321  13.881   7.033
   25    HB   VAL   4           HB       VAL   4  -0.568  12.561   8.115
   26   1HG1  VAL   4          1HG1      VAL   4  -0.505  13.867  10.069
   27   2HG1  VAL   4          2HG1      VAL   4  -0.326  15.368   9.154
   28   3HG1  VAL   4          3HG1      VAL   4   1.012  14.219   9.222
   29   1HG2  VAL   4          1HG2      VAL   4  -2.236  14.992   8.126
   30   2HG2  VAL   4          2HG2      VAL   4  -2.700  13.284   8.094
   31   3HG2  VAL   4          3HG2      VAL   4  -2.199  14.091   6.607
   32    H    ASP   5           H        ASP   5   0.582  14.207   4.228
   33    HA   ASP   5           HA       ASP   5  -0.904  11.918   3.403
   34   1HB   ASP   5          2HB       ASP   5  -0.134  12.510   1.132
   35   2HB   ASP   5          1HB       ASP   5  -0.802  13.897   1.990
   36    H    ALA   6           H        ALA   6   2.539  12.691   3.617
   37    HA   ALA   6           HA       ALA   6   3.454  10.266   2.465
   38   1HB   ALA   6          1HB       ALA   6   5.114  11.820   2.377
   39   2HB   ALA   6          2HB       ALA   6   5.588  11.005   3.868
   40   3HB   ALA   6          3HB       ALA   6   4.694  12.528   3.937
   41    H    ASN   7           H        ASN   7   2.665  11.254   5.743
   42    HA   ASN   7           HA       ASN   7   3.841   9.029   7.054
   43   1HB   ASN   7          2HB       ASN   7   2.088  11.270   7.782
   44   2HB   ASN   7          1HB       ASN   7   1.808   9.812   8.724
   45   1HD2  ASN   7          1HD2      ASN   7   3.476  12.605   8.656
   46   2HD2  ASN   7          2HD2      ASN   7   4.819  12.174   9.651
   47    H    SER   8           H        SER   8   0.517   9.725   6.003
   48    HA   SER   8           HA       SER   8  -0.553   7.251   6.879
   49   1HB   SER   8          2HB       SER   8  -2.030   9.137   6.538
   50   2HB   SER   8          1HB       SER   8  -1.563   9.248   4.841
   51    HG   SER   8           HG       SER   8  -2.747   6.924   5.935
   52    H    LEU   9           H        LEU   9   0.990   8.341   3.946
   53    HA   LEU   9           HA       LEU   9   0.219   6.221   2.256
   54   1HB   LEU   9          2HB       LEU   9   1.273   8.426   1.598
   55   2HB   LEU   9          1HB       LEU   9   2.805   7.757   2.119
   56    HG   LEU   9           HG       LEU   9   1.090   6.638  -0.098
   57   1HD1  LEU   9          1HD1      LEU   9   2.488   8.916  -0.242
   58   2HD1  LEU   9          2HD1      LEU   9   2.289   7.807  -1.601
   59   3HD1  LEU   9          3HD1      LEU   9   3.755   7.749  -0.627
   60   1HD2  LEU   9          1HD2      LEU   9   2.256   4.786   0.523
   61   2HD2  LEU   9          2HD2      LEU   9   3.576   5.718   1.230
   62   3HD2  LEU   9          3HD2      LEU   9   3.462   5.538  -0.520
   63    H    ALA  10           H        ALA  10   3.059   6.714   4.317
   64    HA   ALA  10           HA       ALA  10   4.413   4.353   3.610
   65   1HB   ALA  10          1HB       ALA  10   5.076   6.528   5.031
   66   2HB   ALA  10          2HB       ALA  10   5.990   5.021   5.074
   67   3HB   ALA  10          3HB       ALA  10   4.818   5.379   6.342
   68    H    GLN  11           H        GLN  11   1.708   4.861   5.684
   69    HA   GLN  11           HA       GLN  11   2.100   2.460   7.225
   70   1HB   GLN  11          2HB       GLN  11   1.013   4.246   8.355
   71   2HB   GLN  11          1HB       GLN  11  -0.141   4.463   7.044
   72   1HG   GLN  11          2HG       GLN  11  -1.038   2.229   7.535
   73   2HG   GLN  11          1HG       GLN  11   0.031   2.129   8.929
   74   1HE2  GLN  11          1HE2      GLN  11  -2.850   3.496   7.618
   75   2HE2  GLN  11          2HE2      GLN  11  -3.409   4.253   9.063
   76    H    ALA  12           H        ALA  12  -0.058   3.512   4.604
   77    HA   ALA  12           HA       ALA  12  -1.670   1.284   4.391
   78   1HB   ALA  12          1HB       ALA  12  -1.422   3.523   2.956
   79   2HB   ALA  12          2HB       ALA  12  -2.299   2.108   2.370
   80   3HB   ALA  12          3HB       ALA  12  -0.634   2.392   1.853
   81    H    LYS  13           H        LYS  13   1.615   1.777   3.331
   82    HA   LYS  13           HA       LYS  13   1.799  -0.846   2.097
   83   1HB   LYS  13          2HB       LYS  13   4.342   0.029   2.064
   84   2HB   LYS  13          1HB       LYS  13   3.154   0.470   0.852
   85   1HG   LYS  13          2HG       LYS  13   2.857   2.587   1.703
   86   2HG   LYS  13          1HG       LYS  13   3.511   2.148   3.287
   87   1HD   LYS  13          2HD       LYS  13   5.109   2.296   0.726
   88   2HD   LYS  13          1HD       LYS  13   5.054   3.563   1.951
   89   1HE   LYS  13          2HE       LYS  13   5.670   1.022   3.154
   90   2HE   LYS  13          1HE       LYS  13   6.790   1.367   1.836
   91   1HZ   LYS  13          1HZ       LYS  13   6.203   3.150   4.140
   92   2HZ   LYS  13          2HZ       LYS  13   7.243   3.523   2.859
   93   3HZ   LYS  13          3HZ       LYS  13   7.619   2.251   3.909
   94    H    GLU  14           H        GLU  14   3.478   0.908   4.714
   95    HA   GLU  14           HA       GLU  14   4.982  -1.138   5.770
   96   1HB   GLU  14          2HB       GLU  14   3.627   1.246   6.995
   97   2HB   GLU  14          1HB       GLU  14   4.418   0.072   8.040
   98   1HG   GLU  14          2HG       GLU  14   5.987   1.059   5.743
   99   2HG   GLU  14          1HG       GLU  14   5.654   2.213   7.034
  100    H    ALA  15           H        ALA  15   1.588  -0.427   6.141
  101    HA   ALA  15           HA       ALA  15   1.148  -2.596   8.019
  102   1HB   ALA  15          1HB       ALA  15  -1.104  -1.220   6.644
  103   2HB   ALA  15          2HB       ALA  15  -0.123  -0.302   7.785
  104   3HB   ALA  15          3HB       ALA  15  -0.962  -1.759   8.317
  105    H    ALA  16           H        ALA  16   0.727  -1.970   4.587
  106    HA   ALA  16           HA       ALA  16  -0.846  -4.273   4.032
  107   1HB   ALA  16          1HB       ALA  16   0.754  -2.405   2.316
  108   2HB   ALA  16          2HB       ALA  16  -0.995  -2.597   2.417
  109   3HB   ALA  16          3HB       ALA  16  -0.015  -3.841   1.642
  110    H    ILE  17           H        ILE  17   2.565  -3.724   4.416
  111    HA   ILE  17           HA       ILE  17   3.355  -6.158   3.100
  112    HB   ILE  17           HB       ILE  17   5.595  -5.719   4.071
  113   1HG1  ILE  17          2HG1      ILE  17   4.262  -3.260   5.224
  114   2HG1  ILE  17          1HG1      ILE  17   4.876  -4.625   6.151
  115   1HG2  ILE  17          1HG2      ILE  17   6.083  -3.778   2.724
  116   2HG2  ILE  17          2HG2      ILE  17   4.382  -3.312   2.725
  117   3HG2  ILE  17          3HG2      ILE  17   4.893  -4.784   1.900
  118   1HD1  ILE  17          1HD1      ILE  17   6.334  -2.576   6.072
  119   2HD1  ILE  17          2HD1      ILE  17   6.619  -2.950   4.372
  120   3HD1  ILE  17          3HD1      ILE  17   7.110  -4.094   5.622
  121    H    LYS  18           H        LYS  18   2.592  -5.128   6.351
  122    HA   LYS  18           HA       LYS  18   3.649  -7.278   7.797
  123   1HB   LYS  18          2HB       LYS  18   1.838  -5.093   8.270
  124   2HB   LYS  18          1HB       LYS  18   1.197  -6.555   9.009
  125   1HG   LYS  18          2HG       LYS  18   3.934  -6.485   9.644
  126   2HG   LYS  18          1HG       LYS  18   3.317  -4.850   9.897
  127   1HD   LYS  18          2HD       LYS  18   1.342  -6.383  11.004
  128   2HD   LYS  18          1HD       LYS  18   2.789  -7.317  11.387
  129   1HE   LYS  18          2HE       LYS  18   2.965  -5.944  13.149
  130   2HE   LYS  18          1HE       LYS  18   3.594  -4.783  11.981
  131   1HZ   LYS  18          1HZ       LYS  18   0.979  -4.379  11.721
  132   2HZ   LYS  18          2HZ       LYS  18   1.952  -3.518  12.799
  133   3HZ   LYS  18          3HZ       LYS  18   1.037  -4.833  13.349
  134    H    GLU  19           H        GLU  19   0.670  -6.939   5.971
  135    HA   GLU  19           HA       GLU  19  -0.471  -9.411   6.830
  136   1HB   GLU  19          2HB       GLU  19  -1.177  -7.251   5.025
  137   2HB   GLU  19          1HB       GLU  19  -1.532  -8.817   4.304
  138   1HG   GLU  19          2HG       GLU  19  -3.490  -8.160   5.416
  139   2HG   GLU  19          1HG       GLU  19  -2.745  -9.385   6.442
  140    H    LEU  20           H        LEU  20   1.538  -8.387   4.130
  141    HA   LEU  20           HA       LEU  20   1.439 -10.780   2.661
  142   1HB   LEU  20          2HB       LEU  20   2.767  -8.303   2.474
  143   2HB   LEU  20          1HB       LEU  20   4.020  -9.529   2.468
  144    HG   LEU  20           HG       LEU  20   2.107 -10.498   0.706
  145   1HD1  LEU  20          1HD1      LEU  20   2.091  -7.566   0.743
  146   2HD1  LEU  20          2HD1      LEU  20   0.887  -8.704   0.139
  147   3HD1  LEU  20          3HD1      LEU  20   2.291  -8.299  -0.847
  148   1HD2  LEU  20          1HD2      LEU  20   4.716 -10.346   0.704
  149   2HD2  LEU  20          2HD2      LEU  20   4.418  -8.922  -0.294
  150   3HD2  LEU  20          3HD2      LEU  20   3.820 -10.500  -0.807
  151    H    LYS  21           H        LYS  21   3.289  -9.765   5.439
  152    HA   LYS  21           HA       LYS  21   5.056 -12.047   5.376
  153   1HB   LYS  21          2HB       LYS  21   5.694  -9.794   6.309
  154   2HB   LYS  21          1HB       LYS  21   4.596 -10.105   7.646
  155   1HG   LYS  21          2HG       LYS  21   6.163 -12.366   7.587
  156   2HG   LYS  21          1HG       LYS  21   7.295 -11.075   7.180
  157   1HD   LYS  21          2HD       LYS  21   7.449 -10.807   9.407
  158   2HD   LYS  21          1HD       LYS  21   5.916  -9.950   9.238
  159   1HE   LYS  21          2HE       LYS  21   5.020 -11.428  10.635
  160   2HE   LYS  21          1HE       LYS  21   5.236 -12.655   9.387
  161   1HZ   LYS  21          1HZ       LYS  21   6.367 -13.584  11.122
  162   2HZ   LYS  21          2HZ       LYS  21   6.879 -12.101  11.753
  163   3HZ   LYS  21          3HZ       LYS  21   7.632 -12.741  10.379
  164    H    GLN  22           H        GLN  22   2.150 -11.020   7.076
  165    HA   GLN  22           HA       GLN  22   2.098 -13.258   8.864
  166   1HB   GLN  22          2HB       GLN  22   0.857 -10.864   8.877
  167   2HB   GLN  22          1HB       GLN  22  -0.431 -11.855   8.207
  168   1HG   GLN  22          2HG       GLN  22  -0.885 -11.975  10.445
  169   2HG   GLN  22          1HG       GLN  22   0.101 -13.419  10.217
  170   1HE2  GLN  22          1HE2      GLN  22  -0.014 -10.197  11.517
  171   2HE2  GLN  22          2HE2      GLN  22   1.401 -10.323  12.499
  172    H    TYR  23           H        TYR  23   0.952 -12.597   5.652
  173    HA   TYR  23           HA       TYR  23  -0.814 -14.877   5.535
  174   1HB   TYR  23          2HB       TYR  23   0.051 -12.729   3.649
  175   2HB   TYR  23          1HB       TYR  23  -0.589 -14.225   2.967
  176    HD1  TYR  23           1HD      TYR  23  -1.465 -11.031   3.823
  177    HD2  TYR  23           2HD      TYR  23  -2.817 -15.027   4.356
  178    HE1  TYR  23           1HE      TYR  23  -3.747 -10.204   4.178
  179    HE2  TYR  23           2HE      TYR  23  -5.106 -14.212   4.713
  180    HH   TYR  23           HH       TYR  23  -6.427 -12.052   3.989
  181    H    GLY  24           H        GLY  24   2.398 -14.002   4.352
  182   1HA   GLY  24          2HA       GLY  24   4.096 -15.756   4.341
  183   2HA   GLY  24          1HA       GLY  24   2.854 -16.861   3.775
  184    H    ILE  25           H        ILE  25   2.130 -14.186   2.105
  185    HA   ILE  25           HA       ILE  25   2.921 -15.120  -0.368
  186    HB   ILE  25           HB       ILE  25   3.007 -12.185  -0.251
  187   1HG1  ILE  25          2HG1      ILE  25   0.565 -13.667   0.745
  188   2HG1  ILE  25          1HG1      ILE  25   1.472 -12.414   1.589
  189   1HG2  ILE  25          1HG2      ILE  25   2.206 -12.440  -2.296
  190   2HG2  ILE  25          2HG2      ILE  25   0.832 -13.381  -1.720
  191   3HG2  ILE  25          3HG2      ILE  25   2.368 -14.180  -2.075
  192   1HD1  ILE  25          1HD1      ILE  25  -0.494 -12.171  -0.619
  193   2HD1  ILE  25          2HD1      ILE  25   0.808 -10.988  -0.525
  194   3HD1  ILE  25          3HD1      ILE  25  -0.299 -11.194   0.835
  195    H    GLY  26           H        GLY  26   4.465 -13.841  -1.923
  196   1HA   GLY  26          2HA       GLY  26   7.104 -14.138  -0.814
  197   2HA   GLY  26          1HA       GLY  26   6.707 -13.715  -2.476
  198    H    ASP  27           H        ASP  27   8.735 -12.578  -0.704
  199    HA   ASP  27           HA       ASP  27   7.958 -10.068   0.291
  200   1HB   ASP  27          2HB       ASP  27  10.523 -11.394  -0.384
  201   2HB   ASP  27          1HB       ASP  27  10.552  -9.634  -0.318
  202    H    TYR  28           H        TYR  28   8.522 -11.163  -2.934
  203    HA   TYR  28           HA       TYR  28   9.303  -8.930  -4.330
  204   1HB   TYR  28          2HB       TYR  28   8.368 -11.343  -5.094
  205   2HB   TYR  28          1HB       TYR  28   6.943 -10.364  -5.437
  206    HD1  TYR  28           1HD      TYR  28   6.776  -9.738  -7.635
  207    HD2  TYR  28           2HD      TYR  28  10.629  -9.918  -5.850
  208    HE1  TYR  28           1HE      TYR  28   7.775  -8.949  -9.733
  209    HE2  TYR  28           2HE      TYR  28  11.642  -9.133  -7.938
  210    HH   TYR  28           HH       TYR  28   9.785  -7.870 -10.528
  211    H    TYR  29           H        TYR  29   6.059  -9.794  -3.309
  212    HA   TYR  29           HA       TYR  29   4.865  -7.405  -4.280
  213   1HB   TYR  29          2HB       TYR  29   3.668  -9.407  -2.364
  214   2HB   TYR  29          1HB       TYR  29   2.809  -8.300  -3.427
  215    HD1  TYR  29           1HD      TYR  29   2.601 -11.385  -3.348
  216    HD2  TYR  29           2HD      TYR  29   4.860  -8.702  -5.766
  217    HE1  TYR  29           1HE      TYR  29   2.687 -13.078  -5.126
  218    HE2  TYR  29           2HE      TYR  29   4.957 -10.399  -7.546
  219    HH   TYR  29           HH       TYR  29   3.102 -12.696  -8.008
  220    H    ILE  30           H        ILE  30   6.403  -8.183  -1.269
  221    HA   ILE  30           HA       ILE  30   5.077  -6.083   0.196
  222    HB   ILE  30           HB       ILE  30   6.329  -6.636   2.010
  223   1HG1  ILE  30          2HG1      ILE  30   8.699  -7.710   1.721
  224   2HG1  ILE  30          1HG1      ILE  30   8.603  -6.999   0.114
  225   1HG2  ILE  30          1HG2      ILE  30   5.405  -8.692   1.713
  226   2HG2  ILE  30          2HG2      ILE  30   7.114  -9.099   1.835
  227   3HG2  ILE  30          3HG2      ILE  30   6.335  -9.030   0.257
  228   1HD1  ILE  30          1HD1      ILE  30   9.046  -5.736   2.696
  229   2HD1  ILE  30          2HD1      ILE  30   7.820  -4.934   1.712
  230   3HD1  ILE  30          3HD1      ILE  30   9.447  -5.177   1.072
  231    H    LYS  31           H        LYS  31   7.882  -6.509  -1.794
  232    HA   LYS  31           HA       LYS  31   9.005  -3.904  -1.316
  233   1HB   LYS  31          2HB       LYS  31   9.610  -5.903  -3.494
  234   2HB   LYS  31          1HB       LYS  31  10.601  -4.518  -3.056
  235   1HG   LYS  31          2HG       LYS  31  10.002  -6.818  -1.210
  236   2HG   LYS  31          1HG       LYS  31  11.449  -6.694  -2.210
  237   1HD   LYS  31          2HD       LYS  31  12.269  -4.871  -1.008
  238   2HD   LYS  31          1HD       LYS  31  10.689  -4.496  -0.319
  239   1HE   LYS  31          2HE       LYS  31  10.820  -6.670   0.924
  240   2HE   LYS  31          1HE       LYS  31  12.486  -6.817   0.363
  241   1HZ   LYS  31          1HZ       LYS  31  11.729  -4.326   1.688
  242   2HZ   LYS  31          2HZ       LYS  31  13.191  -5.176   1.736
  243   3HZ   LYS  31          3HZ       LYS  31  11.876  -5.704   2.660
  244    H    LEU  32           H        LEU  32   7.376  -5.516  -4.045
  245    HA   LEU  32           HA       LEU  32   7.377  -3.434  -5.831
  246   1HB   LEU  32          2HB       LEU  32   6.144  -4.817  -7.104
  247   2HB   LEU  32          1HB       LEU  32   6.355  -5.954  -5.796
  248    HG   LEU  32           HG       LEU  32   4.080  -6.027  -6.327
  249   1HD1  LEU  32          1HD1      LEU  32   3.532  -4.201  -4.195
  250   2HD1  LEU  32          2HD1      LEU  32   5.022  -5.098  -3.880
  251   3HD1  LEU  32          3HD1      LEU  32   3.512  -5.967  -4.195
  252   1HD2  LEU  32          1HD2      LEU  32   3.508  -3.163  -5.928
  253   2HD2  LEU  32          2HD2      LEU  32   2.807  -4.313  -7.067
  254   3HD2  LEU  32          3HD2      LEU  32   4.372  -3.574  -7.408
  255    H    ILE  33           H        ILE  33   5.706  -3.656  -2.869
  256    HA   ILE  33           HA       ILE  33   3.641  -1.744  -3.425
  257    HB   ILE  33           HB       ILE  33   4.668  -3.139  -0.980
  258   1HG1  ILE  33          2HG1      ILE  33   2.024  -2.937  -2.413
  259   2HG1  ILE  33          1HG1      ILE  33   3.069  -4.343  -2.266
  260   1HG2  ILE  33          1HG2      ILE  33   3.655  -0.485  -0.896
  261   2HG2  ILE  33          2HG2      ILE  33   4.084  -1.545   0.442
  262   3HG2  ILE  33          3HG2      ILE  33   2.445  -1.561  -0.205
  263   1HD1  ILE  33          1HD1      ILE  33   2.287  -3.401   0.333
  264   2HD1  ILE  33          2HD1      ILE  33   2.046  -4.978  -0.416
  265   3HD1  ILE  33          3HD1      ILE  33   0.878  -3.685  -0.688
  266    H    ASN  34           H        ASN  34   6.576  -1.681  -1.404
  267    HA   ASN  34           HA       ASN  34   6.558   0.993  -0.718
  268   1HB   ASN  34          2HB       ASN  34   8.191  -1.060  -0.163
  269   2HB   ASN  34          1HB       ASN  34   9.203  -0.210  -1.327
  270   1HD2  ASN  34          1HD2      ASN  34   9.053   2.308  -0.896
  271   2HD2  ASN  34          2HD2      ASN  34   9.395   2.751   0.739
  272    H    ASN  35           H        ASN  35   7.277  -0.424  -3.791
  273    HA   ASN  35           HA       ASN  35   8.836   1.712  -4.840
  274   1HB   ASN  35          2HB       ASN  35   8.681  -0.693  -5.704
  275   2HB   ASN  35          1HB       ASN  35   7.184  -0.194  -6.485
  276   1HD2  ASN  35          1HD2      ASN  35  10.630   0.066  -6.460
  277   2HD2  ASN  35          2HD2      ASN  35  10.789   0.886  -7.973
  278    H    ALA  36           H        ALA  36   5.447   1.286  -4.363
  279    HA   ALA  36           HA       ALA  36   4.457   2.922  -6.427
  280   1HB   ALA  36          1HB       ALA  36   3.411   1.694  -4.015
  281   2HB   ALA  36          2HB       ALA  36   2.641   1.963  -5.579
  282   3HB   ALA  36          3HB       ALA  36   2.662   3.252  -4.374
  283    H    LYS  37           H        LYS  37   3.644   5.050  -6.363
  284    HA   LYS  37           HA       LYS  37   5.269   6.823  -4.706
  285   1HB   LYS  37          2HB       LYS  37   3.856   7.088  -7.325
  286   2HB   LYS  37          1HB       LYS  37   4.163   8.534  -6.377
  287   1HG   LYS  37          2HG       LYS  37   6.292   8.580  -6.997
  288   2HG   LYS  37          1HG       LYS  37   6.527   6.889  -6.564
  289   1HD   LYS  37          2HD       LYS  37   5.365   7.922  -9.151
  290   2HD   LYS  37          1HD       LYS  37   6.982   7.250  -8.932
  291   1HE   LYS  37          2HE       LYS  37   4.900   5.483  -7.949
  292   2HE   LYS  37          1HE       LYS  37   4.705   5.865  -9.660
  293   1HZ   LYS  37          1HZ       LYS  37   6.127   4.137  -9.848
  294   2HZ   LYS  37          2HZ       LYS  37   6.814   4.365  -8.319
  295   3HZ   LYS  37          3HZ       LYS  37   7.289   5.345  -9.614
  296    H    THR  38           H        THR  38   1.930   6.095  -5.525
  297    HA   THR  38           HA       THR  38   0.939   8.105  -3.656
  298    HB   THR  38           HB       THR  38  -1.224   7.696  -4.572
  299    HG1  THR  38           1HG      THR  38  -1.569   5.622  -4.817
  300   1HG2  THR  38          1HG2      THR  38  -0.905   7.772  -7.035
  301   2HG2  THR  38          2HG2      THR  38   0.817   7.498  -6.769
  302   3HG2  THR  38          3HG2      THR  38   0.049   8.955  -6.140
  303    H    VAL  39           H        VAL  39  -1.471   6.482  -3.005
  304    HA   VAL  39           HA       VAL  39  -0.264   4.363  -1.399
  305    HB   VAL  39           HB       VAL  39  -0.636   6.610  -0.122
  306   1HG1  VAL  39          1HG1      VAL  39  -2.747   6.758   0.994
  307   2HG1  VAL  39          2HG1      VAL  39  -3.327   5.310   0.171
  308   3HG1  VAL  39          3HG1      VAL  39  -3.023   6.783  -0.749
  309   1HG2  VAL  39          1HG2      VAL  39  -1.263   5.113   1.892
  310   2HG2  VAL  39          2HG2      VAL  39   0.252   4.818   1.033
  311   3HG2  VAL  39          3HG2      VAL  39  -1.154   3.803   0.720
  312    H    GLU  40           H        GLU  40  -3.281   5.804  -2.567
  313    HA   GLU  40           HA       GLU  40  -5.107   3.920  -1.799
  314   1HB   GLU  40          2HB       GLU  40  -5.194   6.069  -3.443
  315   2HB   GLU  40          1HB       GLU  40  -5.359   4.772  -4.617
  316   1HG   GLU  40          2HG       GLU  40  -7.365   4.042  -3.720
  317   2HG   GLU  40          1HG       GLU  40  -7.071   4.826  -2.169
  318    H    GLY  41           H        GLY  41  -2.791   3.685  -4.442
  319   1HA   GLY  41          2HA       GLY  41  -3.828   1.108  -5.283
  320   2HA   GLY  41          1HA       GLY  41  -2.436   1.946  -5.956
  321    H    VAL  42           H        VAL  42  -1.337   2.347  -3.213
  322    HA   VAL  42           HA       VAL  42   0.398   0.159  -3.116
  323    HB   VAL  42           HB       VAL  42  -0.268   2.061  -0.873
  324   1HG1  VAL  42          1HG1      VAL  42   0.914   0.308   0.091
  325   2HG1  VAL  42          2HG1      VAL  42   2.174   1.480  -0.317
  326   3HG1  VAL  42          3HG1      VAL  42   1.911   0.072  -1.350
  327   1HG2  VAL  42          1HG2      VAL  42   1.414   3.486  -1.668
  328   2HG2  VAL  42          2HG2      VAL  42   0.500   3.043  -3.111
  329   3HG2  VAL  42          3HG2      VAL  42   2.044   2.267  -2.767
  330    H    GLU  43           H        GLU  43  -2.377   0.935  -1.031
  331    HA   GLU  43           HA       GLU  43  -2.152  -1.441   0.524
  332   1HB   GLU  43          2HB       GLU  43  -4.665  -0.795   1.024
  333   2HB   GLU  43          1HB       GLU  43  -3.338   0.154   1.677
  334   1HG   GLU  43          2HG       GLU  43  -3.632   1.857   0.088
  335   2HG   GLU  43          1HG       GLU  43  -4.683   0.851  -0.910
  336    H    SER  44           H        SER  44  -4.301  -0.493  -2.137
  337    HA   SER  44           HA       SER  44  -5.685  -2.956  -2.259
  338   1HB   SER  44          2HB       SER  44  -6.823  -2.033  -4.032
  339   2HB   SER  44          1HB       SER  44  -6.161  -0.557  -3.327
  340    HG   SER  44           HG       SER  44  -5.801  -1.453  -5.765
  341    H    LEU  45           H        LEU  45  -2.612  -1.901  -3.380
  342    HA   LEU  45           HA       LEU  45  -2.142  -3.590  -5.546
  343   1HB   LEU  45          2HB       LEU  45  -0.541  -2.051  -3.642
  344   2HB   LEU  45          1HB       LEU  45   0.291  -3.460  -4.258
  345   1HD1  LEU  45          1HD1      LEU  45   1.231  -3.597  -6.042
  346   2HD1  LEU  45          2HD1      LEU  45   1.989  -2.008  -6.171
  347   3HD1  LEU  45          3HD1      LEU  45   0.954  -2.602  -7.472
  348   1HD2  LEU  45          1HD2      LEU  45  -1.298  -2.670  -7.355
  349   2HD2  LEU  45          2HD2      LEU  45  -1.107  -0.918  -7.309
  350   3HD2  LEU  45          3HD2      LEU  45  -2.186  -1.717  -6.168
  351    H    LYS  46           H        LYS  46  -1.163  -4.159  -2.155
  352    HA   LYS  46           HA       LYS  46  -0.480  -6.877  -2.654
  353   1HB   LYS  46          2HB       LYS  46   0.676  -6.285  -0.817
  354   2HB   LYS  46          1HB       LYS  46  -0.479  -5.046  -0.351
  355   1HG   LYS  46          2HG       LYS  46  -1.143  -7.934   0.067
  356   2HG   LYS  46          1HG       LYS  46  -0.052  -7.103   1.181
  357   1HD   LYS  46          2HD       LYS  46  -1.842  -5.323   1.399
  358   2HD   LYS  46          1HD       LYS  46  -2.920  -6.432   0.557
  359   1HE   LYS  46          2HE       LYS  46  -3.060  -7.860   2.311
  360   2HE   LYS  46          1HE       LYS  46  -1.425  -7.505   2.870
  361   1HZ   LYS  46          1HZ       LYS  46  -2.131  -5.780   4.126
  362   2HZ   LYS  46          2HZ       LYS  46  -3.583  -6.647   4.125
  363   3HZ   LYS  46          3HZ       LYS  46  -3.374  -5.347   3.062
  364    H    ASN  47           H        ASN  47  -3.288  -5.339  -1.075
  365    HA   ASN  47           HA       ASN  47  -4.618  -7.699  -0.386
  366   1HB   ASN  47          2HB       ASN  47  -5.221  -5.285   0.253
  367   2HB   ASN  47          1HB       ASN  47  -6.050  -5.198  -1.298
  368   1HD2  ASN  47          1HD2      ASN  47  -7.680  -6.902  -1.698
  369   2HD2  ASN  47          2HD2      ASN  47  -8.649  -7.421  -0.365
  370    H    GLU  48           H        GLU  48  -4.225  -6.138  -3.453
  371    HA   GLU  48           HA       GLU  48  -6.335  -7.608  -4.761
  372   1HB   GLU  48          2HB       GLU  48  -5.693  -5.412  -5.619
  373   2HB   GLU  48          1HB       GLU  48  -4.051  -5.978  -5.896
  374   1HG   GLU  48          2HG       GLU  48  -4.800  -7.486  -7.606
  375   2HG   GLU  48          1HG       GLU  48  -6.486  -7.100  -7.260
  376    H    ILE  49           H        ILE  49  -2.859  -7.840  -4.358
  377    HA   ILE  49           HA       ILE  49  -2.409  -9.967  -6.168
  378    HB   ILE  49           HB       ILE  49  -0.278 -10.244  -5.165
  379   1HG1  ILE  49          2HG1      ILE  49  -0.793  -8.522  -2.802
  380   2HG1  ILE  49          1HG1      ILE  49  -1.418 -10.159  -2.741
  381   1HG2  ILE  49          1HG2      ILE  49  -0.144  -7.486  -4.481
  382   2HG2  ILE  49          2HG2      ILE  49  -1.246  -7.693  -5.843
  383   3HG2  ILE  49          3HG2      ILE  49   0.406  -8.299  -5.947
  384   1HD1  ILE  49          1HD1      ILE  49   1.403  -9.698  -3.513
  385   2HD1  ILE  49          2HD1      ILE  49   0.665 -11.078  -2.700
  386   3HD1  ILE  49          3HD1      ILE  49   0.930  -9.571  -1.820
  387    H    LEU  50           H        LEU  50  -3.619  -9.762  -2.947
  388    HA   LEU  50           HA       LEU  50  -3.374 -12.554  -2.340
  389   1HB   LEU  50          2HB       LEU  50  -4.797 -10.243  -1.026
  390   2HB   LEU  50          1HB       LEU  50  -4.848 -11.876  -0.382
  391    HG   LEU  50           HG       LEU  50  -2.147 -10.831  -0.920
  392   1HD1  LEU  50          1HD1      LEU  50  -2.990  -8.789  -0.115
  393   2HD1  LEU  50          2HD1      LEU  50  -2.193  -9.559   1.259
  394   3HD1  LEU  50          3HD1      LEU  50  -3.952  -9.587   1.131
  395   1HD2  LEU  50          1HD2      LEU  50  -2.060 -11.730   1.567
  396   2HD2  LEU  50          2HD2      LEU  50  -2.035 -12.822   0.182
  397   3HD2  LEU  50          3HD2      LEU  50  -3.540 -12.545   1.063
  398    H    LYS  51           H        LYS  51  -5.809 -10.406  -3.652
  399    HA   LYS  51           HA       LYS  51  -8.033 -12.120  -3.416
  400   1HB   LYS  51          2HB       LYS  51  -7.350  -9.828  -5.234
  401   2HB   LYS  51          1HB       LYS  51  -8.814 -10.765  -5.499
  402   1HG   LYS  51          2HG       LYS  51  -9.251 -10.273  -2.978
  403   2HG   LYS  51          1HG       LYS  51  -8.105  -8.956  -3.239
  404   1HD   LYS  51          2HD       LYS  51 -10.423  -9.366  -5.095
  405   2HD   LYS  51          1HD       LYS  51 -10.628  -8.499  -3.571
  406   1HE   LYS  51          2HE       LYS  51  -9.179  -6.787  -4.214
  407   2HE   LYS  51          1HE       LYS  51  -8.445  -7.760  -5.486
  408   1HZ   LYS  51          1HZ       LYS  51 -10.903  -7.692  -6.384
  409   2HZ   LYS  51          2HZ       LYS  51  -9.795  -6.466  -6.738
  410   3HZ   LYS  51          3HZ       LYS  51 -10.935  -6.244  -5.510
  411    H    ALA  52           H        ALA  52  -5.251 -12.209  -5.408
  412    HA   ALA  52           HA       ALA  52  -6.211 -14.617  -6.703
  413   1HB   ALA  52          1HB       ALA  52  -5.590 -13.850  -8.951
  414   2HB   ALA  52          2HB       ALA  52  -5.252 -12.245  -8.301
  415   3HB   ALA  52          3HB       ALA  52  -6.897 -12.882  -8.268
  416    H    LEU  53           H        LEU  53  -4.450 -14.883  -4.857
  417    HA   LEU  53           HA       LEU  53  -1.749 -14.369  -5.508
  418   1HB   LEU  53          2HB       LEU  53  -3.169 -15.438  -3.334
  419   2HB   LEU  53          1HB       LEU  53  -2.052 -16.696  -3.831
  420    HG   LEU  53           HG       LEU  53  -0.831 -14.034  -3.634
  421   1HD1  LEU  53          1HD1      LEU  53  -2.490 -15.025  -1.464
  422   2HD1  LEU  53          2HD1      LEU  53  -1.723 -13.451  -1.679
  423   3HD1  LEU  53          3HD1      LEU  53  -0.809 -14.790  -0.982
  424   1HD2  LEU  53          1HD2      LEU  53   1.010 -15.231  -3.119
  425   2HD2  LEU  53          2HD2      LEU  53   0.079 -16.560  -3.813
  426   3HD2  LEU  53          3HD2      LEU  53   0.128 -16.336  -2.064
  427    HA   PRO  54           HA       PRO  54  -1.488 -18.944  -6.977
  428   1HB   PRO  54          2HB       PRO  54  -3.782 -20.361  -7.241
  429   2HB   PRO  54          1HB       PRO  54  -2.870 -20.295  -5.728
  430   1HG   PRO  54          2HG       PRO  54  -5.309 -18.760  -6.539
  431   2HG   PRO  54          1HG       PRO  54  -4.943 -19.541  -4.990
  432   1HD   PRO  54          2HD       PRO  54  -4.653 -16.876  -5.394
  433   2HD   PRO  54          1HD       PRO  54  -3.623 -17.795  -4.278
  434    H    THR  55           H        THR  55  -1.388 -17.052  -8.665
  435    HA   THR  55           HA       THR  55  -3.322 -17.552 -10.822
  436    HB   THR  55           HB       THR  55  -1.982 -15.399 -11.709
  437    HG1  THR  55           1HG      THR  55  -1.115 -14.250 -10.156
  438   1HG2  THR  55          1HG2      THR  55  -4.104 -14.756 -11.613
  439   2HG2  THR  55          2HG2      THR  55  -3.726 -14.159  -9.997
  440   3HG2  THR  55          3HG2      THR  55  -4.436 -15.761 -10.202
  441    H    GLU  56           H        GLU  56  -2.301 -17.226 -13.075
  442    HA   GLU  56           HA       GLU  56  -0.190 -19.172 -13.320
  443   1HB   GLU  56          2HB       GLU  56  -1.827 -17.621 -15.315
  444   2HB   GLU  56          1HB       GLU  56  -0.498 -18.660 -15.808
  445   1HG   GLU  56          2HG       GLU  56  -1.599 -20.580 -14.828
  446   2HG   GLU  56          1HG       GLU  56  -2.908 -19.555 -14.242
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  -0.154  24.111   6.720
    2   2H    MET   1          2HT       MET   1   1.332  24.665   7.370
    3   3H    MET   1          3HT       MET   1   0.820  23.052   7.653
    4    HA   MET   1           HA       MET   1   1.798  24.297   5.182
    5   1HB   MET   1          2HB       MET   1   2.620  22.187   7.111
    6   2HB   MET   1          1HB       MET   1   2.982  21.895   5.417
    7   1HG   MET   1          2HG       MET   1   3.696  24.565   6.428
    8   2HG   MET   1          1HG       MET   1   4.612  23.215   7.096
    9   1HE   MET   1          1HE       MET   1   6.364  21.624   4.148
   10   2HE   MET   1          2HE       MET   1   4.650  21.217   4.220
   11   3HE   MET   1          3HE       MET   1   5.582  21.371   5.709
   12    H    GLU   2           H        GLU   2  -0.075  21.607   6.519
   13    HA   GLU   2           HA       GLU   2  -1.507  20.110   5.564
   14   1HB   GLU   2          2HB       GLU   2  -2.546  22.236   4.759
   15   2HB   GLU   2          1HB       GLU   2  -1.608  22.080   3.275
   16   1HG   GLU   2          2HG       GLU   2  -2.994  20.533   2.430
   17   2HG   GLU   2          1HG       GLU   2  -3.169  19.706   3.970
   18    H    ALA   3           H        ALA   3   0.944  19.236   5.344
   19    HA   ALA   3           HA       ALA   3   0.922  17.766   2.868
   20   1HB   ALA   3          1HB       ALA   3   2.760  18.596   1.819
   21   2HB   ALA   3          2HB       ALA   3   3.518  19.123   3.322
   22   3HB   ALA   3          3HB       ALA   3   2.209  20.068   2.613
   23    H    VAL   4           H        VAL   4   0.683  16.016   4.319
   24    HA   VAL   4           HA       VAL   4   3.211  14.994   5.298
   25    HB   VAL   4           HB       VAL   4   2.206  14.400   7.534
   26   1HG1  VAL   4          1HG1      VAL   4   2.682  16.585   8.525
   27   2HG1  VAL   4          2HG1      VAL   4   2.607  17.329   6.932
   28   3HG1  VAL   4          3HG1      VAL   4   3.871  16.156   7.306
   29   1HG2  VAL   4          1HG2      VAL   4   0.192  16.503   6.746
   30   2HG2  VAL   4          2HG2      VAL   4   0.348  15.762   8.340
   31   3HG2  VAL   4          3HG2      VAL   4  -0.139  14.776   6.958
   32    H    ASP   5           H        ASP   5   1.171  14.336   3.260
   33    HA   ASP   5           HA       ASP   5  -0.362  12.124   4.061
   34   1HB   ASP   5          2HB       ASP   5  -0.555  11.644   1.646
   35   2HB   ASP   5          1HB       ASP   5  -0.850  13.343   2.007
   36    H    ALA   6           H        ALA   6   2.987  12.467   3.272
   37    HA   ALA   6           HA       ALA   6   3.658   9.909   2.424
   38   1HB   ALA   6          1HB       ALA   6   5.571  11.048   2.287
   39   2HB   ALA   6          2HB       ALA   6   5.800  10.684   3.998
   40   3HB   ALA   6          3HB       ALA   6   5.056  12.209   3.509
   41    H    ASN   7           H        ASN   7   3.086  11.115   5.687
   42    HA   ASN   7           HA       ASN   7   4.064   8.869   7.083
   43   1HB   ASN   7          2HB       ASN   7   3.014  11.325   7.784
   44   2HB   ASN   7          1HB       ASN   7   1.790  10.199   8.360
   45   1HD2  ASN   7          1HD2      ASN   7   4.658  11.723   9.078
   46   2HD2  ASN   7          2HD2      ASN   7   5.159  10.730  10.404
   47    H    SER   8           H        SER   8   0.794   9.728   5.993
   48    HA   SER   8           HA       SER   8  -0.397   7.323   6.944
   49   1HB   SER   8          2HB       SER   8  -1.566   9.554   6.434
   50   2HB   SER   8          1HB       SER   8  -1.512   9.057   4.742
   51    HG   SER   8           HG       SER   8  -3.352   8.434   6.423
   52    H    LEU   9           H        LEU   9   1.117   8.336   3.970
   53    HA   LEU   9           HA       LEU   9   0.205   6.228   2.320
   54   1HB   LEU   9          2HB       LEU   9   1.260   8.390   1.572
   55   2HB   LEU   9          1HB       LEU   9   2.801   7.736   2.084
   56    HG   LEU   9           HG       LEU   9   1.062   6.547  -0.072
   57   1HD1  LEU   9          1HD1      LEU   9   2.362   8.837  -0.335
   58   2HD1  LEU   9          2HD1      LEU   9   2.255   7.661  -1.640
   59   3HD1  LEU   9          3HD1      LEU   9   3.701   7.732  -0.638
   60   1HD2  LEU   9          1HD2      LEU   9   2.272   4.729   0.551
   61   2HD2  LEU   9          2HD2      LEU   9   3.580   5.695   1.235
   62   3HD2  LEU   9          3HD2      LEU   9   3.457   5.488  -0.511
   63    H    ALA  10           H        ALA  10   3.132   6.687   4.261
   64    HA   ALA  10           HA       ALA  10   4.422   4.301   3.538
   65   1HB   ALA  10          1HB       ALA  10   5.492   4.742   5.934
   66   2HB   ALA  10          2HB       ALA  10   4.731   6.313   5.683
   67   3HB   ALA  10          3HB       ALA  10   5.905   5.706   4.515
   68    H    GLN  11           H        GLN  11   1.781   4.856   5.684
   69    HA   GLN  11           HA       GLN  11   2.187   2.458   7.222
   70   1HB   GLN  11          2HB       GLN  11   1.143   4.258   8.372
   71   2HB   GLN  11          1HB       GLN  11  -0.043   4.476   7.090
   72   1HG   GLN  11          2HG       GLN  11  -0.945   2.253   7.615
   73   2HG   GLN  11          1HG       GLN  11   0.163   2.146   8.976
   74   1HE2  GLN  11          1HE2      GLN  11  -2.888   2.423   8.525
   75   2HE2  GLN  11          2HE2      GLN  11  -3.343   3.618   9.684
   76    H    ALA  12           H        ALA  12  -0.019   3.514   4.644
   77    HA   ALA  12           HA       ALA  12  -1.647   1.288   4.489
   78   1HB   ALA  12          1HB       ALA  12  -1.429   3.527   3.041
   79   2HB   ALA  12          2HB       ALA  12  -2.342   2.118   2.495
   80   3HB   ALA  12          3HB       ALA  12  -0.695   2.383   1.916
   81    H    LYS  13           H        LYS  13   1.610   1.775   3.340
   82    HA   LYS  13           HA       LYS  13   1.754  -0.852   2.107
   83   1HB   LYS  13          2HB       LYS  13   4.291   0.003   1.982
   84   2HB   LYS  13          1HB       LYS  13   3.064   0.478   0.822
   85   1HG   LYS  13          2HG       LYS  13   2.832   2.585   1.704
   86   2HG   LYS  13          1HG       LYS  13   3.534   2.118   3.260
   87   1HD   LYS  13          2HD       LYS  13   5.047   2.269   0.648
   88   2HD   LYS  13          1HD       LYS  13   5.048   3.528   1.883
   89   1HE   LYS  13          2HE       LYS  13   6.127   0.726   2.092
   90   2HE   LYS  13          1HE       LYS  13   7.025   2.240   2.184
   91   1HZ   LYS  13          1HZ       LYS  13   5.527   0.860   4.230
   92   2HZ   LYS  13          2HZ       LYS  13   5.254   2.527   4.177
   93   3HZ   LYS  13          3HZ       LYS  13   6.825   1.934   4.377
   94    H    GLU  14           H        GLU  14   3.459   0.904   4.712
   95    HA   GLU  14           HA       GLU  14   4.997  -1.159   5.715
   96   1HB   GLU  14          2HB       GLU  14   3.729   1.262   6.933
   97   2HB   GLU  14          1HB       GLU  14   4.413   0.054   8.013
   98   1HG   GLU  14          2HG       GLU  14   6.335   0.511   6.011
   99   2HG   GLU  14          1HG       GLU  14   5.737   2.092   6.513
  100    H    ALA  15           H        ALA  15   1.618  -0.426   6.153
  101    HA   ALA  15           HA       ALA  15   1.193  -2.593   8.036
  102   1HB   ALA  15          1HB       ALA  15  -0.923  -1.754   8.347
  103   2HB   ALA  15          2HB       ALA  15  -1.059  -1.183   6.684
  104   3HB   ALA  15          3HB       ALA  15  -0.066  -0.298   7.843
  105    H    ALA  16           H        ALA  16   0.770  -1.977   4.610
  106    HA   ALA  16           HA       ALA  16  -0.830  -4.278   4.080
  107   1HB   ALA  16          1HB       ALA  16   0.724  -2.393   2.338
  108   2HB   ALA  16          2HB       ALA  16  -1.022  -2.591   2.478
  109   3HB   ALA  16          3HB       ALA  16  -0.056  -3.829   1.676
  110    H    ILE  17           H        ILE  17   2.582  -3.719   4.419
  111    HA   ILE  17           HA       ILE  17   3.368  -6.126   3.052
  112    HB   ILE  17           HB       ILE  17   5.615  -5.700   4.023
  113   1HG1  ILE  17          2HG1      ILE  17   4.300  -3.239   5.189
  114   2HG1  ILE  17          1HG1      ILE  17   4.871  -4.621   6.117
  115   1HG2  ILE  17          1HG2      ILE  17   5.977  -3.523   2.817
  116   2HG2  ILE  17          2HG2      ILE  17   4.232  -3.460   2.568
  117   3HG2  ILE  17          3HG2      ILE  17   5.173  -4.785   1.883
  118   1HD1  ILE  17          1HD1      ILE  17   6.678  -2.982   4.371
  119   2HD1  ILE  17          2HD1      ILE  17   7.123  -4.136   5.628
  120   3HD1  ILE  17          3HD1      ILE  17   6.373  -2.601   6.065
  121    H    LYS  18           H        LYS  18   2.675  -5.152   6.343
  122    HA   LYS  18           HA       LYS  18   3.727  -7.363   7.708
  123   1HB   LYS  18          2HB       LYS  18   2.346  -5.082   8.406
  124   2HB   LYS  18          1HB       LYS  18   1.189  -6.352   8.778
  125   1HG   LYS  18          2HG       LYS  18   3.067  -7.478  10.064
  126   2HG   LYS  18          1HG       LYS  18   3.942  -5.954   9.903
  127   1HD   LYS  18          2HD       LYS  18   2.759  -6.065  12.035
  128   2HD   LYS  18          1HD       LYS  18   2.103  -4.783  11.015
  129   1HE   LYS  18          2HE       LYS  18   0.842  -7.459  10.823
  130   2HE   LYS  18          1HE       LYS  18   0.555  -6.534  12.296
  131   1HZ   LYS  18          1HZ       LYS  18   0.244  -4.984   9.894
  132   2HZ   LYS  18          2HZ       LYS  18  -0.788  -5.130  11.228
  133   3HZ   LYS  18          3HZ       LYS  18  -0.838  -6.282   9.990
  134    H    GLU  19           H        GLU  19   0.725  -6.895   5.962
  135    HA   GLU  19           HA       GLU  19  -0.507  -9.322   6.807
  136   1HB   GLU  19          2HB       GLU  19  -0.989  -7.438   4.505
  137   2HB   GLU  19          1HB       GLU  19  -1.910  -8.925   4.684
  138   1HG   GLU  19          2HG       GLU  19  -1.884  -7.477   7.162
  139   2HG   GLU  19          1HG       GLU  19  -2.425  -6.433   5.850
  140    H    LEU  20           H        LEU  20   1.583  -8.382   4.152
  141    HA   LEU  20           HA       LEU  20   1.390 -10.756   2.650
  142   1HB   LEU  20          2HB       LEU  20   2.869  -8.336   2.548
  143   2HB   LEU  20          1HB       LEU  20   4.024  -9.654   2.476
  144    HG   LEU  20           HG       LEU  20   2.079 -10.436   0.695
  145   1HD1  LEU  20          1HD1      LEU  20   0.880  -8.606   0.215
  146   2HD1  LEU  20          2HD1      LEU  20   2.292  -8.138  -0.732
  147   3HD1  LEU  20          3HD1      LEU  20   2.082  -7.517   0.904
  148   1HD2  LEU  20          1HD2      LEU  20   4.707 -10.277   0.664
  149   2HD2  LEU  20          2HD2      LEU  20   4.367  -8.846  -0.311
  150   3HD2  LEU  20          3HD2      LEU  20   3.771 -10.425  -0.822
  151    H    LYS  21           H        LYS  21   3.260  -9.822   5.445
  152    HA   LYS  21           HA       LYS  21   4.926 -12.174   5.413
  153   1HB   LYS  21          2HB       LYS  21   5.590  -9.925   6.385
  154   2HB   LYS  21          1HB       LYS  21   4.488 -10.265   7.713
  155   1HG   LYS  21          2HG       LYS  21   6.137 -12.529   7.432
  156   2HG   LYS  21          1HG       LYS  21   7.187 -11.115   7.344
  157   1HD   LYS  21          2HD       LYS  21   7.134 -11.219   9.591
  158   2HD   LYS  21          1HD       LYS  21   5.562 -10.436   9.413
  159   1HE   LYS  21          2HE       LYS  21   4.528 -12.710   9.339
  160   2HE   LYS  21          1HE       LYS  21   6.111 -13.384   9.722
  161   1HZ   LYS  21          1HZ       LYS  21   4.263 -11.897  11.424
  162   2HZ   LYS  21          2HZ       LYS  21   5.915 -11.647  11.679
  163   3HZ   LYS  21          3HZ       LYS  21   5.269 -13.204  11.803
  164    H    GLN  22           H        GLN  22   2.030 -11.040   7.057
  165    HA   GLN  22           HA       GLN  22   1.828 -13.263   8.839
  166   1HB   GLN  22          2HB       GLN  22   0.743 -11.055   9.239
  167   2HB   GLN  22          1HB       GLN  22  -0.353 -11.387   7.904
  168   1HG   GLN  22          2HG       GLN  22  -0.930 -13.530   9.234
  169   2HG   GLN  22          1HG       GLN  22  -0.214 -12.668  10.595
  170   1HE2  GLN  22          1HE2      GLN  22  -2.901 -13.480  10.446
  171   2HE2  GLN  22          2HE2      GLN  22  -3.891 -12.063  10.430
  172    H    TYR  23           H        TYR  23   0.793 -12.583   5.586
  173    HA   TYR  23           HA       TYR  23  -0.979 -14.853   5.409
  174   1HB   TYR  23          2HB       TYR  23  -0.096 -12.660   3.610
  175   2HB   TYR  23          1HB       TYR  23  -0.592 -14.164   2.835
  176    HD1  TYR  23           1HD      TYR  23  -2.881 -15.142   3.812
  177    HD2  TYR  23           2HD      TYR  23  -1.703 -11.059   3.928
  178    HE1  TYR  23           1HE      TYR  23  -5.234 -14.476   4.010
  179    HE2  TYR  23           2HE      TYR  23  -4.051 -10.380   4.129
  180    HH   TYR  23           HH       TYR  23  -6.415 -12.181   5.088
  181    H    GLY  24           H        GLY  24   2.253 -13.977   4.272
  182   1HA   GLY  24          2HA       GLY  24   3.945 -15.756   4.337
  183   2HA   GLY  24          1HA       GLY  24   2.717 -16.837   3.698
  184    H    ILE  25           H        ILE  25   2.063 -14.157   2.038
  185    HA   ILE  25           HA       ILE  25   2.973 -15.049  -0.408
  186    HB   ILE  25           HB       ILE  25   3.015 -12.117  -0.268
  187   1HG1  ILE  25          2HG1      ILE  25   0.526 -13.614   0.589
  188   2HG1  ILE  25          1HG1      ILE  25   1.418 -12.423   1.534
  189   1HG2  ILE  25          1HG2      ILE  25   2.691 -12.718  -2.398
  190   2HG2  ILE  25          2HG2      ILE  25   0.991 -12.836  -1.927
  191   3HG2  ILE  25          3HG2      ILE  25   2.002 -14.281  -1.961
  192   1HD1  ILE  25          1HD1      ILE  25  -0.464 -12.033  -0.718
  193   2HD1  ILE  25          2HD1      ILE  25   0.873 -10.897  -0.557
  194   3HD1  ILE  25          3HD1      ILE  25  -0.268 -11.109   0.771
  195    H    GLY  26           H        GLY  26   4.559 -13.728  -1.882
  196   1HA   GLY  26          2HA       GLY  26   7.155 -13.984  -0.647
  197   2HA   GLY  26          1HA       GLY  26   6.828 -13.605  -2.336
  198    H    ASP  27           H        ASP  27   8.766 -12.395  -0.524
  199    HA   ASP  27           HA       ASP  27   7.925  -9.885   0.408
  200   1HB   ASP  27          2HB       ASP  27  10.537 -11.153  -0.229
  201   2HB   ASP  27          1HB       ASP  27  10.511  -9.395  -0.127
  202    H    TYR  28           H        TYR  28   8.611 -11.007  -2.794
  203    HA   TYR  28           HA       TYR  28   9.366  -8.769  -4.192
  204   1HB   TYR  28          2HB       TYR  28   8.488 -11.229  -4.934
  205   2HB   TYR  28          1HB       TYR  28   7.093 -10.255  -5.386
  206    HD1  TYR  28           1HD      TYR  28   8.774  -7.738  -6.010
  207    HD2  TYR  28           2HD      TYR  28   9.093 -11.805  -7.207
  208    HE1  TYR  28           1HE      TYR  28   9.906  -7.033  -8.057
  209    HE2  TYR  28           2HE      TYR  28  10.233 -11.111  -9.273
  210    HH   TYR  28           HH       TYR  28  10.125  -8.373 -10.603
  211    H    TYR  29           H        TYR  29   6.122  -9.688  -3.220
  212    HA   TYR  29           HA       TYR  29   4.920  -7.322  -4.260
  213   1HB   TYR  29          2HB       TYR  29   3.685  -9.342  -2.386
  214   2HB   TYR  29          1HB       TYR  29   2.848  -8.235  -3.466
  215    HD1  TYR  29           1HD      TYR  29   2.597 -11.296  -3.439
  216    HD2  TYR  29           2HD      TYR  29   5.024  -8.636  -5.722
  217    HE1  TYR  29           1HE      TYR  29   2.742 -12.976  -5.227
  218    HE2  TYR  29           2HE      TYR  29   5.181 -10.320  -7.508
  219    HH   TYR  29           HH       TYR  29   3.899 -12.263  -8.329
  220    H    ILE  30           H        ILE  30   6.369  -8.066  -1.195
  221    HA   ILE  30           HA       ILE  30   4.962  -5.976   0.210
  222    HB   ILE  30           HB       ILE  30   6.163  -6.495   2.067
  223   1HG1  ILE  30          2HG1      ILE  30   8.554  -7.538   1.865
  224   2HG1  ILE  30          1HG1      ILE  30   8.499  -6.849   0.246
  225   1HG2  ILE  30          1HG2      ILE  30   6.968  -8.946   1.957
  226   2HG2  ILE  30          2HG2      ILE  30   6.277  -8.908   0.338
  227   3HG2  ILE  30          3HG2      ILE  30   5.264  -8.564   1.735
  228   1HD1  ILE  30          1HD1      ILE  30   9.254  -4.982   1.181
  229   2HD1  ILE  30          2HD1      ILE  30   8.886  -5.553   2.809
  230   3HD1  ILE  30          3HD1      ILE  30   7.626  -4.789   1.834
  231    H    LYS  31           H        LYS  31   7.824  -6.375  -1.697
  232    HA   LYS  31           HA       LYS  31   8.903  -3.755  -1.201
  233   1HB   LYS  31          2HB       LYS  31   9.594  -5.768  -3.342
  234   2HB   LYS  31          1HB       LYS  31  10.551  -4.361  -2.900
  235   1HG   LYS  31          2HG       LYS  31   9.947  -6.659  -1.053
  236   2HG   LYS  31          1HG       LYS  31  11.428  -6.489  -1.996
  237   1HD   LYS  31          2HD       LYS  31  12.150  -4.654  -0.761
  238   2HD   LYS  31          1HD       LYS  31  10.530  -4.301  -0.158
  239   1HE   LYS  31          2HE       LYS  31  10.728  -6.617   0.992
  240   2HE   LYS  31          1HE       LYS  31  12.458  -6.416   0.719
  241   1HZ   LYS  31          1HZ       LYS  31  12.578  -4.669   2.170
  242   2HZ   LYS  31          2HZ       LYS  31  11.362  -5.582   2.911
  243   3HZ   LYS  31          3HZ       LYS  31  10.955  -4.231   1.978
  244    H    LEU  32           H        LEU  32   7.372  -5.401  -3.972
  245    HA   LEU  32           HA       LEU  32   7.388  -3.315  -5.758
  246   1HB   LEU  32          2HB       LEU  32   6.213  -4.716  -7.068
  247   2HB   LEU  32          1HB       LEU  32   6.408  -5.853  -5.757
  248    HG   LEU  32           HG       LEU  32   4.150  -5.963  -6.348
  249   1HD1  LEU  32          1HD1      LEU  32   3.513  -4.155  -4.228
  250   2HD1  LEU  32          2HD1      LEU  32   5.011  -5.023  -3.876
  251   3HD1  LEU  32          3HD1      LEU  32   3.526  -5.921  -4.232
  252   1HD2  LEU  32          1HD2      LEU  32   3.528  -3.105  -5.960
  253   2HD2  LEU  32          2HD2      LEU  32   2.856  -4.266  -7.103
  254   3HD2  LEU  32          3HD2      LEU  32   4.416  -3.512  -7.427
  255    H    ILE  33           H        ILE  33   5.645  -3.578  -2.845
  256    HA   ILE  33           HA       ILE  33   3.547  -1.717  -3.439
  257    HB   ILE  33           HB       ILE  33   4.568  -3.100  -0.987
  258   1HG1  ILE  33          2HG1      ILE  33   1.912  -2.897  -2.401
  259   2HG1  ILE  33          1HG1      ILE  33   2.983  -4.291  -2.319
  260   1HG2  ILE  33          1HG2      ILE  33   3.934  -1.547   0.457
  261   2HG2  ILE  33          2HG2      ILE  33   2.315  -1.535  -0.240
  262   3HG2  ILE  33          3HG2      ILE  33   3.554  -0.457  -0.874
  263   1HD1  ILE  33          1HD1      ILE  33   0.804  -3.770  -0.704
  264   2HD1  ILE  33          2HD1      ILE  33   2.196  -3.409   0.315
  265   3HD1  ILE  33          3HD1      ILE  33   2.044  -4.994  -0.443
  266    H    ASN  34           H        ASN  34   6.445  -1.564  -1.365
  267    HA   ASN  34           HA       ASN  34   6.328   1.121  -0.711
  268   1HB   ASN  34          2HB       ASN  34   7.866  -0.416   0.374
  269   2HB   ASN  34          1HB       ASN  34   8.763  -0.622  -1.125
  270   1HD2  ASN  34          1HD2      ASN  34   7.478   2.363   0.249
  271   2HD2  ASN  34          2HD2      ASN  34   9.010   3.131   0.468
  272    H    ASN  35           H        ASN  35   7.182  -0.324  -3.736
  273    HA   ASN  35           HA       ASN  35   8.727   1.816  -4.779
  274   1HB   ASN  35          2HB       ASN  35   8.709  -0.535  -5.660
  275   2HB   ASN  35          1HB       ASN  35   7.118  -0.208  -6.343
  276   1HD2  ASN  35          1HD2      ASN  35   7.830  -0.531  -8.438
  277   2HD2  ASN  35          2HD2      ASN  35   8.842   0.604  -9.258
  278    H    ALA  36           H        ALA  36   5.317   1.296  -4.444
  279    HA   ALA  36           HA       ALA  36   4.333   2.915  -6.494
  280   1HB   ALA  36          1HB       ALA  36   2.497   3.291  -4.531
  281   2HB   ALA  36          2HB       ALA  36   3.292   1.812  -3.993
  282   3HB   ALA  36          3HB       ALA  36   2.562   1.887  -5.595
  283    H    LYS  37           H        LYS  37   3.457   5.028  -6.447
  284    HA   LYS  37           HA       LYS  37   5.112   6.870  -4.901
  285   1HB   LYS  37          2HB       LYS  37   3.410   7.172  -7.368
  286   2HB   LYS  37          1HB       LYS  37   4.063   8.560  -6.509
  287   1HG   LYS  37          2HG       LYS  37   5.578   8.155  -8.240
  288   2HG   LYS  37          1HG       LYS  37   6.343   7.473  -6.803
  289   1HD   LYS  37          2HD       LYS  37   6.549   5.973  -8.733
  290   2HD   LYS  37          1HD       LYS  37   5.595   5.244  -7.445
  291   1HE   LYS  37          2HE       LYS  37   3.685   5.272  -8.663
  292   2HE   LYS  37          1HE       LYS  37   4.101   6.780  -9.479
  293   1HZ   LYS  37          1HZ       LYS  37   4.135   4.406 -10.672
  294   2HZ   LYS  37          2HZ       LYS  37   5.742   4.479 -10.149
  295   3HZ   LYS  37          3HZ       LYS  37   5.123   5.696 -11.148
  296    H    THR  38           H        THR  38   1.732   6.127  -5.589
  297    HA   THR  38           HA       THR  38   0.826   8.095  -3.633
  298    HB   THR  38           HB       THR  38  -1.383   7.692  -4.460
  299    HG1  THR  38           1HG      THR  38  -1.609   5.570  -4.713
  300   1HG2  THR  38          1HG2      THR  38   0.738   8.019  -6.467
  301   2HG2  THR  38          2HG2      THR  38  -0.679   9.012  -6.130
  302   3HG2  THR  38          3HG2      THR  38  -0.841   7.537  -7.084
  303    H    VAL  39           H        VAL  39  -1.539   6.579  -2.839
  304    HA   VAL  39           HA       VAL  39  -0.296   4.394  -1.338
  305    HB   VAL  39           HB       VAL  39  -0.658   6.608  -0.021
  306   1HG1  VAL  39          1HG1      VAL  39  -2.765   6.779   1.087
  307   2HG1  VAL  39          2HG1      VAL  39  -3.360   5.334   0.268
  308   3HG1  VAL  39          3HG1      VAL  39  -3.045   6.804  -0.655
  309   1HG2  VAL  39          1HG2      VAL  39  -1.215   3.796   0.787
  310   2HG2  VAL  39          2HG2      VAL  39  -1.298   5.097   1.975
  311   3HG2  VAL  39          3HG2      VAL  39   0.208   4.785   1.108
  312    H    GLU  40           H        GLU  40  -3.302   5.792  -2.547
  313    HA   GLU  40           HA       GLU  40  -5.147   3.939  -1.747
  314   1HB   GLU  40          2HB       GLU  40  -4.865   5.695  -4.103
  315   2HB   GLU  40          1HB       GLU  40  -6.000   4.364  -4.276
  316   1HG   GLU  40          2HG       GLU  40  -7.341   6.062  -3.490
  317   2HG   GLU  40          1HG       GLU  40  -6.942   5.180  -2.015
  318    H    GLY  41           H        GLY  41  -3.005   3.676  -4.572
  319   1HA   GLY  41          2HA       GLY  41  -3.972   1.055  -5.250
  320   2HA   GLY  41          1HA       GLY  41  -2.588   1.873  -5.962
  321    H    VAL  42           H        VAL  42  -1.475   2.328  -3.214
  322    HA   VAL  42           HA       VAL  42   0.279   0.160  -3.104
  323    HB   VAL  42           HB       VAL  42  -0.401   2.043  -0.852
  324   1HG1  VAL  42          1HG1      VAL  42   1.856   0.156  -1.407
  325   2HG1  VAL  42          2HG1      VAL  42   0.860   0.298   0.048
  326   3HG1  VAL  42          3HG1      VAL  42   2.056   1.543  -0.334
  327   1HG2  VAL  42          1HG2      VAL  42   0.194   3.270  -2.875
  328   2HG2  VAL  42          2HG2      VAL  42   1.645   2.289  -3.047
  329   3HG2  VAL  42          3HG2      VAL  42   1.482   3.380  -1.676
  330    H    GLU  43           H        GLU  43  -2.494   0.911  -1.011
  331    HA   GLU  43           HA       GLU  43  -2.235  -1.432   0.573
  332   1HB   GLU  43          2HB       GLU  43  -4.803  -0.840   0.979
  333   2HB   GLU  43          1HB       GLU  43  -3.504   0.092   1.708
  334   1HG   GLU  43          2HG       GLU  43  -3.726   1.827   0.134
  335   2HG   GLU  43          1HG       GLU  43  -4.754   0.846  -0.913
  336    H    SER  44           H        SER  44  -4.482  -0.597  -2.056
  337    HA   SER  44           HA       SER  44  -5.723  -3.128  -2.164
  338   1HB   SER  44          2HB       SER  44  -6.139  -0.673  -3.347
  339   2HB   SER  44          1HB       SER  44  -5.625  -1.675  -4.707
  340    HG   SER  44           HG       SER  44  -7.459  -2.694  -4.621
  341    H    LEU  45           H        LEU  45  -2.719  -1.934  -3.347
  342    HA   LEU  45           HA       LEU  45  -2.195  -3.585  -5.520
  343   1HB   LEU  45          2HB       LEU  45  -0.653  -2.004  -3.622
  344   2HB   LEU  45          1HB       LEU  45   0.224  -3.417  -4.160
  345   1HD1  LEU  45          1HD1      LEU  45   1.951  -2.030  -6.115
  346   2HD1  LEU  45          2HD1      LEU  45   0.933  -2.690  -7.394
  347   3HD1  LEU  45          3HD1      LEU  45   1.204  -3.616  -5.918
  348   1HD2  LEU  45          1HD2      LEU  45  -2.215  -1.723  -6.177
  349   2HD2  LEU  45          2HD2      LEU  45  -1.316  -2.717  -7.321
  350   3HD2  LEU  45          3HD2      LEU  45  -1.106  -0.966  -7.318
  351    H    LYS  46           H        LYS  46  -1.241  -4.172  -2.131
  352    HA   LYS  46           HA       LYS  46  -0.490  -6.871  -2.628
  353   1HB   LYS  46          2HB       LYS  46   0.584  -6.271  -0.741
  354   2HB   LYS  46          1HB       LYS  46  -0.610  -5.053  -0.318
  355   1HG   LYS  46          2HG       LYS  46  -1.215  -7.962   0.070
  356   2HG   LYS  46          1HG       LYS  46  -0.221  -7.085   1.239
  357   1HD   LYS  46          2HD       LYS  46  -2.087  -5.374   1.343
  358   2HD   LYS  46          1HD       LYS  46  -3.071  -6.526   0.447
  359   1HE   LYS  46          2HE       LYS  46  -3.427  -7.791   2.245
  360   2HE   LYS  46          1HE       LYS  46  -1.732  -7.726   2.729
  361   1HZ   LYS  46          1HZ       LYS  46  -3.561  -6.641   4.201
  362   2HZ   LYS  46          2HZ       LYS  46  -3.423  -5.354   3.113
  363   3HZ   LYS  46          3HZ       LYS  46  -2.073  -5.863   3.996
  364    H    ASN  47           H        ASN  47  -3.387  -5.350  -1.245
  365    HA   ASN  47           HA       ASN  47  -4.737  -7.701  -0.555
  366   1HB   ASN  47          2HB       ASN  47  -5.467  -5.420   0.115
  367   2HB   ASN  47          1HB       ASN  47  -5.963  -5.108  -1.546
  368   1HD2  ASN  47          1HD2      ASN  47  -8.089  -4.754  -0.898
  369   2HD2  ASN  47          2HD2      ASN  47  -9.135  -6.052  -0.442
  370    H    GLU  48           H        GLU  48  -4.249  -6.161  -3.631
  371    HA   GLU  48           HA       GLU  48  -6.253  -7.700  -5.013
  372   1HB   GLU  48          2HB       GLU  48  -4.140  -5.744  -5.795
  373   2HB   GLU  48          1HB       GLU  48  -4.735  -6.843  -7.031
  374   1HG   GLU  48          2HG       GLU  48  -6.858  -5.947  -6.999
  375   2HG   GLU  48          1HG       GLU  48  -6.669  -5.289  -5.375
  376    H    ILE  49           H        ILE  49  -2.789  -7.856  -4.470
  377    HA   ILE  49           HA       ILE  49  -2.227 -10.006  -6.217
  378    HB   ILE  49           HB       ILE  49  -0.130 -10.203  -5.149
  379   1HG1  ILE  49          2HG1      ILE  49  -0.825  -8.537  -2.781
  380   2HG1  ILE  49          1HG1      ILE  49  -1.325 -10.216  -2.771
  381   1HG2  ILE  49          1HG2      ILE  49  -1.151  -7.671  -5.830
  382   2HG2  ILE  49          2HG2      ILE  49   0.520  -8.229  -5.888
  383   3HG2  ILE  49          3HG2      ILE  49  -0.099  -7.451  -4.433
  384   1HD1  ILE  49          1HD1      ILE  49   0.982  -9.389  -1.807
  385   2HD1  ILE  49          2HD1      ILE  49   1.467  -9.627  -3.485
  386   3HD1  ILE  49          3HD1      ILE  49   0.785 -10.969  -2.568
  387    H    LEU  50           H        LEU  50  -3.534  -9.764  -3.031
  388    HA   LEU  50           HA       LEU  50  -3.272 -12.539  -2.377
  389   1HB   LEU  50          2HB       LEU  50  -4.775 -10.240  -1.136
  390   2HB   LEU  50          1HB       LEU  50  -4.799 -11.863  -0.467
  391    HG   LEU  50           HG       LEU  50  -2.120 -10.732  -0.967
  392   1HD1  LEU  50          1HD1      LEU  50  -3.119  -8.735  -0.163
  393   2HD1  LEU  50          2HD1      LEU  50  -2.214  -9.449   1.172
  394   3HD1  LEU  50          3HD1      LEU  50  -3.970  -9.603   1.116
  395   1HD2  LEU  50          1HD2      LEU  50  -2.031 -11.650   1.511
  396   2HD2  LEU  50          2HD2      LEU  50  -1.955 -12.729   0.114
  397   3HD2  LEU  50          3HD2      LEU  50  -3.478 -12.512   0.983
  398    H    LYS  51           H        LYS  51  -5.682 -10.468  -3.843
  399    HA   LYS  51           HA       LYS  51  -7.939 -12.098  -3.610
  400   1HB   LYS  51          2HB       LYS  51  -7.599  -9.703  -4.663
  401   2HB   LYS  51          1HB       LYS  51  -7.410 -10.613  -6.156
  402   1HG   LYS  51          2HG       LYS  51  -9.599 -11.420  -6.079
  403   2HG   LYS  51          1HG       LYS  51  -9.783 -11.018  -4.370
  404   1HD   LYS  51          2HD       LYS  51 -10.883  -9.221  -5.170
  405   2HD   LYS  51          1HD       LYS  51  -9.258  -8.574  -5.403
  406   1HE   LYS  51          2HE       LYS  51  -9.260  -9.086  -7.690
  407   2HE   LYS  51          1HE       LYS  51 -10.620 -10.197  -7.526
  408   1HZ   LYS  51          1HZ       LYS  51 -12.040  -8.284  -7.020
  409   2HZ   LYS  51          2HZ       LYS  51 -11.324  -8.145  -8.545
  410   3HZ   LYS  51          3HZ       LYS  51 -10.722  -7.243  -7.246
  411    H    ALA  52           H        ALA  52  -5.088 -12.364  -5.547
  412    HA   ALA  52           HA       ALA  52  -6.054 -14.921  -6.605
  413   1HB   ALA  52          1HB       ALA  52  -6.312 -13.408  -8.447
  414   2HB   ALA  52          2HB       ALA  52  -4.903 -14.421  -8.762
  415   3HB   ALA  52          3HB       ALA  52  -4.689 -12.760  -8.204
  416    H    LEU  53           H        LEU  53  -4.557 -14.788  -4.376
  417    HA   LEU  53           HA       LEU  53  -1.813 -14.660  -4.529
  418   1HB   LEU  53          2HB       LEU  53  -3.226 -14.997  -2.480
  419   2HB   LEU  53          1HB       LEU  53  -3.346 -16.690  -2.915
  420    HG   LEU  53           HG       LEU  53  -0.582 -15.966  -2.893
  421   1HD1  LEU  53          1HD1      LEU  53  -0.656 -14.287  -1.381
  422   2HD1  LEU  53          2HD1      LEU  53  -0.737 -15.635  -0.247
  423   3HD1  LEU  53          3HD1      LEU  53  -2.212 -14.795  -0.725
  424   1HD2  LEU  53          1HD2      LEU  53  -0.870 -17.587  -0.782
  425   2HD2  LEU  53          2HD2      LEU  53  -0.888 -18.163  -2.449
  426   3HD2  LEU  53          3HD2      LEU  53  -2.406 -17.892  -1.592
  427    HA   PRO  54           HA       PRO  54  -0.889 -18.068  -7.274
  428   1HB   PRO  54          2HB       PRO  54   1.800 -17.874  -7.194
  429   2HB   PRO  54          1HB       PRO  54   0.801 -16.711  -8.072
  430   1HG   PRO  54          2HG       PRO  54   2.043 -16.471  -5.359
  431   2HG   PRO  54          1HG       PRO  54   1.965 -15.272  -6.664
  432   1HD   PRO  54          2HD       PRO  54   0.279 -15.255  -4.529
  433   2HD   PRO  54          1HD       PRO  54  -0.180 -14.647  -6.132
  434    H    THR  55           H        THR  55   1.252 -19.721  -7.055
  435    HA   THR  55           HA       THR  55   2.116 -21.528  -5.975
  436    HB   THR  55           HB       THR  55   1.168 -20.372  -3.359
  437    HG1  THR  55           1HG      THR  55   3.586 -19.714  -4.679
  438   1HG2  THR  55          1HG2      THR  55   3.531 -21.269  -2.747
  439   2HG2  THR  55          2HG2      THR  55   3.305 -22.273  -4.180
  440   3HG2  THR  55          3HG2      THR  55   2.157 -22.370  -2.843
  441    H    GLU  56           H        GLU  56  -0.077 -22.145  -7.144
  442    HA   GLU  56           HA       GLU  56  -1.219 -24.227  -5.654
  443   1HB   GLU  56          2HB       GLU  56  -2.312 -22.105  -4.641
  444   2HB   GLU  56          1HB       GLU  56  -3.239 -22.057  -6.135
  445   1HG   GLU  56          2HG       GLU  56  -4.531 -23.792  -5.545
  446   2HG   GLU  56          1HG       GLU  56  -3.199 -24.662  -4.787
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  -0.300  22.463   6.360
    2   2H    MET   1          2HT       MET   1   0.696  23.868   6.336
    3   3H    MET   1          3HT       MET   1  -1.001  24.006   6.098
    4    HA   MET   1           HA       MET   1  -0.072  24.624   8.326
    5   1HB   MET   1          2HB       MET   1  -2.048  23.441   9.425
    6   2HB   MET   1          1HB       MET   1  -2.399  24.469   8.052
    7   1HG   MET   1          2HG       MET   1  -2.258  22.319   6.657
    8   2HG   MET   1          1HG       MET   1  -2.399  21.488   8.206
    9   1HE   MET   1          1HE       MET   1  -4.376  20.909   5.945
   10   2HE   MET   1          2HE       MET   1  -5.974  21.069   6.667
   11   3HE   MET   1          3HE       MET   1  -4.692  20.241   7.550
   12    H    GLU   2           H        GLU   2  -0.498  21.131   7.758
   13    HA   GLU   2           HA       GLU   2   1.611  20.642   9.744
   14   1HB   GLU   2          2HB       GLU   2  -0.902  20.198  10.440
   15   2HB   GLU   2          1HB       GLU   2  -0.656  18.707   9.533
   16   1HG   GLU   2          2HG       GLU   2  -0.117  18.081  11.678
   17   2HG   GLU   2          1HG       GLU   2   1.464  18.454  10.987
   18    H    ALA   3           H        ALA   3  -0.342  19.192   7.151
   19    HA   ALA   3           HA       ALA   3   0.184  17.763   5.462
   20   1HB   ALA   3          1HB       ALA   3   2.726  19.185   5.993
   21   2HB   ALA   3          2HB       ALA   3   1.803  19.023   4.498
   22   3HB   ALA   3          3HB       ALA   3   2.829  17.694   5.046
   23    H    VAL   4           H        VAL   4  -0.023  15.646   5.683
   24    HA   VAL   4           HA       VAL   4   2.019  14.093   7.036
   25    HB   VAL   4           HB       VAL   4  -0.841  13.754   7.917
   26   1HG1  VAL   4          1HG1      VAL   4   1.783  12.537   8.637
   27   2HG1  VAL   4          2HG1      VAL   4   0.214  11.772   8.383
   28   3HG1  VAL   4          3HG1      VAL   4   0.528  12.667   9.867
   29   1HG2  VAL   4          1HG2      VAL   4  -0.134  14.827  10.045
   30   2HG2  VAL   4          2HG2      VAL   4  -0.174  15.934   8.671
   31   3HG2  VAL   4          3HG2      VAL   4   1.370  15.313   9.254
   32    H    ASP   5           H        ASP   5   0.999  14.382   4.322
   33    HA   ASP   5           HA       ASP   5  -0.658  12.194   3.653
   34   1HB   ASP   5          2HB       ASP   5   0.123  12.627   1.321
   35   2HB   ASP   5          1HB       ASP   5  -0.493  14.059   2.139
   36    H    ALA   6           H        ALA   6   2.858  12.667   3.499
   37    HA   ALA   6           HA       ALA   6   3.502  10.153   2.432
   38   1HB   ALA   6          1HB       ALA   6   5.707  10.765   3.901
   39   2HB   ALA   6          2HB       ALA   6   4.952  12.346   3.735
   40   3HB   ALA   6          3HB       ALA   6   5.358  11.410   2.298
   41    H    ASN   7           H        ASN   7   2.974  11.220   5.751
   42    HA   ASN   7           HA       ASN   7   3.950   8.895   7.029
   43   1HB   ASN   7          2HB       ASN   7   3.160  11.288   7.938
   44   2HB   ASN   7          1HB       ASN   7   1.693  10.384   8.270
   45   1HD2  ASN   7          1HD2      ASN   7   1.847   8.529   9.636
   46   2HD2  ASN   7          2HD2      ASN   7   3.095   8.419  10.818
   47    H    SER   8           H        SER   8   0.675   9.849   6.039
   48    HA   SER   8           HA       SER   8  -0.565   7.463   6.929
   49   1HB   SER   8          2HB       SER   8  -1.744   9.645   6.477
   50   2HB   SER   8          1HB       SER   8  -1.551   9.320   4.754
   51    HG   SER   8           HG       SER   8  -3.473   8.476   6.322
   52    H    LEU   9           H        LEU   9   1.016   8.440   3.979
   53    HA   LEU   9           HA       LEU   9   0.087   6.365   2.305
   54   1HB   LEU   9          2HB       LEU   9   1.216   8.486   1.577
   55   2HB   LEU   9          1HB       LEU   9   2.731   7.812   2.145
   56    HG   LEU   9           HG       LEU   9   1.044   6.576  -0.029
   57   1HD1  LEU   9          1HD1      LEU   9   3.479   8.321  -0.222
   58   2HD1  LEU   9          2HD1      LEU   9   1.850   8.726  -0.760
   59   3HD1  LEU   9          3HD1      LEU   9   2.752   7.441  -1.566
   60   1HD2  LEU   9          1HD2      LEU   9   3.527   5.806   1.354
   61   2HD2  LEU   9          2HD2      LEU   9   3.540   5.653  -0.403
   62   3HD2  LEU   9          3HD2      LEU   9   2.316   4.809   0.546
   63    H    ALA  10           H        ALA  10   2.980   6.723   4.317
   64    HA   ALA  10           HA       ALA  10   4.208   4.298   3.615
   65   1HB   ALA  10          1HB       ALA  10   4.677   5.310   6.342
   66   2HB   ALA  10          2HB       ALA  10   4.986   6.443   5.026
   67   3HB   ALA  10          3HB       ALA  10   5.824   4.892   5.068
   68    H    GLN  11           H        GLN  11   1.516   4.920   5.665
   69    HA   GLN  11           HA       GLN  11   1.813   2.535   7.247
   70   1HB   GLN  11          2HB       GLN  11   0.728   4.369   8.310
   71   2HB   GLN  11          1HB       GLN  11  -0.394   4.566   6.968
   72   1HG   GLN  11          2HG       GLN  11  -1.336   2.363   7.489
   73   2HG   GLN  11          1HG       GLN  11  -0.288   2.265   8.899
   74   1HE2  GLN  11          1HE2      GLN  11  -2.390   4.746   7.461
   75   2HE2  GLN  11          2HE2      GLN  11  -3.240   5.113   8.916
   76    H    ALA  12           H        ALA  12  -0.227   3.580   4.538
   77    HA   ALA  12           HA       ALA  12  -1.892   1.395   4.307
   78   1HB   ALA  12          1HB       ALA  12  -0.711   2.408   1.792
   79   2HB   ALA  12          2HB       ALA  12  -1.515   3.587   2.833
   80   3HB   ALA  12          3HB       ALA  12  -2.404   2.183   2.238
   81    H    LYS  13           H        LYS  13   1.444   1.776   3.358
   82    HA   LYS  13           HA       LYS  13   1.606  -0.901   2.235
   83   1HB   LYS  13          2HB       LYS  13   4.171  -0.085   2.258
   84   2HB   LYS  13          1HB       LYS  13   3.040   0.325   0.983
   85   1HG   LYS  13          2HG       LYS  13   2.760   2.487   1.730
   86   2HG   LYS  13          1HG       LYS  13   3.355   2.105   3.350
   87   1HD   LYS  13          2HD       LYS  13   5.008   2.171   0.820
   88   2HD   LYS  13          1HD       LYS  13   4.995   3.411   2.073
   89   1HE   LYS  13          2HE       LYS  13   5.487   0.940   3.350
   90   2HE   LYS  13          1HE       LYS  13   6.531   1.008   1.932
   91   1HZ   LYS  13          1HZ       LYS  13   6.878   3.452   2.911
   92   2HZ   LYS  13          2HZ       LYS  13   7.851   2.137   3.340
   93   3HZ   LYS  13          3HZ       LYS  13   6.583   2.613   4.351
   94    H    GLU  14           H        GLU  14   3.304   0.917   4.815
   95    HA   GLU  14           HA       GLU  14   4.696  -1.112   6.013
   96   1HB   GLU  14          2HB       GLU  14   3.382   1.358   7.064
   97   2HB   GLU  14          1HB       GLU  14   3.971   0.181   8.229
   98   1HG   GLU  14          2HG       GLU  14   6.152   0.333   6.745
   99   2HG   GLU  14          1HG       GLU  14   5.481   1.917   6.359
  100    H    ALA  15           H        ALA  15   1.294  -0.372   6.200
  101    HA   ALA  15           HA       ALA  15   0.758  -2.476   8.131
  102   1HB   ALA  15          1HB       ALA  15  -1.376  -1.636   8.283
  103   2HB   ALA  15          2HB       ALA  15  -1.408  -1.114   6.599
  104   3HB   ALA  15          3HB       ALA  15  -0.491  -0.192   7.791
  105    H    ALA  16           H        ALA  16   0.203  -1.872   4.680
  106    HA   ALA  16           HA       ALA  16  -1.228  -4.241   4.147
  107   1HB   ALA  16          1HB       ALA  16  -1.388  -2.533   2.539
  108   2HB   ALA  16          2HB       ALA  16  -0.472  -3.822   1.758
  109   3HB   ALA  16          3HB       ALA  16   0.364  -2.400   2.383
  110    H    ILE  17           H        ILE  17   2.168  -3.614   4.532
  111    HA   ILE  17           HA       ILE  17   3.009  -6.040   3.231
  112    HB   ILE  17           HB       ILE  17   5.242  -5.528   4.079
  113   1HG1  ILE  17          2HG1      ILE  17   3.886  -3.224   5.487
  114   2HG1  ILE  17          1HG1      ILE  17   4.648  -4.608   6.262
  115   1HG2  ILE  17          1HG2      ILE  17   5.649  -3.726   2.676
  116   2HG2  ILE  17          2HG2      ILE  17   4.133  -2.931   3.092
  117   3HG2  ILE  17          3HG2      ILE  17   4.123  -4.361   2.062
  118   1HD1  ILE  17          1HD1      ILE  17   6.810  -3.910   5.488
  119   2HD1  ILE  17          2HD1      ILE  17   6.025  -2.561   6.310
  120   3HD1  ILE  17          3HD1      ILE  17   6.093  -2.602   4.547
  121    H    LYS  18           H        LYS  18   2.240  -4.998   6.479
  122    HA   LYS  18           HA       LYS  18   3.366  -7.079   7.957
  123   1HB   LYS  18          2HB       LYS  18   1.572  -4.943   8.428
  124   2HB   LYS  18          1HB       LYS  18   0.778  -6.397   9.016
  125   1HG   LYS  18          2HG       LYS  18   3.608  -6.043   9.783
  126   2HG   LYS  18          1HG       LYS  18   2.442  -4.928  10.501
  127   1HD   LYS  18          2HD       LYS  18   1.082  -6.926  11.170
  128   2HD   LYS  18          1HD       LYS  18   2.422  -7.939  10.632
  129   1HE   LYS  18          2HE       LYS  18   3.670  -6.118  12.256
  130   2HE   LYS  18          1HE       LYS  18   2.122  -6.350  13.067
  131   1HZ   LYS  18          1HZ       LYS  18   4.336  -8.187  12.750
  132   2HZ   LYS  18          2HZ       LYS  18   2.809  -8.872  12.505
  133   3HZ   LYS  18          3HZ       LYS  18   3.164  -8.101  13.967
  134    H    GLU  19           H        GLU  19   0.471  -6.941   6.007
  135    HA   GLU  19           HA       GLU  19  -0.534  -9.487   6.882
  136   1HB   GLU  19          2HB       GLU  19  -1.485  -7.324   5.292
  137   2HB   GLU  19          1HB       GLU  19  -1.561  -8.778   4.305
  138   1HG   GLU  19          2HG       GLU  19  -3.598  -8.893   5.289
  139   2HG   GLU  19          1HG       GLU  19  -2.657  -9.772   6.493
  140    H    LEU  20           H        LEU  20   1.433  -8.275   4.246
  141    HA   LEU  20           HA       LEU  20   1.462 -10.608   2.676
  142   1HB   LEU  20          2HB       LEU  20   2.519  -8.091   2.454
  143   2HB   LEU  20          1HB       LEU  20   3.956  -9.067   2.699
  144    HG   LEU  20           HG       LEU  20   2.336 -10.396   0.791
  145   1HD1  LEU  20          1HD1      LEU  20   2.494  -8.563  -0.993
  146   2HD1  LEU  20          2HD1      LEU  20   2.580  -7.444   0.367
  147   3HD1  LEU  20          3HD1      LEU  20   1.169  -8.483   0.167
  148   1HD2  LEU  20          1HD2      LEU  20   5.033  -9.577   1.173
  149   2HD2  LEU  20          2HD2      LEU  20   4.530  -9.155  -0.459
  150   3HD2  LEU  20          3HD2      LEU  20   4.391 -10.818   0.098
  151    H    LYS  21           H        LYS  21   3.281  -9.610   5.493
  152    HA   LYS  21           HA       LYS  21   5.110 -11.844   5.340
  153   1HB   LYS  21          2HB       LYS  21   5.962 -11.027   7.488
  154   2HB   LYS  21          1HB       LYS  21   5.862  -9.723   6.315
  155   1HG   LYS  21          2HG       LYS  21   3.929  -8.824   7.351
  156   2HG   LYS  21          1HG       LYS  21   3.740 -10.247   8.378
  157   1HD   LYS  21          2HD       LYS  21   6.280  -9.434   8.984
  158   2HD   LYS  21          1HD       LYS  21   5.457  -7.898   8.708
  159   1HE   LYS  21          2HE       LYS  21   4.661  -8.050  10.779
  160   2HE   LYS  21          1HE       LYS  21   3.675  -9.404  10.231
  161   1HZ   LYS  21          1HZ       LYS  21   5.461 -10.908  10.836
  162   2HZ   LYS  21          2HZ       LYS  21   4.987  -9.987  12.172
  163   3HZ   LYS  21          3HZ       LYS  21   6.417  -9.611  11.352
  164    H    GLN  22           H        GLN  22   2.177 -10.941   7.032
  165    HA   GLN  22           HA       GLN  22   2.160 -13.177   8.812
  166   1HB   GLN  22          2HB       GLN  22   0.899 -11.041   9.183
  167   2HB   GLN  22          1HB       GLN  22  -0.190 -11.514   7.887
  168   1HG   GLN  22          2HG       GLN  22   0.083 -13.616   9.844
  169   2HG   GLN  22          1HG       GLN  22  -0.435 -12.103  10.587
  170   1HE2  GLN  22          1HE2      GLN  22  -1.840 -14.672  10.074
  171   2HE2  GLN  22          2HE2      GLN  22  -3.274 -14.234   9.214
  172    H    TYR  23           H        TYR  23   1.129 -12.595   5.548
  173    HA   TYR  23           HA       TYR  23  -0.462 -15.004   5.370
  174   1HB   TYR  23          2HB       TYR  23   0.191 -12.719   3.590
  175   2HB   TYR  23          1HB       TYR  23  -0.163 -14.255   2.800
  176    HD1  TYR  23           1HD      TYR  23  -1.563 -11.287   3.960
  177    HD2  TYR  23           2HD      TYR  23  -2.336 -15.463   3.764
  178    HE1  TYR  23           1HE      TYR  23  -3.964 -10.846   4.192
  179    HE2  TYR  23           2HE      TYR  23  -4.742 -15.035   3.994
  180    HH   TYR  23           HH       TYR  23  -6.093 -12.692   5.168
  181    H    GLY  24           H        GLY  24   2.664 -13.822   4.199
  182   1HA   GLY  24          2HA       GLY  24   4.554 -15.324   4.149
  183   2HA   GLY  24          1HA       GLY  24   3.447 -16.630   3.759
  184    H    ILE  25           H        ILE  25   2.449 -14.040   1.963
  185    HA   ILE  25           HA       ILE  25   3.044 -15.118  -0.500
  186    HB   ILE  25           HB       ILE  25   3.126 -12.190  -0.614
  187   1HG1  ILE  25          2HG1      ILE  25   0.776 -13.547   0.734
  188   2HG1  ILE  25          1HG1      ILE  25   1.820 -12.313   1.433
  189   1HG2  ILE  25          1HG2      ILE  25   1.646 -14.453  -1.852
  190   2HG2  ILE  25          2HG2      ILE  25   2.575 -13.160  -2.608
  191   3HG2  ILE  25          3HG2      ILE  25   0.963 -12.832  -1.972
  192   1HD1  ILE  25          1HD1      ILE  25  -0.237 -12.016  -0.722
  193   2HD1  ILE  25          2HD1      ILE  25   1.016 -10.808  -0.455
  194   3HD1  ILE  25          3HD1      ILE  25  -0.130 -11.185   0.831
  195    H    GLY  26           H        GLY  26   4.459 -13.939  -2.256
  196   1HA   GLY  26          2HA       GLY  26   7.162 -14.302  -1.462
  197   2HA   GLY  26          1HA       GLY  26   6.608 -13.710  -3.025
  198    H    ASP  27           H        ASP  27   8.833 -12.860  -1.235
  199    HA   ASP  27           HA       ASP  27   8.276 -10.404  -0.026
  200   1HB   ASP  27          2HB       ASP  27  10.697  -9.966  -0.202
  201   2HB   ASP  27          1HB       ASP  27  10.372 -11.602   0.363
  202    H    TYR  28           H        TYR  28   8.548 -11.275  -3.334
  203    HA   TYR  28           HA       TYR  28   9.361  -9.003  -4.643
  204   1HB   TYR  28          2HB       TYR  28   8.320 -11.330  -5.472
  205   2HB   TYR  28          1HB       TYR  28   6.886 -10.321  -5.651
  206    HD1  TYR  28           1HD      TYR  28  10.513  -9.701  -6.272
  207    HD2  TYR  28           2HD      TYR  28   6.570  -9.770  -7.859
  208    HE1  TYR  28           1HE      TYR  28  11.361  -8.821  -8.397
  209    HE2  TYR  28           2HE      TYR  28   7.406  -8.893  -9.994
  210    HH   TYR  28           HH       TYR  28   9.457  -8.746 -11.252
  211    H    TYR  29           H        TYR  29   6.161  -9.752  -3.412
  212    HA   TYR  29           HA       TYR  29   4.951  -7.349  -4.302
  213   1HB   TYR  29          2HB       TYR  29   3.897  -9.235  -2.198
  214   2HB   TYR  29          1HB       TYR  29   2.973  -8.182  -3.266
  215    HD1  TYR  29           1HD      TYR  29   4.720  -8.735  -5.756
  216    HD2  TYR  29           2HD      TYR  29   2.831 -11.293  -2.912
  217    HE1  TYR  29           1HE      TYR  29   4.649 -10.545  -7.424
  218    HE2  TYR  29           2HE      TYR  29   2.745 -13.097  -4.583
  219    HH   TYR  29           HH       TYR  29   3.372 -12.578  -7.887
  220    H    ILE  30           H        ILE  30   6.028  -8.364  -1.030
  221    HA   ILE  30           HA       ILE  30   5.130  -6.073   0.304
  222    HB   ILE  30           HB       ILE  30   5.978  -7.938   1.554
  223   1HG1  ILE  30          2HG1      ILE  30   6.245  -5.590   2.469
  224   2HG1  ILE  30          1HG1      ILE  30   7.249  -6.823   3.215
  225   1HG2  ILE  30          1HG2      ILE  30   7.590  -8.777   0.021
  226   2HG2  ILE  30          2HG2      ILE  30   8.378  -8.499   1.574
  227   3HG2  ILE  30          3HG2      ILE  30   8.614  -7.361   0.245
  228   1HD1  ILE  30          1HD1      ILE  30   8.002  -4.393   1.908
  229   2HD1  ILE  30          2HD1      ILE  30   8.774  -5.772   1.130
  230   3HD1  ILE  30          3HD1      ILE  30   8.984  -5.504   2.860
  231    H    LYS  31           H        LYS  31   7.751  -6.632  -1.865
  232    HA   LYS  31           HA       LYS  31   9.057  -4.099  -1.367
  233   1HB   LYS  31          2HB       LYS  31   9.616  -6.552  -2.879
  234   2HB   LYS  31          1HB       LYS  31  10.156  -5.079  -3.671
  235   1HG   LYS  31          2HG       LYS  31  12.018  -5.497  -2.463
  236   2HG   LYS  31          1HG       LYS  31  11.123  -4.602  -1.234
  237   1HD   LYS  31          2HD       LYS  31  10.226  -7.191  -0.913
  238   2HD   LYS  31          1HD       LYS  31  11.938  -7.398  -1.287
  239   1HE   LYS  31          2HE       LYS  31  11.473  -5.245   0.606
  240   2HE   LYS  31          1HE       LYS  31  10.852  -6.790   1.185
  241   1HZ   LYS  31          1HZ       LYS  31  13.625  -6.236   0.278
  242   2HZ   LYS  31          2HZ       LYS  31  13.046  -7.761   0.725
  243   3HZ   LYS  31          3HZ       LYS  31  13.124  -6.517   1.869
  244    H    LEU  32           H        LEU  32   7.307  -5.643  -4.064
  245    HA   LEU  32           HA       LEU  32   7.383  -3.537  -5.837
  246   1HB   LEU  32          2HB       LEU  32   6.144  -4.896  -7.123
  247   2HB   LEU  32          1HB       LEU  32   6.273  -6.035  -5.807
  248    HG   LEU  32           HG       LEU  32   4.011  -6.004  -6.409
  249   1HD1  LEU  32          1HD1      LEU  32   4.935  -5.079  -3.930
  250   2HD1  LEU  32          2HD1      LEU  32   3.457  -5.989  -4.274
  251   3HD1  LEU  32          3HD1      LEU  32   3.431  -4.223  -4.275
  252   1HD2  LEU  32          1HD2      LEU  32   4.454  -3.524  -7.417
  253   2HD2  LEU  32          2HD2      LEU  32   3.515  -3.141  -5.975
  254   3HD2  LEU  32          3HD2      LEU  32   2.856  -4.235  -7.190
  255    H    ILE  33           H        ILE  33   5.768  -3.723  -2.858
  256    HA   ILE  33           HA       ILE  33   3.729  -1.761  -3.378
  257    HB   ILE  33           HB       ILE  33   4.755  -3.151  -0.916
  258   1HG1  ILE  33          2HG1      ILE  33   2.176  -3.111  -2.471
  259   2HG1  ILE  33          1HG1      ILE  33   3.244  -4.475  -2.161
  260   1HG2  ILE  33          1HG2      ILE  33   2.477  -1.676  -0.176
  261   2HG2  ILE  33          2HG2      ILE  33   3.573  -0.541  -0.955
  262   3HG2  ILE  33          3HG2      ILE  33   4.125  -1.497   0.418
  263   1HD1  ILE  33          1HD1      ILE  33   0.933  -3.806  -0.791
  264   2HD1  ILE  33          2HD1      ILE  33   2.241  -3.363   0.305
  265   3HD1  ILE  33          3HD1      ILE  33   2.135  -5.007  -0.324
  266    H    ASN  34           H        ASN  34   6.664  -1.819  -1.347
  267    HA   ASN  34           HA       ASN  34   6.718   0.826  -0.589
  268   1HB   ASN  34          2HB       ASN  34   8.334  -1.265  -0.134
  269   2HB   ASN  34          1HB       ASN  34   9.335  -0.392  -1.291
  270   1HD2  ASN  34          1HD2      ASN  34   9.693   1.923  -0.813
  271   2HD2  ASN  34          2HD2      ASN  34   9.895   2.384   0.840
  272    H    ASN  35           H        ASN  35   7.353  -0.493  -3.727
  273    HA   ASN  35           HA       ASN  35   8.894   1.705  -4.708
  274   1HB   ASN  35          2HB       ASN  35   7.560  -0.671  -5.954
  275   2HB   ASN  35          1HB       ASN  35   8.167   0.628  -6.976
  276   1HD2  ASN  35          1HD2      ASN  35  10.320   0.833  -7.305
  277   2HD2  ASN  35          2HD2      ASN  35  11.501  -0.262  -6.682
  278    H    ALA  36           H        ALA  36   5.512   1.152  -4.288
  279    HA   ALA  36           HA       ALA  36   4.444   2.717  -6.334
  280   1HB   ALA  36          1HB       ALA  36   3.500   1.595  -3.830
  281   2HB   ALA  36          2HB       ALA  36   2.669   1.783  -5.373
  282   3HB   ALA  36          3HB       ALA  36   2.720   3.124  -4.229
  283    H    LYS  37           H        LYS  37   3.685   4.868  -6.387
  284    HA   LYS  37           HA       LYS  37   5.301   6.692  -4.773
  285   1HB   LYS  37          2HB       LYS  37   4.847   8.376  -6.456
  286   2HB   LYS  37          1HB       LYS  37   5.415   6.901  -7.238
  287   1HG   LYS  37          2HG       LYS  37   2.482   7.346  -6.965
  288   2HG   LYS  37          1HG       LYS  37   3.375   8.237  -8.188
  289   1HD   LYS  37          2HD       LYS  37   3.445   6.466  -9.520
  290   2HD   LYS  37          1HD       LYS  37   4.165   5.485  -8.243
  291   1HE   LYS  37          2HE       LYS  37   1.845   5.188  -7.315
  292   2HE   LYS  37          1HE       LYS  37   1.239   5.945  -8.787
  293   1HZ   LYS  37          1HZ       LYS  37   1.576   3.328  -8.524
  294   2HZ   LYS  37          2HZ       LYS  37   3.090   3.736  -9.156
  295   3HZ   LYS  37          3HZ       LYS  37   1.686   4.125 -10.012
  296    H    THR  38           H        THR  38   2.002   5.836  -5.483
  297    HA   THR  38           HA       THR  38   0.993   7.991  -3.777
  298    HB   THR  38           HB       THR  38  -1.163   7.555  -4.695
  299    HG1  THR  38           1HG      THR  38  -1.736   5.656  -5.360
  300   1HG2  THR  38          1HG2      THR  38   0.771   8.412  -6.307
  301   2HG2  THR  38          2HG2      THR  38  -0.890   8.174  -6.844
  302   3HG2  THR  38          3HG2      THR  38   0.325   6.939  -7.167
  303    H    VAL  39           H        VAL  39  -1.427   6.452  -3.057
  304    HA   VAL  39           HA       VAL  39  -0.249   4.395  -1.346
  305    HB   VAL  39           HB       VAL  39  -0.667   6.701  -0.194
  306   1HG1  VAL  39          1HG1      VAL  39  -2.804   6.880   0.872
  307   2HG1  VAL  39          2HG1      VAL  39  -3.354   5.393   0.098
  308   3HG1  VAL  39          3HG1      VAL  39  -3.039   6.829  -0.877
  309   1HG2  VAL  39          1HG2      VAL  39  -1.124   3.924   0.739
  310   2HG2  VAL  39          2HG2      VAL  39  -1.369   5.257   1.866
  311   3HG2  VAL  39          3HG2      VAL  39   0.205   5.021   1.099
  312    H    GLU  40           H        GLU  40  -3.266   5.782  -2.593
  313    HA   GLU  40           HA       GLU  40  -5.059   3.860  -1.796
  314   1HB   GLU  40          2HB       GLU  40  -5.319   6.020  -3.287
  315   2HB   GLU  40          1HB       GLU  40  -5.241   4.859  -4.607
  316   1HG   GLU  40          2HG       GLU  40  -7.299   4.091  -4.222
  317   2HG   GLU  40          1HG       GLU  40  -7.080   4.097  -2.471
  318    H    GLY  41           H        GLY  41  -2.760   3.702  -4.456
  319   1HA   GLY  41          2HA       GLY  41  -3.756   1.146  -5.371
  320   2HA   GLY  41          1HA       GLY  41  -2.334   1.990  -5.970
  321    H    VAL  42           H        VAL  42  -1.326   2.305  -3.179
  322    HA   VAL  42           HA       VAL  42   0.363   0.071  -3.093
  323    HB   VAL  42           HB       VAL  42  -0.292   1.933  -0.815
  324   1HG1  VAL  42          1HG1      VAL  42   1.727  -0.184  -1.291
  325   2HG1  VAL  42          2HG1      VAL  42   0.890   0.273   0.200
  326   3HG1  VAL  42          3HG1      VAL  42   2.230   1.257  -0.404
  327   1HG2  VAL  42          1HG2      VAL  42   1.321   3.407  -1.579
  328   2HG2  VAL  42          2HG2      VAL  42   0.552   2.900  -3.083
  329   3HG2  VAL  42          3HG2      VAL  42   2.091   2.193  -2.594
  330    H    GLU  43           H        GLU  43  -2.296   0.930  -0.883
  331    HA   GLU  43           HA       GLU  43  -2.206  -1.462   0.599
  332   1HB   GLU  43          2HB       GLU  43  -4.708  -0.785   1.055
  333   2HB   GLU  43          1HB       GLU  43  -3.390   0.185   1.698
  334   1HG   GLU  43          2HG       GLU  43  -3.683   1.860   0.103
  335   2HG   GLU  43          1HG       GLU  43  -4.648   0.817  -0.943
  336    H    SER  44           H        SER  44  -4.185  -0.505  -2.175
  337    HA   SER  44           HA       SER  44  -5.638  -2.945  -2.305
  338   1HB   SER  44          2HB       SER  44  -6.691  -2.034  -4.153
  339   2HB   SER  44          1HB       SER  44  -6.116  -0.568  -3.357
  340    HG   SER  44           HG       SER  44  -4.260  -0.700  -4.761
  341    H    LEU  45           H        LEU  45  -2.543  -1.900  -3.424
  342    HA   LEU  45           HA       LEU  45  -2.083  -3.633  -5.558
  343   1HB   LEU  45          2HB       LEU  45  -0.445  -2.090  -3.672
  344   2HB   LEU  45          1HB       LEU  45   0.365  -3.488  -4.341
  345   1HD1  LEU  45          1HD1      LEU  45   2.026  -1.967  -6.163
  346   2HD1  LEU  45          2HD1      LEU  45   1.027  -2.481  -7.523
  347   3HD1  LEU  45          3HD1      LEU  45   1.277  -3.565  -6.155
  348   1HD2  LEU  45          1HD2      LEU  45  -1.107  -0.980  -7.371
  349   2HD2  LEU  45          2HD2      LEU  45  -2.165  -1.761  -6.198
  350   3HD2  LEU  45          3HD2      LEU  45  -1.273  -2.735  -7.364
  351    H    LYS  46           H        LYS  46  -1.088  -4.145  -2.158
  352    HA   LYS  46           HA       LYS  46  -0.399  -6.869  -2.612
  353   1HB   LYS  46          2HB       LYS  46   0.727  -6.250  -0.765
  354   2HB   LYS  46          1HB       LYS  46  -0.434  -5.008  -0.333
  355   1HG   LYS  46          2HG       LYS  46  -1.097  -7.891   0.120
  356   2HG   LYS  46          1HG       LYS  46  -0.026  -7.037   1.236
  357   1HD   LYS  46          2HD       LYS  46  -1.813  -5.270   1.430
  358   2HD   LYS  46          1HD       LYS  46  -2.878  -6.356   0.545
  359   1HE   LYS  46          2HE       LYS  46  -3.048  -7.833   2.273
  360   2HE   LYS  46          1HE       LYS  46  -1.456  -7.431   2.915
  361   1HZ   LYS  46          1HZ       LYS  46  -3.823  -6.587   3.928
  362   2HZ   LYS  46          2HZ       LYS  46  -3.314  -5.244   3.035
  363   3HZ   LYS  46          3HZ       LYS  46  -2.318  -5.881   4.244
  364    H    ASN  47           H        ASN  47  -3.241  -5.306  -1.129
  365    HA   ASN  47           HA       ASN  47  -4.578  -7.664  -0.423
  366   1HB   ASN  47          2HB       ASN  47  -5.125  -5.010  -0.137
  367   2HB   ASN  47          1HB       ASN  47  -6.289  -5.446  -1.385
  368   1HD2  ASN  47          1HD2      ASN  47  -5.022  -6.967   1.565
  369   2HD2  ASN  47          2HD2      ASN  47  -6.568  -7.355   2.230
  370    H    GLU  48           H        GLU  48  -4.168  -6.100  -3.494
  371    HA   GLU  48           HA       GLU  48  -6.252  -7.569  -4.831
  372   1HB   GLU  48          2HB       GLU  48  -4.036  -5.753  -5.716
  373   2HB   GLU  48          1HB       GLU  48  -4.848  -6.765  -6.901
  374   1HG   GLU  48          2HG       GLU  48  -6.913  -5.711  -6.552
  375   2HG   GLU  48          1HG       GLU  48  -6.364  -4.950  -5.059
  376    H    ILE  49           H        ILE  49  -2.767  -7.808  -4.440
  377    HA   ILE  49           HA       ILE  49  -2.318  -9.983  -6.172
  378    HB   ILE  49           HB       ILE  49  -0.197 -10.238  -5.149
  379   1HG1  ILE  49          2HG1      ILE  49  -0.763  -8.495  -2.811
  380   2HG1  ILE  49          1HG1      ILE  49  -1.347 -10.144  -2.741
  381   1HG2  ILE  49          1HG2      ILE  49  -0.132  -7.454  -4.491
  382   2HG2  ILE  49          2HG2      ILE  49  -1.143  -7.725  -5.911
  383   3HG2  ILE  49          3HG2      ILE  49   0.527  -8.290  -5.897
  384   1HD1  ILE  49          1HD1      ILE  49   0.953  -9.528  -1.779
  385   2HD1  ILE  49          2HD1      ILE  49   1.475  -9.579  -3.462
  386   3HD1  ILE  49          3HD1      ILE  49   0.769 -11.014  -2.714
  387    H    LEU  50           H        LEU  50  -3.568  -9.713  -2.972
  388    HA   LEU  50           HA       LEU  50  -3.370 -12.522  -2.366
  389   1HB   LEU  50          2HB       LEU  50  -4.692 -10.193  -0.975
  390   2HB   LEU  50          1HB       LEU  50  -4.709 -11.829  -0.340
  391    HG   LEU  50           HG       LEU  50  -2.038 -10.774  -0.993
  392   1HD1  LEU  50          1HD1      LEU  50  -1.936  -9.460   1.103
  393   2HD1  LEU  50          2HD1      LEU  50  -3.690  -9.596   1.227
  394   3HD1  LEU  50          3HD1      LEU  50  -2.966  -8.745  -0.137
  395   1HD2  LEU  50          1HD2      LEU  50  -3.336 -12.565   0.953
  396   2HD2  LEU  50          2HD2      LEU  50  -1.933 -11.672   1.540
  397   3HD2  LEU  50          3HD2      LEU  50  -1.785 -12.716   0.126
  398    H    LYS  51           H        LYS  51  -5.738 -10.271  -3.596
  399    HA   LYS  51           HA       LYS  51  -8.082 -11.716  -3.245
  400   1HB   LYS  51          2HB       LYS  51  -7.638  -9.359  -4.307
  401   2HB   LYS  51          1HB       LYS  51  -7.569 -10.260  -5.815
  402   1HG   LYS  51          2HG       LYS  51  -9.827 -11.154  -5.333
  403   2HG   LYS  51          1HG       LYS  51  -9.888 -10.126  -3.900
  404   1HD   LYS  51          2HD       LYS  51 -10.737  -8.532  -5.206
  405   2HD   LYS  51          1HD       LYS  51  -9.144  -8.408  -5.955
  406   1HE   LYS  51          2HE       LYS  51 -11.261 -10.347  -6.865
  407   2HE   LYS  51          1HE       LYS  51 -11.071  -8.730  -7.540
  408   1HZ   LYS  51          1HZ       LYS  51  -8.703 -10.435  -7.445
  409   2HZ   LYS  51          2HZ       LYS  51  -9.165  -9.291  -8.602
  410   3HZ   LYS  51          3HZ       LYS  51  -9.891 -10.819  -8.588
  411    H    ALA  52           H        ALA  52  -5.385 -12.278  -5.339
  412    HA   ALA  52           HA       ALA  52  -6.765 -14.629  -6.426
  413   1HB   ALA  52          1HB       ALA  52  -5.369 -14.281  -8.515
  414   2HB   ALA  52          2HB       ALA  52  -5.036 -12.661  -7.898
  415   3HB   ALA  52          3HB       ALA  52  -6.695 -13.147  -8.257
  416    H    LEU  53           H        LEU  53  -5.272 -14.804  -4.141
  417    HA   LEU  53           HA       LEU  53  -2.605 -15.704  -4.870
  418   1HB   LEU  53          2HB       LEU  53  -3.450 -14.460  -2.670
  419   2HB   LEU  53          1HB       LEU  53  -3.685 -16.111  -2.133
  420    HG   LEU  53           HG       LEU  53  -1.085 -15.900  -3.306
  421   1HD1  LEU  53          1HD1      LEU  53  -0.358 -14.353  -1.246
  422   2HD1  LEU  53          2HD1      LEU  53  -1.914 -13.617  -1.630
  423   3HD1  LEU  53          3HD1      LEU  53  -0.663 -13.726  -2.867
  424   1HD2  LEU  53          1HD2      LEU  53  -2.104 -17.436  -1.483
  425   2HD2  LEU  53          2HD2      LEU  53  -1.631 -16.148  -0.376
  426   3HD2  LEU  53          3HD2      LEU  53  -0.412 -16.956  -1.361
  427    HA   PRO  54           HA       PRO  54  -4.778 -19.792  -3.059
  428   1HB   PRO  54          2HB       PRO  54  -7.441 -19.167  -4.249
  429   2HB   PRO  54          1HB       PRO  54  -7.049 -20.053  -2.771
  430   1HG   PRO  54          2HG       PRO  54  -7.959 -17.558  -2.646
  431   2HG   PRO  54          1HG       PRO  54  -6.682 -18.115  -1.548
  432   1HD   PRO  54          2HD       PRO  54  -6.484 -16.366  -3.957
  433   2HD   PRO  54          1HD       PRO  54  -5.567 -16.307  -2.439
  434    H    THR  55           H        THR  55  -3.464 -20.712  -4.608
  435    HA   THR  55           HA       THR  55  -4.802 -21.555  -7.044
  436    HB   THR  55           HB       THR  55  -2.045 -20.410  -7.340
  437    HG1  THR  55           1HG      THR  55  -3.292 -18.715  -6.523
  438   1HG2  THR  55          1HG2      THR  55  -4.322 -20.612  -9.293
  439   2HG2  THR  55          2HG2      THR  55  -2.987 -21.758  -9.172
  440   3HG2  THR  55          3HG2      THR  55  -2.674 -20.085  -9.633
  441    H    GLU  56           H        GLU  56  -3.960 -22.879  -4.635
  442    HA   GLU  56           HA       GLU  56  -1.810 -24.612  -5.659
  443   1HB   GLU  56          2HB       GLU  56  -1.819 -23.312  -3.298
  444   2HB   GLU  56          1HB       GLU  56  -2.616 -24.802  -2.814
  445   1HG   GLU  56          2HG       GLU  56  -0.743 -26.109  -3.549
  446   2HG   GLU  56          1HG       GLU  56   0.038 -24.680  -4.226
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1  -1.775  22.629  10.352
    2   2H    MET   1          2HT       MET   1  -0.511  23.367   9.470
    3   3H    MET   1          3HT       MET   1  -0.149  22.166  10.635
    4    HA   MET   1           HA       MET   1  -1.454  20.591   9.310
    5   1HB   MET   1          2HB       MET   1  -1.224  22.728   7.185
    6   2HB   MET   1          1HB       MET   1  -2.067  21.187   7.069
    7   1HG   MET   1          2HG       MET   1  -3.811  22.623   7.399
    8   2HG   MET   1          1HG       MET   1  -3.474  22.130   9.050
    9   1HE   MET   1          1HE       MET   1  -3.285  26.173   7.141
   10   2HE   MET   1          2HE       MET   1  -3.464  24.596   6.371
   11   3HE   MET   1          3HE       MET   1  -1.855  25.250   6.667
   12    H    GLU   2           H        GLU   2   0.712  22.842   7.593
   13    HA   GLU   2           HA       GLU   2   2.785  22.580   6.693
   14   1HB   GLU   2          2HB       GLU   2   2.819  20.964   9.145
   15   2HB   GLU   2          1HB       GLU   2   4.007  20.461   7.947
   16   1HG   GLU   2          2HG       GLU   2   3.918  23.354   8.348
   17   2HG   GLU   2          1HG       GLU   2   4.331  22.449   9.803
   18    H    ALA   3           H        ALA   3   2.414  19.162   7.527
   19    HA   ALA   3           HA       ALA   3   1.343  18.183   5.182
   20   1HB   ALA   3          1HB       ALA   3   4.209  18.878   4.949
   21   2HB   ALA   3          2HB       ALA   3   2.951  18.811   3.714
   22   3HB   ALA   3          3HB       ALA   3   3.711  17.326   4.281
   23    H    VAL   4           H        VAL   4   1.379  15.899   5.062
   24    HA   VAL   4           HA       VAL   4   3.032  14.257   6.640
   25    HB   VAL   4           HB       VAL   4   1.721  15.317   8.466
   26   1HG1  VAL   4          1HG1      VAL   4  -0.515  15.365   8.530
   27   2HG1  VAL   4          2HG1      VAL   4  -0.657  13.701   7.948
   28   3HG1  VAL   4          3HG1      VAL   4  -0.415  15.024   6.808
   29   1HG2  VAL   4          1HG2      VAL   4   2.704  12.948   8.477
   30   2HG2  VAL   4          2HG2      VAL   4   1.033  12.408   8.328
   31   3HG2  VAL   4          3HG2      VAL   4   1.532  13.361   9.717
   32    H    ASP   5           H        ASP   5   1.985  14.348   3.993
   33    HA   ASP   5           HA       ASP   5  -0.072  12.366   3.738
   34   1HB   ASP   5          2HB       ASP   5   0.500  14.303   2.116
   35   2HB   ASP   5          1HB       ASP   5   1.738  13.218   1.497
   36    H    ALA   6           H        ALA   6   3.429  12.430   3.576
   37    HA   ALA   6           HA       ALA   6   3.789   9.857   2.450
   38   1HB   ALA   6          1HB       ALA   6   5.487  11.897   3.722
   39   2HB   ALA   6          2HB       ALA   6   5.766  10.912   2.282
   40   3HB   ALA   6          3HB       ALA   6   6.065  10.238   3.882
   41    H    ASN   7           H        ASN   7   3.407  11.006   5.759
   42    HA   ASN   7           HA       ASN   7   4.158   8.632   7.074
   43   1HB   ASN   7          2HB       ASN   7   2.707  11.111   7.792
   44   2HB   ASN   7          1HB       ASN   7   2.363   9.703   8.796
   45   1HD2  ASN   7          1HD2      ASN   7   4.692   8.426   8.992
   46   2HD2  ASN   7          2HD2      ASN   7   5.890   9.426   9.739
   47    H    SER   8           H        SER   8   0.983   9.850   6.044
   48    HA   SER   8           HA       SER   8  -0.454   7.570   6.945
   49   1HB   SER   8          2HB       SER   8  -1.046  10.033   5.479
   50   2HB   SER   8          1HB       SER   8  -2.003   8.665   4.934
   51    HG   SER   8           HG       SER   8  -1.822   9.735   7.540
   52    H    LEU   9           H        LEU   9   1.199   8.427   4.005
   53    HA   LEU   9           HA       LEU   9   0.124   6.385   2.352
   54   1HB   LEU   9          2HB       LEU   9   1.264   8.486   1.579
   55   2HB   LEU   9          1HB       LEU   9   2.785   7.783   2.090
   56    HG   LEU   9           HG       LEU   9   1.000   6.544   0.005
   57   1HD1  LEU   9          1HD1      LEU   9   2.622   7.419  -1.626
   58   2HD1  LEU   9          2HD1      LEU   9   3.384   8.330  -0.327
   59   3HD1  LEU   9          3HD1      LEU   9   1.723   8.687  -0.796
   60   1HD2  LEU   9          1HD2      LEU   9   3.533   5.808   1.283
   61   2HD2  LEU   9          2HD2      LEU   9   3.516   5.680  -0.475
   62   3HD2  LEU   9          3HD2      LEU   9   2.326   4.800   0.483
   63    H    ALA  10           H        ALA  10   3.092   6.708   4.262
   64    HA   ALA  10           HA       ALA  10   4.274   4.269   3.543
   65   1HB   ALA  10          1HB       ALA  10   5.364   4.661   5.938
   66   2HB   ALA  10          2HB       ALA  10   4.670   6.262   5.690
   67   3HB   ALA  10          3HB       ALA  10   5.814   5.607   4.520
   68    H    GLN  11           H        GLN  11   1.613   4.891   5.619
   69    HA   GLN  11           HA       GLN  11   1.937   2.500   7.200
   70   1HB   GLN  11          2HB       GLN  11   0.909   4.342   8.307
   71   2HB   GLN  11          1HB       GLN  11  -0.245   4.566   6.997
   72   1HG   GLN  11          2HG       GLN  11  -1.203   2.370   7.530
   73   2HG   GLN  11          1HG       GLN  11  -0.128   2.259   8.919
   74   1HE2  GLN  11          1HE2      GLN  11  -2.441   4.537   7.475
   75   2HE2  GLN  11          2HE2      GLN  11  -3.175   5.003   8.965
   76    H    ALA  12           H        ALA  12  -0.111   3.586   4.522
   77    HA   ALA  12           HA       ALA  12  -1.839   1.442   4.342
   78   1HB   ALA  12          1HB       ALA  12  -1.470   3.617   2.858
   79   2HB   ALA  12          2HB       ALA  12  -2.374   2.217   2.274
   80   3HB   ALA  12          3HB       ALA  12  -0.685   2.437   1.805
   81    H    LYS  13           H        LYS  13   1.496   1.729   3.323
   82    HA   LYS  13           HA       LYS  13   1.538  -0.955   2.203
   83   1HB   LYS  13          2HB       LYS  13   4.114  -0.286   2.133
   84   2HB   LYS  13          1HB       LYS  13   2.969   0.267   0.929
   85   1HG   LYS  13          2HG       LYS  13   2.920   2.408   1.740
   86   2HG   LYS  13          1HG       LYS  13   3.474   1.917   3.347
   87   1HD   LYS  13          2HD       LYS  13   5.667   1.931   2.733
   88   2HD   LYS  13          1HD       LYS  13   5.313   1.395   1.088
   89   1HE   LYS  13          2HE       LYS  13   5.324   3.482   0.315
   90   2HE   LYS  13          1HE       LYS  13   4.252   4.036   1.600
   91   1HZ   LYS  13          1HZ       LYS  13   6.404   3.890   3.018
   92   2HZ   LYS  13          2HZ       LYS  13   6.145   5.231   2.020
   93   3HZ   LYS  13          3HZ       LYS  13   7.188   3.997   1.523
   94    H    GLU  14           H        GLU  14   3.222   0.813   4.817
   95    HA   GLU  14           HA       GLU  14   4.609  -1.269   5.967
   96   1HB   GLU  14          2HB       GLU  14   3.423   1.262   6.981
   97   2HB   GLU  14          1HB       GLU  14   3.833   0.056   8.194
   98   1HG   GLU  14          2HG       GLU  14   5.609   1.747   7.739
   99   2HG   GLU  14          1HG       GLU  14   6.117   0.068   7.568
  100    H    ALA  15           H        ALA  15   1.239  -0.422   6.163
  101    HA   ALA  15           HA       ALA  15   0.614  -2.536   8.056
  102   1HB   ALA  15          1HB       ALA  15  -1.480  -1.610   8.218
  103   2HB   ALA  15          2HB       ALA  15  -1.492  -1.073   6.539
  104   3HB   ALA  15          3HB       ALA  15  -0.540  -0.196   7.739
  105    H    ALA  16           H        ALA  16   0.040  -1.842   4.614
  106    HA   ALA  16           HA       ALA  16  -1.462  -4.147   4.035
  107   1HB   ALA  16          1HB       ALA  16  -1.538  -2.411   2.448
  108   2HB   ALA  16          2HB       ALA  16  -0.675  -3.730   1.656
  109   3HB   ALA  16          3HB       ALA  16   0.219  -2.354   2.302
  110    H    ILE  17           H        ILE  17   1.953  -3.673   4.451
  111    HA   ILE  17           HA       ILE  17   2.668  -6.142   3.140
  112    HB   ILE  17           HB       ILE  17   4.938  -5.692   3.822
  113   1HG1  ILE  17          2HG1      ILE  17   3.781  -3.407   5.437
  114   2HG1  ILE  17          1HG1      ILE  17   4.513  -4.868   6.093
  115   1HG2  ILE  17          1HG2      ILE  17   3.306  -3.546   2.592
  116   2HG2  ILE  17          2HG2      ILE  17   4.618  -4.506   1.911
  117   3HG2  ILE  17          3HG2      ILE  17   4.979  -3.165   2.997
  118   1HD1  ILE  17          1HD1      ILE  17   5.919  -2.744   6.040
  119   2HD1  ILE  17          2HD1      ILE  17   6.042  -3.017   4.302
  120   3HD1  ILE  17          3HD1      ILE  17   6.654  -4.226   5.431
  121    H    LYS  18           H        LYS  18   1.940  -5.032   6.361
  122    HA   LYS  18           HA       LYS  18   3.048  -7.042   7.921
  123   1HB   LYS  18          2HB       LYS  18   1.746  -4.957   8.653
  124   2HB   LYS  18          1HB       LYS  18   0.293  -5.911   8.394
  125   1HG   LYS  18          2HG       LYS  18   0.512  -6.519  10.524
  126   2HG   LYS  18          1HG       LYS  18   1.811  -7.570   9.957
  127   1HD   LYS  18          2HD       LYS  18   3.356  -5.574  10.289
  128   2HD   LYS  18          1HD       LYS  18   2.024  -4.829  11.177
  129   1HE   LYS  18          2HE       LYS  18   1.998  -7.025  12.530
  130   2HE   LYS  18          1HE       LYS  18   3.605  -7.284  11.853
  131   1HZ   LYS  18          1HZ       LYS  18   2.801  -4.868  13.379
  132   2HZ   LYS  18          2HZ       LYS  18   4.357  -5.251  12.838
  133   3HZ   LYS  18          3HZ       LYS  18   3.628  -6.186  14.043
  134    H    GLU  19           H        GLU  19   0.113  -7.010   5.992
  135    HA   GLU  19           HA       GLU  19  -0.762  -9.611   6.828
  136   1HB   GLU  19          2HB       GLU  19  -1.770  -7.475   5.197
  137   2HB   GLU  19          1HB       GLU  19  -1.848  -8.970   4.277
  138   1HG   GLU  19          2HG       GLU  19  -3.784  -9.320   5.307
  139   2HG   GLU  19          1HG       GLU  19  -2.823  -9.718   6.730
  140    H    LEU  20           H        LEU  20   1.149  -8.269   4.230
  141    HA   LEU  20           HA       LEU  20   1.313 -10.539   2.587
  142   1HB   LEU  20          2HB       LEU  20   2.141  -8.019   2.330
  143   2HB   LEU  20          1HB       LEU  20   3.657  -8.728   2.849
  144    HG   LEU  20           HG       LEU  20   2.674 -10.410   0.819
  145   1HD1  LEU  20          1HD1      LEU  20   2.566  -7.510  -0.001
  146   2HD1  LEU  20          2HD1      LEU  20   1.169  -8.572   0.170
  147   3HD1  LEU  20          3HD1      LEU  20   2.384  -8.906  -1.061
  148   1HD2  LEU  20          1HD2      LEU  20   5.026  -9.820   1.444
  149   2HD2  LEU  20          2HD2      LEU  20   4.793  -8.300   0.582
  150   3HD2  LEU  20          3HD2      LEU  20   4.693  -9.828  -0.288
  151    H    LYS  21           H        LYS  21   3.038  -9.568   5.472
  152    HA   LYS  21           HA       LYS  21   4.939 -11.746   5.262
  153   1HB   LYS  21          2HB       LYS  21   5.842 -10.914   7.365
  154   2HB   LYS  21          1HB       LYS  21   5.639  -9.590   6.227
  155   1HG   LYS  21          2HG       LYS  21   3.760  -8.757   7.371
  156   2HG   LYS  21          1HG       LYS  21   3.593 -10.229   8.328
  157   1HD   LYS  21          2HD       LYS  21   6.213  -9.062   8.670
  158   2HD   LYS  21          1HD       LYS  21   4.946  -7.893   9.044
  159   1HE   LYS  21          2HE       LYS  21   3.893  -9.715  10.465
  160   2HE   LYS  21          1HE       LYS  21   5.405 -10.600  10.271
  161   1HZ   LYS  21          1HZ       LYS  21   5.431  -7.820  11.247
  162   2HZ   LYS  21          2HZ       LYS  21   6.570  -9.047  11.492
  163   3HZ   LYS  21          3HZ       LYS  21   5.091  -9.089  12.313
  164    H    GLN  22           H        GLN  22   2.008 -10.927   7.012
  165    HA   GLN  22           HA       GLN  22   2.093 -13.141   8.805
  166   1HB   GLN  22          2HB       GLN  22   0.416 -10.893   8.365
  167   2HB   GLN  22          1HB       GLN  22  -0.606 -12.320   8.277
  168   1HG   GLN  22          2HG       GLN  22   1.075 -12.683  10.498
  169   2HG   GLN  22          1HG       GLN  22   0.499 -11.018  10.569
  170   1HE2  GLN  22          1HE2      GLN  22  -1.872 -10.743  10.267
  171   2HE2  GLN  22          2HE2      GLN  22  -2.912 -11.917  10.991
  172    H    TYR  23           H        TYR  23   0.961 -12.638   5.555
  173    HA   TYR  23           HA       TYR  23  -0.528 -15.099   5.400
  174   1HB   TYR  23          2HB       TYR  23   0.131 -12.850   3.578
  175   2HB   TYR  23          1HB       TYR  23  -0.170 -14.413   2.816
  176    HD1  TYR  23           1HD      TYR  23  -1.663 -11.446   3.800
  177    HD2  TYR  23           2HD      TYR  23  -2.344 -15.642   3.809
  178    HE1  TYR  23           1HE      TYR  23  -4.079 -11.045   3.949
  179    HE2  TYR  23           2HE      TYR  23  -4.763 -15.256   3.958
  180    HH   TYR  23           HH       TYR  23  -6.338 -13.111   3.204
  181    H    GLY  24           H        GLY  24   2.615 -13.903   4.318
  182   1HA   GLY  24          2HA       GLY  24   4.513 -15.417   4.367
  183   2HA   GLY  24          1HA       GLY  24   3.426 -16.704   3.869
  184    H    ILE  25           H        ILE  25   2.495 -14.085   2.123
  185    HA   ILE  25           HA       ILE  25   3.210 -15.043  -0.349
  186    HB   ILE  25           HB       ILE  25   3.290 -12.125  -0.378
  187   1HG1  ILE  25          2HG1      ILE  25   0.954 -13.487   0.983
  188   2HG1  ILE  25          1HG1      ILE  25   1.989 -12.232   1.656
  189   1HG2  ILE  25          1HG2      ILE  25   1.258 -14.054  -1.482
  190   2HG2  ILE  25          2HG2      ILE  25   2.779 -13.646  -2.277
  191   3HG2  ILE  25          3HG2      ILE  25   1.561 -12.400  -2.009
  192   1HD1  ILE  25          1HD1      ILE  25   1.138 -10.746  -0.216
  193   2HD1  ILE  25          2HD1      ILE  25  -0.001 -11.155   1.066
  194   3HD1  ILE  25          3HD1      ILE  25  -0.087 -11.983  -0.489
  195    H    GLY  26           H        GLY  26   4.701 -13.853  -1.994
  196   1HA   GLY  26          2HA       GLY  26   7.370 -14.170  -1.041
  197   2HA   GLY  26          1HA       GLY  26   6.893 -13.652  -2.655
  198    H    ASP  27           H        ASP  27   9.076 -12.637  -1.124
  199    HA   ASP  27           HA       ASP  27   8.452 -10.178   0.111
  200   1HB   ASP  27          2HB       ASP  27  10.922 -11.500  -0.884
  201   2HB   ASP  27          1HB       ASP  27  10.987  -9.756  -0.651
  202    H    TYR  28           H        TYR  28   8.703 -11.133  -3.180
  203    HA   TYR  28           HA       TYR  28   9.445  -8.881  -4.562
  204   1HB   TYR  28          2HB       TYR  28   8.434 -11.250  -5.316
  205   2HB   TYR  28          1HB       TYR  28   6.984 -10.267  -5.507
  206    HD1  TYR  28           1HD      TYR  28  10.599  -9.637  -6.187
  207    HD2  TYR  28           2HD      TYR  28   6.635  -9.752  -7.716
  208    HE1  TYR  28           1HE      TYR  28  11.414  -8.800  -8.340
  209    HE2  TYR  28           2HE      TYR  28   7.438  -8.919  -9.882
  210    HH   TYR  28           HH       TYR  28   9.302  -7.712 -10.816
  211    H    TYR  29           H        TYR  29   6.283  -9.653  -3.248
  212    HA   TYR  29           HA       TYR  29   5.000  -7.315  -4.197
  213   1HB   TYR  29          2HB       TYR  29   4.053  -9.126  -1.980
  214   2HB   TYR  29          1HB       TYR  29   3.071  -8.141  -3.062
  215    HD1  TYR  29           1HD      TYR  29   3.019 -11.241  -2.574
  216    HD2  TYR  29           2HD      TYR  29   4.745  -8.755  -5.579
  217    HE1  TYR  29           1HE      TYR  29   2.925 -13.114  -4.167
  218    HE2  TYR  29           2HE      TYR  29   4.659 -10.631  -7.173
  219    HH   TYR  29           HH       TYR  29   4.606 -13.185  -7.025
  220    H    ILE  30           H        ILE  30   6.075  -8.194  -0.876
  221    HA   ILE  30           HA       ILE  30   5.223  -5.854   0.374
  222    HB   ILE  30           HB       ILE  30   6.145  -7.666   1.664
  223   1HG1  ILE  30          2HG1      ILE  30   6.342  -5.277   2.500
  224   2HG1  ILE  30          1HG1      ILE  30   7.403  -6.452   3.266
  225   1HG2  ILE  30          1HG2      ILE  30   7.761  -8.496   0.128
  226   2HG2  ILE  30          2HG2      ILE  30   8.564  -8.143   1.659
  227   3HG2  ILE  30          3HG2      ILE  30   8.738  -7.039   0.292
  228   1HD1  ILE  30          1HD1      ILE  30   8.848  -5.410   1.115
  229   2HD1  ILE  30          2HD1      ILE  30   9.092  -5.100   2.834
  230   3HD1  ILE  30          3HD1      ILE  30   8.054  -4.039   1.884
  231    H    LYS  31           H        LYS  31   7.803  -6.447  -1.840
  232    HA   LYS  31           HA       LYS  31   9.069  -3.872  -1.470
  233   1HB   LYS  31          2HB       LYS  31   9.533  -6.118  -3.425
  234   2HB   LYS  31          1HB       LYS  31  10.490  -4.644  -3.385
  235   1HG   LYS  31          2HG       LYS  31  10.219  -6.464  -1.010
  236   2HG   LYS  31          1HG       LYS  31  11.479  -6.661  -2.230
  237   1HD   LYS  31          2HD       LYS  31  12.708  -5.183  -1.106
  238   2HD   LYS  31          1HD       LYS  31  11.521  -3.947  -1.530
  239   1HE   LYS  31          2HE       LYS  31  10.377  -4.189   0.496
  240   2HE   LYS  31          1HE       LYS  31  11.122  -5.750   0.834
  241   1HZ   LYS  31          1HZ       LYS  31  12.129  -3.072   1.318
  242   2HZ   LYS  31          2HZ       LYS  31  13.269  -4.177   0.735
  243   3HZ   LYS  31          3HZ       LYS  31  12.423  -4.511   2.161
  244    H    LEU  32           H        LEU  32   7.298  -5.560  -4.069
  245    HA   LEU  32           HA       LEU  32   7.277  -3.507  -5.914
  246   1HB   LEU  32          2HB       LEU  32   6.064  -4.949  -7.135
  247   2HB   LEU  32          1HB       LEU  32   6.251  -6.042  -5.787
  248    HG   LEU  32           HG       LEU  32   3.979  -6.099  -6.352
  249   1HD1  LEU  32          1HD1      LEU  32   4.911  -5.081  -3.917
  250   2HD1  LEU  32          2HD1      LEU  32   3.454  -6.041  -4.211
  251   3HD1  LEU  32          3HD1      LEU  32   3.378  -4.276  -4.260
  252   1HD2  LEU  32          1HD2      LEU  32   3.377  -3.252  -5.987
  253   2HD2  LEU  32          2HD2      LEU  32   2.766  -4.395  -7.181
  254   3HD2  LEU  32          3HD2      LEU  32   4.332  -3.621  -7.422
  255    H    ILE  33           H        ILE  33   5.731  -3.672  -2.905
  256    HA   ILE  33           HA       ILE  33   3.604  -1.813  -3.423
  257    HB   ILE  33           HB       ILE  33   4.738  -3.151  -0.988
  258   1HG1  ILE  33          2HG1      ILE  33   2.096  -3.117  -2.426
  259   2HG1  ILE  33          1HG1      ILE  33   3.186  -4.476  -2.174
  260   1HG2  ILE  33          1HG2      ILE  33   2.440  -1.619  -0.257
  261   2HG2  ILE  33          2HG2      ILE  33   3.676  -0.542  -0.897
  262   3HG2  ILE  33          3HG2      ILE  33   4.053  -1.612   0.449
  263   1HD1  ILE  33          1HD1      ILE  33   2.319  -3.423   0.352
  264   2HD1  ILE  33          2HD1      ILE  33   2.125  -5.040  -0.322
  265   3HD1  ILE  33          3HD1      ILE  33   0.937  -3.787  -0.679
  266    H    ASN  34           H        ASN  34   6.586  -1.689  -1.470
  267    HA   ASN  34           HA       ASN  34   6.538   0.984  -0.795
  268   1HB   ASN  34          2HB       ASN  34   8.130  -0.680   0.111
  269   2HB   ASN  34          1HB       ASN  34   8.994  -0.667  -1.423
  270   1HD2  ASN  34          1HD2      ASN  34  10.900   0.134  -0.723
  271   2HD2  ASN  34          2HD2      ASN  34  11.102   1.714  -0.055
  272    H    ASN  35           H        ASN  35   7.201  -0.426  -3.884
  273    HA   ASN  35           HA       ASN  35   8.702   1.717  -4.986
  274   1HB   ASN  35          2HB       ASN  35   8.191  -0.802  -5.795
  275   2HB   ASN  35          1HB       ASN  35   7.038   0.071  -6.802
  276   1HD2  ASN  35          1HD2      ASN  35   8.259   2.316  -7.488
  277   2HD2  ASN  35          2HD2      ASN  35   9.722   2.005  -8.354
  278    H    ALA  36           H        ALA  36   5.284   1.145  -4.580
  279    HA   ALA  36           HA       ALA  36   4.214   2.809  -6.522
  280   1HB   ALA  36          1HB       ALA  36   2.441   1.869  -5.565
  281   2HB   ALA  36          2HB       ALA  36   2.525   3.171  -4.377
  282   3HB   ALA  36          3HB       ALA  36   3.294   1.618  -4.043
  283    H    LYS  37           H        LYS  37   3.436   4.951  -6.482
  284    HA   LYS  37           HA       LYS  37   5.110   6.746  -4.887
  285   1HB   LYS  37          2HB       LYS  37   3.886   6.839  -7.560
  286   2HB   LYS  37          1HB       LYS  37   3.766   8.341  -6.658
  287   1HG   LYS  37          2HG       LYS  37   5.802   8.792  -7.431
  288   2HG   LYS  37          1HG       LYS  37   6.385   7.590  -6.276
  289   1HD   LYS  37          2HD       LYS  37   5.460   6.806  -9.018
  290   2HD   LYS  37          1HD       LYS  37   7.109   7.362  -8.733
  291   1HE   LYS  37          2HE       LYS  37   6.008   5.235  -6.970
  292   2HE   LYS  37          1HE       LYS  37   6.470   4.802  -8.615
  293   1HZ   LYS  37          1HZ       LYS  37   8.613   6.160  -7.888
  294   2HZ   LYS  37          2HZ       LYS  37   8.456   4.500  -7.612
  295   3HZ   LYS  37          3HZ       LYS  37   8.137   5.592  -6.365
  296    H    THR  38           H        THR  38   1.766   5.973  -5.601
  297    HA   THR  38           HA       THR  38   0.795   8.063  -3.814
  298    HB   THR  38           HB       THR  38  -1.383   7.579  -4.652
  299    HG1  THR  38           1HG      THR  38  -1.777   5.529  -4.859
  300   1HG2  THR  38          1HG2      THR  38  -0.355   8.779  -6.347
  301   2HG2  THR  38          2HG2      THR  38  -1.032   7.378  -7.177
  302   3HG2  THR  38          3HG2      THR  38   0.691   7.433  -6.800
  303    H    VAL  39           H        VAL  39  -1.577   6.418  -3.043
  304    HA   VAL  39           HA       VAL  39  -0.291   4.429  -1.336
  305    HB   VAL  39           HB       VAL  39  -0.703   6.732  -0.187
  306   1HG1  VAL  39          1HG1      VAL  39  -3.086   6.860  -0.784
  307   2HG1  VAL  39          2HG1      VAL  39  -2.810   6.878   0.960
  308   3HG1  VAL  39          3HG1      VAL  39  -3.375   5.405   0.171
  309   1HG2  VAL  39          1HG2      VAL  39   0.221   5.079   1.100
  310   2HG2  VAL  39          2HG2      VAL  39  -1.097   3.959   0.778
  311   3HG2  VAL  39          3HG2      VAL  39  -1.337   5.293   1.903
  312    H    GLU  40           H        GLU  40  -3.378   5.742  -2.488
  313    HA   GLU  40           HA       GLU  40  -5.107   3.799  -1.609
  314   1HB   GLU  40          2HB       GLU  40  -5.347   5.935  -3.251
  315   2HB   GLU  40          1HB       GLU  40  -5.513   4.630  -4.418
  316   1HG   GLU  40          2HG       GLU  40  -7.249   3.680  -2.766
  317   2HG   GLU  40          1HG       GLU  40  -7.252   5.305  -2.083
  318    H    GLY  41           H        GLY  41  -2.865   3.629  -4.311
  319   1HA   GLY  41          2HA       GLY  41  -3.859   1.040  -5.157
  320   2HA   GLY  41          1HA       GLY  41  -2.484   1.905  -5.832
  321    H    VAL  42           H        VAL  42  -1.317   2.302  -3.141
  322    HA   VAL  42           HA       VAL  42   0.414   0.117  -3.077
  323    HB   VAL  42           HB       VAL  42  -0.200   1.990  -0.794
  324   1HG1  VAL  42          1HG1      VAL  42   2.328   1.393  -0.425
  325   2HG1  VAL  42          2HG1      VAL  42   1.889  -0.051  -1.342
  326   3HG1  VAL  42          3HG1      VAL  42   1.046   0.326   0.166
  327   1HG2  VAL  42          1HG2      VAL  42   0.557   2.908  -3.139
  328   2HG2  VAL  42          2HG2      VAL  42   2.132   2.307  -2.620
  329   3HG2  VAL  42          3HG2      VAL  42   1.291   3.515  -1.655
  330    H    GLU  43           H        GLU  43  -2.291   0.883  -0.893
  331    HA   GLU  43           HA       GLU  43  -2.021  -1.495   0.640
  332   1HB   GLU  43          2HB       GLU  43  -4.533  -0.871   1.193
  333   2HB   GLU  43          1HB       GLU  43  -3.195   0.076   1.830
  334   1HG   GLU  43          2HG       GLU  43  -3.524   1.792   0.259
  335   2HG   GLU  43          1HG       GLU  43  -4.596   0.793  -0.724
  336    H    SER  44           H        SER  44  -4.284  -0.564  -1.935
  337    HA   SER  44           HA       SER  44  -5.634  -3.039  -2.030
  338   1HB   SER  44          2HB       SER  44  -6.833  -2.121  -3.761
  339   2HB   SER  44          1HB       SER  44  -6.154  -0.641  -3.082
  340    HG   SER  44           HG       SER  44  -5.523  -0.418  -5.099
  341    H    LEU  45           H        LEU  45  -2.602  -1.965  -3.241
  342    HA   LEU  45           HA       LEU  45  -2.191  -3.649  -5.423
  343   1HB   LEU  45          2HB       LEU  45  -0.541  -2.094  -3.577
  344   2HB   LEU  45          1HB       LEU  45   0.281  -3.502  -4.208
  345   1HD1  LEU  45          1HD1      LEU  45   1.193  -3.636  -5.985
  346   2HD1  LEU  45          2HD1      LEU  45   1.893  -2.040  -6.262
  347   3HD1  LEU  45          3HD1      LEU  45   0.789  -2.738  -7.448
  348   1HD2  LEU  45          1HD2      LEU  45  -1.230  -0.954  -7.202
  349   2HD2  LEU  45          2HD2      LEU  45  -2.264  -1.776  -6.035
  350   3HD2  LEU  45          3HD2      LEU  45  -1.415  -2.706  -7.271
  351    H    LYS  46           H        LYS  46  -1.098  -4.222  -2.063
  352    HA   LYS  46           HA       LYS  46  -0.393  -6.920  -2.591
  353   1HB   LYS  46          2HB       LYS  46   0.762  -6.348  -0.750
  354   2HB   LYS  46          1HB       LYS  46  -0.395  -5.118  -0.268
  355   1HG   LYS  46          2HG       LYS  46  -1.040  -8.016   0.134
  356   2HG   LYS  46          1HG       LYS  46   0.052  -7.184   1.248
  357   1HD   LYS  46          2HD       LYS  46  -1.730  -5.430   1.530
  358   2HD   LYS  46          1HD       LYS  46  -2.814  -6.485   0.628
  359   1HE   LYS  46          2HE       LYS  46  -2.890  -8.067   2.298
  360   2HE   LYS  46          1HE       LYS  46  -1.346  -7.563   2.988
  361   1HZ   LYS  46          1HZ       LYS  46  -3.629  -6.960   4.115
  362   2HZ   LYS  46          2HZ       LYS  46  -3.557  -5.650   3.047
  363   3HZ   LYS  46          3HZ       LYS  46  -2.314  -5.898   4.166
  364    H    ASN  47           H        ASN  47  -3.225  -5.445  -1.006
  365    HA   ASN  47           HA       ASN  47  -4.511  -7.847  -0.343
  366   1HB   ASN  47          2HB       ASN  47  -5.244  -5.021  -0.509
  367   2HB   ASN  47          1HB       ASN  47  -6.584  -6.086  -0.924
  368   1HD2  ASN  47          1HD2      ASN  47  -6.926  -7.921   0.624
  369   2HD2  ASN  47          2HD2      ASN  47  -6.770  -7.565   2.307
  370    H    GLU  48           H        GLU  48  -4.199  -6.172  -3.366
  371    HA   GLU  48           HA       GLU  48  -6.294  -7.641  -4.693
  372   1HB   GLU  48          2HB       GLU  48  -5.686  -5.411  -5.492
  373   2HB   GLU  48          1HB       GLU  48  -4.042  -5.950  -5.806
  374   1HG   GLU  48          2HG       GLU  48  -4.585  -6.806  -7.786
  375   2HG   GLU  48          1HG       GLU  48  -6.036  -7.579  -7.152
  376    H    ILE  49           H        ILE  49  -2.803  -7.824  -4.372
  377    HA   ILE  49           HA       ILE  49  -2.359  -9.900  -6.238
  378    HB   ILE  49           HB       ILE  49  -0.204 -10.186  -5.258
  379   1HG1  ILE  49          2HG1      ILE  49  -0.634  -8.435  -2.922
  380   2HG1  ILE  49          1HG1      ILE  49  -1.357 -10.026  -2.815
  381   1HG2  ILE  49          1HG2      ILE  49  -0.137  -7.404  -4.597
  382   2HG2  ILE  49          2HG2      ILE  49  -1.189  -7.673  -5.986
  383   3HG2  ILE  49          3HG2      ILE  49   0.483  -8.232  -6.026
  384   1HD1  ILE  49          1HD1      ILE  49   1.528  -9.475  -3.394
  385   2HD1  ILE  49          2HD1      ILE  49   0.782 -11.051  -3.126
  386   3HD1  ILE  49          3HD1      ILE  49   0.862  -9.873  -1.812
  387    H    LEU  50           H        LEU  50  -3.519  -9.800  -2.994
  388    HA   LEU  50           HA       LEU  50  -3.221 -12.612  -2.477
  389   1HB   LEU  50          2HB       LEU  50  -4.633 -10.367  -1.040
  390   2HB   LEU  50          1HB       LEU  50  -4.624 -12.019  -0.449
  391    HG   LEU  50           HG       LEU  50  -1.967 -10.889  -1.040
  392   1HD1  LEU  50          1HD1      LEU  50  -1.948  -9.677   1.151
  393   2HD1  LEU  50          2HD1      LEU  50  -3.708  -9.793   1.152
  394   3HD1  LEU  50          3HD1      LEU  50  -2.883  -8.904  -0.128
  395   1HD2  LEU  50          1HD2      LEU  50  -1.820 -11.868   1.436
  396   2HD2  LEU  50          2HD2      LEU  50  -1.730 -12.889   0.001
  397   3HD2  LEU  50          3HD2      LEU  50  -3.251 -12.737   0.882
  398    H    LYS  51           H        LYS  51  -5.698 -10.444  -3.664
  399    HA   LYS  51           HA       LYS  51  -7.930 -12.123  -3.388
  400   1HB   LYS  51          2HB       LYS  51  -7.257  -9.687  -4.830
  401   2HB   LYS  51          1HB       LYS  51  -8.323 -10.722  -5.771
  402   1HG   LYS  51          2HG       LYS  51  -9.579  -9.114  -4.446
  403   2HG   LYS  51          1HG       LYS  51  -9.922 -10.770  -3.939
  404   1HD   LYS  51          2HD       LYS  51  -7.846 -10.137  -2.305
  405   2HD   LYS  51          1HD       LYS  51  -8.636  -8.568  -2.475
  406   1HE   LYS  51          2HE       LYS  51  -9.958 -11.138  -1.608
  407   2HE   LYS  51          1HE       LYS  51  -9.503  -9.803  -0.551
  408   1HZ   LYS  51          1HZ       LYS  51 -11.922 -10.075  -1.612
  409   2HZ   LYS  51          2HZ       LYS  51 -11.202  -9.116  -2.805
  410   3HZ   LYS  51          3HZ       LYS  51 -11.255  -8.575  -1.203
  411    H    ALA  52           H        ALA  52  -5.205 -12.237  -5.485
  412    HA   ALA  52           HA       ALA  52  -6.259 -14.656  -6.729
  413   1HB   ALA  52          1HB       ALA  52  -6.771 -12.945  -8.350
  414   2HB   ALA  52          2HB       ALA  52  -5.438 -13.933  -8.952
  415   3HB   ALA  52          3HB       ALA  52  -5.117 -12.334  -8.276
  416    H    LEU  53           H        LEU  53  -4.597 -15.010  -4.801
  417    HA   LEU  53           HA       LEU  53  -1.858 -14.677  -5.208
  418   1HB   LEU  53          2HB       LEU  53  -3.580 -16.288  -3.468
  419   2HB   LEU  53          1HB       LEU  53  -2.017 -17.018  -3.783
  420    HG   LEU  53           HG       LEU  53  -1.979 -14.165  -3.001
  421   1HD1  LEU  53          1HD1      LEU  53  -3.494 -14.613  -1.351
  422   2HD1  LEU  53          2HD1      LEU  53  -2.009 -15.121  -0.547
  423   3HD1  LEU  53          3HD1      LEU  53  -3.073 -16.323  -1.274
  424   1HD2  LEU  53          1HD2      LEU  53  -0.299 -16.582  -2.790
  425   2HD2  LEU  53          2HD2      LEU  53  -0.188 -15.433  -1.456
  426   3HD2  LEU  53          3HD2      LEU  53   0.153 -14.906  -3.105
  427    HA   PRO  54           HA       PRO  54  -1.529 -17.620  -8.626
  428   1HB   PRO  54          2HB       PRO  54   0.971 -16.931  -9.375
  429   2HB   PRO  54          1HB       PRO  54  -0.441 -15.947  -9.782
  430   1HG   PRO  54          2HG       PRO  54   1.559 -15.573  -7.586
  431   2HG   PRO  54          1HG       PRO  54   0.859 -14.365  -8.678
  432   1HD   PRO  54          2HD       PRO  54  -0.015 -14.742  -6.131
  433   2HD   PRO  54          1HD       PRO  54  -1.071 -14.182  -7.443
  434    H    THR  55           H        THR  55   0.276 -19.215  -9.250
  435    HA   THR  55           HA       THR  55   1.488 -21.062  -8.706
  436    HB   THR  55           HB       THR  55   2.524 -19.551  -6.317
  437    HG1  THR  55           1HG      THR  55   3.979 -18.544  -7.708
  438   1HG2  THR  55          1HG2      THR  55   3.311 -21.867  -6.659
  439   2HG2  THR  55          2HG2      THR  55   4.596 -20.662  -6.761
  440   3HG2  THR  55          3HG2      THR  55   3.943 -21.382  -8.232
  441    H    GLU  56           H        GLU  56  -0.316 -22.329  -8.179
  442    HA   GLU  56           HA       GLU  56  -1.325 -22.377  -5.478
  443   1HB   GLU  56          2HB       GLU  56  -1.898 -24.070  -7.909
  444   2HB   GLU  56          1HB       GLU  56  -2.667 -24.336  -6.350
  445   1HG   GLU  56          2HG       GLU  56  -2.787 -21.670  -7.707
  446   2HG   GLU  56          1HG       GLU  56  -3.916 -22.962  -8.112
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1   1.034  18.072  10.796
    2   2H    MET   1          2HT       MET   1   0.555  17.750  12.410
    3   3H    MET   1          3HT       MET   1   0.182  19.259  11.686
    4    HA   MET   1           HA       MET   1  -0.793  16.690  10.655
    5   1HB   MET   1          2HB       MET   1  -2.937  17.402  11.809
    6   2HB   MET   1          1HB       MET   1  -1.655  16.824  12.863
    7   1HG   MET   1          2HG       MET   1  -1.820  19.735  12.343
    8   2HG   MET   1          1HG       MET   1  -3.039  19.006  13.395
    9   1HE   MET   1          1HE       MET   1  -2.827  19.335  15.677
   10   2HE   MET   1          2HE       MET   1  -1.448  18.890  16.683
   11   3HE   MET   1          3HE       MET   1  -2.309  17.654  15.763
   12    H    GLU   2           H        GLU   2  -3.130  17.342   9.757
   13    HA   GLU   2           HA       GLU   2  -4.311  18.398   8.127
   14   1HB   GLU   2          2HB       GLU   2  -2.679  20.855   8.743
   15   2HB   GLU   2          1HB       GLU   2  -4.275  20.787   8.012
   16   1HG   GLU   2          2HG       GLU   2  -4.517  19.470  10.462
   17   2HG   GLU   2          1HG       GLU   2  -3.542  20.909  10.782
   18    H    ALA   3           H        ALA   3  -1.406  17.349   7.750
   19    HA   ALA   3           HA       ALA   3  -1.273  17.398   5.015
   20   1HB   ALA   3          1HB       ALA   3  -0.936  19.682   4.810
   21   2HB   ALA   3          2HB       ALA   3   0.706  19.040   4.754
   22   3HB   ALA   3          3HB       ALA   3   0.093  19.764   6.242
   23    H    VAL   4           H        VAL   4  -0.723  15.286   6.004
   24    HA   VAL   4           HA       VAL   4   2.166  14.964   6.042
   25    HB   VAL   4           HB       VAL   4   0.561  13.711   8.259
   26   1HG1  VAL   4          1HG1      VAL   4   2.550  12.950   9.084
   27   2HG1  VAL   4          2HG1      VAL   4   3.478  14.281   8.393
   28   3HG1  VAL   4          3HG1      VAL   4   2.928  12.959   7.361
   29   1HG2  VAL   4          1HG2      VAL   4   2.145  16.280   8.356
   30   2HG2  VAL   4          2HG2      VAL   4   1.487  15.431   9.758
   31   3HG2  VAL   4          3HG2      VAL   4   0.399  16.121   8.554
   32    H    ASP   5           H        ASP   5   0.241  14.269   4.118
   33    HA   ASP   5           HA       ASP   5  -0.792  11.709   4.210
   34   1HB   ASP   5          2HB       ASP   5  -0.957  13.538   2.368
   35   2HB   ASP   5          1HB       ASP   5   0.472  12.761   1.695
   36    H    ALA   6           H        ALA   6   2.511  12.732   3.817
   37    HA   ALA   6           HA       ALA   6   3.616  10.413   2.695
   38   1HB   ALA   6          1HB       ALA   6   5.204  12.005   2.691
   39   2HB   ALA   6          2HB       ALA   6   5.643  11.303   4.246
   40   3HB   ALA   6          3HB       ALA   6   4.628  12.743   4.188
   41    H    ASN   7           H        ASN   7   2.755  11.201   6.011
   42    HA   ASN   7           HA       ASN   7   4.043   8.923   7.166
   43   1HB   ASN   7          2HB       ASN   7   2.300  11.120   8.108
   44   2HB   ASN   7          1HB       ASN   7   2.188   9.613   9.021
   45   1HD2  ASN   7          1HD2      ASN   7   3.614   9.303  10.572
   46   2HD2  ASN   7          2HD2      ASN   7   5.108  10.155  10.758
   47    H    SER   8           H        SER   8   0.682   9.728   6.343
   48    HA   SER   8           HA       SER   8  -0.411   7.253   7.169
   49   1HB   SER   8          2HB       SER   8  -1.591   9.521   6.617
   50   2HB   SER   8          1HB       SER   8  -1.639   8.892   4.974
   51    HG   SER   8           HG       SER   8  -3.496   8.216   5.920
   52    H    LEU   9           H        LEU   9   1.065   8.371   4.220
   53    HA   LEU   9           HA       LEU   9   0.221   6.335   2.480
   54   1HB   LEU   9          2HB       LEU   9   1.332   8.509   1.868
   55   2HB   LEU   9          1HB       LEU   9   2.849   7.807   2.391
   56    HG   LEU   9           HG       LEU   9   1.153   6.658   0.184
   57   1HD1  LEU   9          1HD1      LEU   9   3.429   8.601   0.111
   58   2HD1  LEU   9          2HD1      LEU   9   1.825   8.751  -0.613
   59   3HD1  LEU   9          3HD1      LEU   9   2.988   7.604  -1.274
   60   1HD2  LEU   9          1HD2      LEU   9   3.678   5.828  -0.259
   61   2HD2  LEU   9          2HD2      LEU   9   2.478   4.902   0.643
   62   3HD2  LEU   9          3HD2      LEU   9   3.661   5.889   1.504
   63    H    ALA  10           H        ALA  10   3.089   6.665   4.536
   64    HA   ALA  10           HA       ALA  10   4.338   4.259   3.766
   65   1HB   ALA  10          1HB       ALA  10   5.783   4.587   5.659
   66   2HB   ALA  10          2HB       ALA  10   4.641   5.721   6.382
   67   3HB   ALA  10          3HB       ALA  10   5.478   6.143   4.888
   68    H    GLN  11           H        GLN  11   1.651   4.846   5.818
   69    HA   GLN  11           HA       GLN  11   1.944   2.460   7.391
   70   1HB   GLN  11          2HB       GLN  11   0.835   4.279   8.448
   71   2HB   GLN  11          1HB       GLN  11  -0.267   4.481   7.091
   72   1HG   GLN  11          2HG       GLN  11  -1.212   2.275   7.586
   73   2HG   GLN  11          1HG       GLN  11  -0.184   2.169   9.009
   74   1HE2  GLN  11          1HE2      GLN  11  -1.607   2.266  10.635
   75   2HE2  GLN  11          2HE2      GLN  11  -2.734   3.545  10.885
   76    H    ALA  12           H        ALA  12   0.012   3.487   4.612
   77    HA   ALA  12           HA       ALA  12  -1.666   1.297   4.378
   78   1HB   ALA  12          1HB       ALA  12  -2.182   2.108   2.327
   79   2HB   ALA  12          2HB       ALA  12  -0.489   2.315   1.869
   80   3HB   ALA  12          3HB       ALA  12  -1.275   3.504   2.914
   81    H    LYS  13           H        LYS  13   1.680   1.704   3.423
   82    HA   LYS  13           HA       LYS  13   1.837  -0.980   2.320
   83   1HB   LYS  13          2HB       LYS  13   4.385  -0.215   2.272
   84   2HB   LYS  13          1HB       LYS  13   3.231   0.285   1.051
   85   1HG   LYS  13          2HG       LYS  13   3.078   2.427   1.860
   86   2HG   LYS  13          1HG       LYS  13   3.654   1.965   3.470
   87   1HD   LYS  13          2HD       LYS  13   5.852   2.023   2.839
   88   2HD   LYS  13          1HD       LYS  13   5.495   1.553   1.176
   89   1HE   LYS  13          2HE       LYS  13   5.425   3.674   0.499
   90   2HE   LYS  13          1HE       LYS  13   4.365   4.135   1.827
   91   1HZ   LYS  13          1HZ       LYS  13   6.879   4.989   1.556
   92   2HZ   LYS  13          2HZ       LYS  13   7.124   3.653   2.563
   93   3HZ   LYS  13          3HZ       LYS  13   6.076   4.890   3.042
   94    H    GLU  14           H        GLU  14   3.376   0.865   4.964
   95    HA   GLU  14           HA       GLU  14   4.843  -1.164   6.131
   96   1HB   GLU  14          2HB       GLU  14   3.443   1.249   7.245
   97   2HB   GLU  14          1HB       GLU  14   4.194   0.098   8.343
   98   1HG   GLU  14          2HG       GLU  14   5.940   0.880   6.152
   99   2HG   GLU  14          1HG       GLU  14   5.426   2.238   7.150
  100    H    ALA  15           H        ALA  15   1.443  -0.425   6.293
  101    HA   ALA  15           HA       ALA  15   0.873  -2.543   8.194
  102   1HB   ALA  15          1HB       ALA  15  -1.311  -1.755   8.241
  103   2HB   ALA  15          2HB       ALA  15  -1.219  -1.107   6.604
  104   3HB   ALA  15          3HB       ALA  15  -0.380  -0.292   7.923
  105    H    ALA  16           H        ALA  16   0.646  -1.982   4.728
  106    HA   ALA  16           HA       ALA  16  -0.853  -4.321   4.124
  107   1HB   ALA  16          1HB       ALA  16   0.053  -3.916   1.778
  108   2HB   ALA  16          2HB       ALA  16   0.840  -2.489   2.449
  109   3HB   ALA  16          3HB       ALA  16  -0.916  -2.629   2.495
  110    H    ILE  17           H        ILE  17   2.516  -3.703   4.703
  111    HA   ILE  17           HA       ILE  17   3.464  -6.106   3.457
  112    HB   ILE  17           HB       ILE  17   4.973  -4.209   3.704
  113   1HG1  ILE  17          2HG1      ILE  17   6.008  -6.377   5.521
  114   2HG1  ILE  17          1HG1      ILE  17   5.764  -6.652   3.798
  115   1HG2  ILE  17          1HG2      ILE  17   4.373  -4.553   6.610
  116   2HG2  ILE  17          2HG2      ILE  17   4.386  -3.087   5.633
  117   3HG2  ILE  17          3HG2      ILE  17   5.906  -3.851   6.093
  118   1HD1  ILE  17          1HD1      ILE  17   7.266  -4.663   3.405
  119   2HD1  ILE  17          2HD1      ILE  17   8.033  -6.107   4.066
  120   3HD1  ILE  17          3HD1      ILE  17   7.662  -4.744   5.122
  121    H    LYS  18           H        LYS  18   2.409  -5.135   6.649
  122    HA   LYS  18           HA       LYS  18   3.345  -7.313   8.139
  123   1HB   LYS  18          2HB       LYS  18   1.632  -5.093   8.550
  124   2HB   LYS  18          1HB       LYS  18   0.740  -6.521   9.057
  125   1HG   LYS  18          2HG       LYS  18   3.452  -5.662  10.046
  126   2HG   LYS  18          1HG       LYS  18   1.927  -5.567  10.929
  127   1HD   LYS  18          2HD       LYS  18   2.528  -8.238   9.900
  128   2HD   LYS  18          1HD       LYS  18   3.716  -7.639  11.059
  129   1HE   LYS  18          2HE       LYS  18   1.887  -7.143  12.635
  130   2HE   LYS  18          1HE       LYS  18   0.735  -7.816  11.483
  131   1HZ   LYS  18          1HZ       LYS  18   1.327  -9.912  11.983
  132   2HZ   LYS  18          2HZ       LYS  18   1.863  -9.227  13.434
  133   3HZ   LYS  18          3HZ       LYS  18   2.964  -9.536  12.188
  134    H    GLU  19           H        GLU  19   0.552  -6.927   6.058
  135    HA   GLU  19           HA       GLU  19  -0.656  -9.424   6.763
  136   1HB   GLU  19          2HB       GLU  19  -1.213  -7.212   4.937
  137   2HB   GLU  19          1HB       GLU  19  -1.594  -8.777   4.231
  138   1HG   GLU  19          2HG       GLU  19  -3.574  -8.097   5.243
  139   2HG   GLU  19          1HG       GLU  19  -2.875  -9.246   6.383
  140    H    LEU  20           H        LEU  20   1.509  -8.291   4.221
  141    HA   LEU  20           HA       LEU  20   1.517 -10.628   2.666
  142   1HB   LEU  20          2HB       LEU  20   2.961  -8.161   2.754
  143   2HB   LEU  20          1HB       LEU  20   4.104  -9.481   2.576
  144    HG   LEU  20           HG       LEU  20   2.020 -10.028   0.779
  145   1HD1  LEU  20          1HD1      LEU  20   1.856  -7.363   1.286
  146   2HD1  LEU  20          2HD1      LEU  20   1.336  -8.149  -0.205
  147   3HD1  LEU  20          3HD1      LEU  20   2.933  -7.405  -0.109
  148   1HD2  LEU  20          1HD2      LEU  20   3.722 -10.308  -0.664
  149   2HD2  LEU  20          2HD2      LEU  20   4.706 -10.139   0.788
  150   3HD2  LEU  20          3HD2      LEU  20   4.452  -8.751  -0.271
  151    H    LYS  21           H        LYS  21   3.185  -9.721   5.592
  152    HA   LYS  21           HA       LYS  21   4.948 -12.007   5.561
  153   1HB   LYS  21          2HB       LYS  21   5.619  -9.850   6.589
  154   2HB   LYS  21          1HB       LYS  21   4.353 -10.052   7.792
  155   1HG   LYS  21          2HG       LYS  21   5.899 -12.413   7.811
  156   2HG   LYS  21          1HG       LYS  21   7.020 -11.053   7.803
  157   1HD   LYS  21          2HD       LYS  21   6.681 -11.058  10.027
  158   2HD   LYS  21          1HD       LYS  21   5.188 -10.210   9.621
  159   1HE   LYS  21          2HE       LYS  21   4.625 -11.989  11.104
  160   2HE   LYS  21          1HE       LYS  21   4.056 -12.436   9.496
  161   1HZ   LYS  21          1HZ       LYS  21   6.492 -13.511   9.487
  162   2HZ   LYS  21          2HZ       LYS  21   5.106 -14.348   9.978
  163   3HZ   LYS  21          3HZ       LYS  21   6.123 -13.646  11.133
  164    H    GLN  22           H        GLN  22   1.955 -11.013   7.130
  165    HA   GLN  22           HA       GLN  22   1.785 -13.286   8.851
  166   1HB   GLN  22          2HB       GLN  22   0.614 -11.066   9.190
  167   2HB   GLN  22          1HB       GLN  22  -0.497 -11.545   7.915
  168   1HG   GLN  22          2HG       GLN  22  -0.149 -13.508  10.070
  169   2HG   GLN  22          1HG       GLN  22  -0.903 -11.987  10.545
  170   1HE2  GLN  22          1HE2      GLN  22  -2.843 -11.353   9.500
  171   2HE2  GLN  22          2HE2      GLN  22  -3.878 -12.526   8.767
  172    H    TYR  23           H        TYR  23   0.822 -12.562   5.589
  173    HA   TYR  23           HA       TYR  23  -0.888 -14.864   5.305
  174   1HB   TYR  23          2HB       TYR  23   0.063 -12.657   3.541
  175   2HB   TYR  23          1HB       TYR  23  -0.477 -14.148   2.768
  176    HD1  TYR  23           1HD      TYR  23  -2.790 -15.055   3.854
  177    HD2  TYR  23           2HD      TYR  23  -1.506 -11.004   3.737
  178    HE1  TYR  23           1HE      TYR  23  -5.124 -14.316   4.050
  179    HE2  TYR  23           2HE      TYR  23  -3.833 -10.252   3.934
  180    HH   TYR  23           HH       TYR  23  -6.243 -11.981   5.010
  181    H    GLY  24           H        GLY  24   2.386 -13.930   4.369
  182   1HA   GLY  24          2HA       GLY  24   4.125 -15.618   4.409
  183   2HA   GLY  24          1HA       GLY  24   2.939 -16.776   3.827
  184    H    ILE  25           H        ILE  25   2.225 -14.127   2.088
  185    HA   ILE  25           HA       ILE  25   3.083 -15.091  -0.347
  186    HB   ILE  25           HB       ILE  25   3.165 -12.154  -0.271
  187   1HG1  ILE  25          2HG1      ILE  25   0.662 -13.609   0.619
  188   2HG1  ILE  25          1HG1      ILE  25   1.575 -12.423   1.547
  189   1HG2  ILE  25          1HG2      ILE  25   2.897 -12.916  -2.386
  190   2HG2  ILE  25          2HG2      ILE  25   1.191 -12.767  -1.947
  191   3HG2  ILE  25          3HG2      ILE  25   1.987 -14.340  -1.880
  192   1HD1  ILE  25          1HD1      ILE  25  -0.115 -11.111   0.776
  193   2HD1  ILE  25          2HD1      ILE  25  -0.290 -12.026  -0.722
  194   3HD1  ILE  25          3HD1      ILE  25   1.048 -10.899  -0.533
  195    H    GLY  26           H        GLY  26   4.647 -13.817  -1.883
  196   1HA   GLY  26          2HA       GLY  26   7.268 -14.087  -0.715
  197   2HA   GLY  26          1HA       GLY  26   6.901 -13.697  -2.394
  198    H    ASP  27           H        ASP  27   8.924 -12.492  -0.758
  199    HA   ASP  27           HA       ASP  27   8.111  -9.985   0.254
  200   1HB   ASP  27          2HB       ASP  27  10.689 -11.280  -0.437
  201   2HB   ASP  27          1HB       ASP  27  10.690  -9.520  -0.388
  202    H    TYR  28           H        TYR  28   8.652 -11.112  -2.966
  203    HA   TYR  28           HA       TYR  28   9.388  -8.891  -4.398
  204   1HB   TYR  28          2HB       TYR  28   8.468 -11.314  -5.126
  205   2HB   TYR  28          1HB       TYR  28   7.021 -10.361  -5.444
  206    HD1  TYR  28           1HD      TYR  28   6.797  -9.809  -7.656
  207    HD2  TYR  28           2HD      TYR  28  10.681  -9.807  -5.932
  208    HE1  TYR  28           1HE      TYR  28   7.732  -9.022  -9.785
  209    HE2  TYR  28           2HE      TYR  28  11.630  -9.024  -8.051
  210    HH   TYR  28           HH       TYR  28   9.780  -7.769 -10.548
  211    H    TYR  29           H        TYR  29   6.159  -9.757  -3.314
  212    HA   TYR  29           HA       TYR  29   4.948  -7.378  -4.291
  213   1HB   TYR  29          2HB       TYR  29   3.768  -9.325  -2.311
  214   2HB   TYR  29          1HB       TYR  29   2.910  -8.252  -3.409
  215    HD1  TYR  29           1HD      TYR  29   4.911  -8.746  -5.755
  216    HD2  TYR  29           2HD      TYR  29   2.700 -11.337  -3.190
  217    HE1  TYR  29           1HE      TYR  29   4.982 -10.514  -7.468
  218    HE2  TYR  29           2HE      TYR  29   2.753 -13.096  -4.908
  219    HH   TYR  29           HH       TYR  29   4.777 -12.926  -7.650
  220    H    ILE  30           H        ILE  30   6.536  -8.129  -1.295
  221    HA   ILE  30           HA       ILE  30   5.231  -6.026   0.179
  222    HB   ILE  30           HB       ILE  30   6.547  -6.539   1.967
  223   1HG1  ILE  30          2HG1      ILE  30   8.877  -7.693   1.606
  224   2HG1  ILE  30          1HG1      ILE  30   8.742  -6.987  -0.002
  225   1HG2  ILE  30          1HG2      ILE  30   6.422  -8.965   0.260
  226   2HG2  ILE  30          2HG2      ILE  30   5.554  -8.575   1.741
  227   3HG2  ILE  30          3HG2      ILE  30   7.254  -9.029   1.811
  228   1HD1  ILE  30          1HD1      ILE  30   9.682  -5.193   0.921
  229   2HD1  ILE  30          2HD1      ILE  30   9.297  -5.720   2.560
  230   3HD1  ILE  30          3HD1      ILE  30   8.078  -4.887   1.591
  231    H    LYS  31           H        LYS  31   8.012  -6.431  -1.855
  232    HA   LYS  31           HA       LYS  31   9.088  -3.798  -1.401
  233   1HB   LYS  31          2HB       LYS  31   9.769  -6.143  -3.111
  234   2HB   LYS  31          1HB       LYS  31  10.415  -4.571  -3.556
  235   1HG   LYS  31          2HG       LYS  31  12.058  -4.868  -2.105
  236   2HG   LYS  31          1HG       LYS  31  10.875  -4.866  -0.796
  237   1HD   LYS  31          2HD       LYS  31  10.563  -7.382  -1.620
  238   2HD   LYS  31          1HD       LYS  31  12.233  -7.138  -2.135
  239   1HE   LYS  31          2HE       LYS  31  11.241  -6.545   0.646
  240   2HE   LYS  31          1HE       LYS  31  11.946  -8.090   0.174
  241   1HZ   LYS  31          1HZ       LYS  31  13.232  -5.524   0.614
  242   2HZ   LYS  31          2HZ       LYS  31  13.813  -6.415  -0.700
  243   3HZ   LYS  31          3HZ       LYS  31  13.828  -7.090   0.851
  244    H    LEU  32           H        LEU  32   7.454  -5.480  -4.083
  245    HA   LEU  32           HA       LEU  32   7.409  -3.417  -5.906
  246   1HB   LEU  32          2HB       LEU  32   6.194  -4.849  -7.146
  247   2HB   LEU  32          1HB       LEU  32   6.428  -5.960  -5.820
  248    HG   LEU  32           HG       LEU  32   4.152  -6.073  -6.329
  249   1HD1  LEU  32          1HD1      LEU  32   5.098  -5.097  -3.908
  250   2HD1  LEU  32          2HD1      LEU  32   3.583  -5.972  -4.197
  251   3HD1  LEU  32          3HD1      LEU  32   3.607  -4.206  -4.228
  252   1HD2  LEU  32          1HD2      LEU  32   3.514  -3.224  -5.977
  253   2HD2  LEU  32          2HD2      LEU  32   2.868  -4.399  -7.123
  254   3HD2  LEU  32          3HD2      LEU  32   4.416  -3.615  -7.441
  255    H    ILE  33           H        ILE  33   5.808  -3.642  -2.919
  256    HA   ILE  33           HA       ILE  33   3.671  -1.799  -3.431
  257    HB   ILE  33           HB       ILE  33   4.784  -3.222  -1.057
  258   1HG1  ILE  33          2HG1      ILE  33   2.102  -2.920  -2.383
  259   2HG1  ILE  33          1HG1      ILE  33   3.090  -4.365  -2.226
  260   1HG2  ILE  33          1HG2      ILE  33   2.647  -1.555  -0.154
  261   2HG2  ILE  33          2HG2      ILE  33   3.934  -0.545  -0.799
  262   3HG2  ILE  33          3HG2      ILE  33   4.284  -1.706   0.477
  263   1HD1  ILE  33          1HD1      ILE  33   0.965  -3.533  -0.602
  264   2HD1  ILE  33          2HD1      ILE  33   2.426  -3.399   0.377
  265   3HD1  ILE  33          3HD1      ILE  33   2.015  -4.933  -0.388
  266    H    ASN  34           H        ASN  34   6.702  -1.642  -1.573
  267    HA   ASN  34           HA       ASN  34   6.625   1.008  -0.818
  268   1HB   ASN  34          2HB       ASN  34   8.292  -0.698  -0.083
  269   2HB   ASN  34          1HB       ASN  34   9.111  -0.504  -1.630
  270   1HD2  ASN  34          1HD2      ASN  34   8.434   0.907   1.453
  271   2HD2  ASN  34          2HD2      ASN  34   9.563   2.209   1.339
  272    H    ASN  35           H        ASN  35   7.181  -0.286  -3.981
  273    HA   ASN  35           HA       ASN  35   8.459   2.085  -5.008
  274   1HB   ASN  35          2HB       ASN  35   8.651  -0.410  -5.814
  275   2HB   ASN  35          1HB       ASN  35   7.243   0.012  -6.785
  276   1HD2  ASN  35          1HD2      ASN  35   8.087   0.085  -8.772
  277   2HD2  ASN  35          2HD2      ASN  35   9.376   1.128  -9.259
  278    H    ALA  36           H        ALA  36   5.202   1.017  -4.598
  279    HA   ALA  36           HA       ALA  36   3.878   2.257  -6.686
  280   1HB   ALA  36          1HB       ALA  36   2.296   1.171  -5.552
  281   2HB   ALA  36          2HB       ALA  36   2.157   2.644  -4.592
  282   3HB   ALA  36          3HB       ALA  36   3.165   1.314  -4.026
  283    H    LYS  37           H        LYS  37   3.334   4.286  -7.222
  284    HA   LYS  37           HA       LYS  37   4.303   6.455  -5.494
  285   1HB   LYS  37          2HB       LYS  37   4.250   6.005  -8.363
  286   2HB   LYS  37          1HB       LYS  37   3.519   7.546  -7.945
  287   1HG   LYS  37          2HG       LYS  37   5.765   8.053  -8.292
  288   2HG   LYS  37          1HG       LYS  37   5.623   7.943  -6.536
  289   1HD   LYS  37          2HD       LYS  37   6.354   5.496  -8.067
  290   2HD   LYS  37          1HD       LYS  37   7.579   6.739  -7.829
  291   1HE   LYS  37          2HE       LYS  37   5.987   5.419  -5.635
  292   2HE   LYS  37          1HE       LYS  37   7.641   5.005  -6.081
  293   1HZ   LYS  37          1HZ       LYS  37   7.373   7.795  -5.600
  294   2HZ   LYS  37          2HZ       LYS  37   8.412   6.674  -4.873
  295   3HZ   LYS  37          3HZ       LYS  37   6.853   6.901  -4.259
  296    H    THR  38           H        THR  38   1.966   5.228  -4.699
  297    HA   THR  38           HA       THR  38   0.218   7.360  -4.316
  298    HB   THR  38           HB       THR  38  -1.693   5.999  -5.699
  299    HG1  THR  38           1HG      THR  38  -0.405   4.646  -6.820
  300   1HG2  THR  38          1HG2      THR  38  -0.658   8.512  -5.821
  301   2HG2  THR  38          2HG2      THR  38  -1.961   7.893  -6.831
  302   3HG2  THR  38          3HG2      THR  38  -0.307   7.889  -7.433
  303    H    VAL  39           H        VAL  39  -0.160   6.758  -2.271
  304    HA   VAL  39           HA       VAL  39  -0.086   4.277  -1.185
  305    HB   VAL  39           HB       VAL  39  -0.516   6.658  -0.109
  306   1HG1  VAL  39          1HG1      VAL  39  -3.164   5.276   0.209
  307   2HG1  VAL  39          2HG1      VAL  39  -2.890   6.719  -0.767
  308   3HG1  VAL  39          3HG1      VAL  39  -2.651   6.775   0.982
  309   1HG2  VAL  39          1HG2      VAL  39  -0.850   3.884   0.869
  310   2HG2  VAL  39          2HG2      VAL  39  -1.181   5.214   1.977
  311   3HG2  VAL  39          3HG2      VAL  39   0.412   5.057   1.229
  312    H    GLU  40           H        GLU  40  -3.015   5.793  -2.523
  313    HA   GLU  40           HA       GLU  40  -4.892   3.921  -1.815
  314   1HB   GLU  40          2HB       GLU  40  -4.582   5.765  -4.120
  315   2HB   GLU  40          1HB       GLU  40  -5.765   4.477  -4.297
  316   1HG   GLU  40          2HG       GLU  40  -7.188   5.832  -3.271
  317   2HG   GLU  40          1HG       GLU  40  -6.300   5.482  -1.792
  318    H    GLY  41           H        GLY  41  -2.457   3.703  -4.322
  319   1HA   GLY  41          2HA       GLY  41  -3.488   1.158  -5.280
  320   2HA   GLY  41          1HA       GLY  41  -2.068   2.004  -5.882
  321    H    VAL  42           H        VAL  42  -0.943   2.386  -3.224
  322    HA   VAL  42           HA       VAL  42   0.725   0.177  -3.049
  323    HB   VAL  42           HB       VAL  42   0.011   2.073  -0.810
  324   1HG1  VAL  42          1HG1      VAL  42   1.139   0.311   0.196
  325   2HG1  VAL  42          2HG1      VAL  42   2.438   1.452  -0.180
  326   3HG1  VAL  42          3HG1      VAL  42   2.168   0.047  -1.216
  327   1HG2  VAL  42          1HG2      VAL  42   0.924   2.965  -3.094
  328   2HG2  VAL  42          2HG2      VAL  42   2.454   2.311  -2.511
  329   3HG2  VAL  42          3HG2      VAL  42   1.613   3.547  -1.579
  330    H    GLU  43           H        GLU  43  -2.106   0.957  -1.036
  331    HA   GLU  43           HA       GLU  43  -1.936  -1.425   0.511
  332   1HB   GLU  43          2HB       GLU  43  -4.485  -0.766   0.902
  333   2HB   GLU  43          1HB       GLU  43  -3.167   0.111   1.666
  334   1HG   GLU  43          2HG       GLU  43  -3.327   1.889   0.127
  335   2HG   GLU  43          1HG       GLU  43  -4.380   0.964  -0.946
  336    H    SER  44           H        SER  44  -4.226  -0.468  -2.049
  337    HA   SER  44           HA       SER  44  -5.510  -2.950  -2.235
  338   1HB   SER  44          2HB       SER  44  -5.869  -0.486  -3.365
  339   2HB   SER  44          1HB       SER  44  -5.315  -1.434  -4.747
  340    HG   SER  44           HG       SER  44  -7.425  -2.215  -3.018
  341    H    LEU  45           H        LEU  45  -2.448  -1.870  -3.383
  342    HA   LEU  45           HA       LEU  45  -2.010  -3.538  -5.569
  343   1HB   LEU  45          2HB       LEU  45  -0.366  -2.039  -3.664
  344   2HB   LEU  45          1HB       LEU  45   0.440  -3.450  -4.307
  345   1HD1  LEU  45          1HD1      LEU  45   1.371  -3.583  -6.059
  346   2HD1  LEU  45          2HD1      LEU  45   2.046  -2.017  -6.511
  347   3HD1  LEU  45          3HD1      LEU  45   0.845  -2.792  -7.546
  348   1HD2  LEU  45          1HD2      LEU  45  -1.233  -2.437  -7.399
  349   2HD2  LEU  45          2HD2      LEU  45  -1.004  -0.704  -7.166
  350   3HD2  LEU  45          3HD2      LEU  45  -2.050  -1.610  -6.074
  351    H    LYS  46           H        LYS  46  -1.010  -4.135  -2.194
  352    HA   LYS  46           HA       LYS  46  -0.369  -6.862  -2.700
  353   1HB   LYS  46          2HB       LYS  46   0.769  -6.345  -0.838
  354   2HB   LYS  46          1HB       LYS  46  -0.314  -5.030  -0.414
  355   1HG   LYS  46          2HG       LYS  46  -1.132  -7.873   0.048
  356   2HG   LYS  46          1HG       LYS  46  -0.047  -7.054   1.177
  357   1HD   LYS  46          2HD       LYS  46  -1.753  -5.211   1.326
  358   2HD   LYS  46          1HD       LYS  46  -2.851  -6.250   0.421
  359   1HE   LYS  46          2HE       LYS  46  -3.144  -7.695   2.153
  360   2HE   LYS  46          1HE       LYS  46  -1.539  -7.393   2.818
  361   1HZ   LYS  46          1HZ       LYS  46  -2.509  -5.072   3.328
  362   2HZ   LYS  46          2HZ       LYS  46  -2.911  -6.368   4.335
  363   3HZ   LYS  46          3HZ       LYS  46  -4.011  -5.836   3.167
  364    H    ASN  47           H        ASN  47  -3.180  -5.221  -1.303
  365    HA   ASN  47           HA       ASN  47  -4.599  -7.533  -0.566
  366   1HB   ASN  47          2HB       ASN  47  -5.234  -5.255   0.169
  367   2HB   ASN  47          1HB       ASN  47  -5.710  -4.858  -1.480
  368   1HD2  ASN  47          1HD2      ASN  47  -6.787  -5.891   1.468
  369   2HD2  ASN  47          2HD2      ASN  47  -8.303  -6.569   0.990
  370    H    GLU  48           H        GLU  48  -4.092  -5.994  -3.630
  371    HA   GLU  48           HA       GLU  48  -6.196  -7.416  -4.992
  372   1HB   GLU  48          2HB       GLU  48  -5.446  -5.224  -5.808
  373   2HB   GLU  48          1HB       GLU  48  -3.833  -5.866  -6.080
  374   1HG   GLU  48          2HG       GLU  48  -4.548  -7.203  -7.870
  375   2HG   GLU  48          1HG       GLU  48  -6.247  -7.010  -7.441
  376    H    ILE  49           H        ILE  49  -2.756  -7.755  -4.452
  377    HA   ILE  49           HA       ILE  49  -2.313  -9.896  -6.264
  378    HB   ILE  49           HB       ILE  49  -0.205 -10.208  -5.227
  379   1HG1  ILE  49          2HG1      ILE  49  -0.759  -8.485  -2.868
  380   2HG1  ILE  49          1HG1      ILE  49  -1.366 -10.127  -2.828
  381   1HG2  ILE  49          1HG2      ILE  49  -1.116  -7.628  -5.902
  382   2HG2  ILE  49          2HG2      ILE  49   0.522  -8.275  -6.005
  383   3HG2  ILE  49          3HG2      ILE  49  -0.012  -7.460  -4.536
  384   1HD1  ILE  49          1HD1      ILE  49   1.467  -9.623  -3.529
  385   2HD1  ILE  49          2HD1      ILE  49   0.726 -11.025  -2.756
  386   3HD1  ILE  49          3HD1      ILE  49   0.947  -9.526  -1.847
  387    H    LEU  50           H        LEU  50  -3.546  -9.629  -3.052
  388    HA   LEU  50           HA       LEU  50  -3.409 -12.436  -2.456
  389   1HB   LEU  50          2HB       LEU  50  -4.727 -10.088  -1.094
  390   2HB   LEU  50          1HB       LEU  50  -4.768 -11.721  -0.451
  391    HG   LEU  50           HG       LEU  50  -2.089 -10.647  -1.087
  392   1HD1  LEU  50          1HD1      LEU  50  -3.044  -8.669  -0.145
  393   2HD1  LEU  50          2HD1      LEU  50  -2.000  -9.422   1.062
  394   3HD1  LEU  50          3HD1      LEU  50  -3.752  -9.587   1.184
  395   1HD2  LEU  50          1HD2      LEU  50  -1.856 -12.662  -0.078
  396   2HD2  LEU  50          2HD2      LEU  50  -3.363 -12.505   0.831
  397   3HD2  LEU  50          3HD2      LEU  50  -1.915 -11.656   1.372
  398    H    LYS  51           H        LYS  51  -5.752 -10.159  -3.716
  399    HA   LYS  51           HA       LYS  51  -8.071 -11.721  -3.428
  400   1HB   LYS  51          2HB       LYS  51  -7.949  -9.285  -4.110
  401   2HB   LYS  51          1HB       LYS  51  -7.489  -9.834  -5.715
  402   1HG   LYS  51          2HG       LYS  51  -9.863 -11.194  -4.827
  403   2HG   LYS  51          1HG       LYS  51 -10.067  -9.445  -4.723
  404   1HD   LYS  51          2HD       LYS  51  -9.047 -10.881  -7.171
  405   2HD   LYS  51          1HD       LYS  51 -10.740 -10.448  -6.917
  406   1HE   LYS  51          2HE       LYS  51  -8.922  -8.215  -6.486
  407   2HE   LYS  51          1HE       LYS  51  -8.816  -8.876  -8.117
  408   1HZ   LYS  51          1HZ       LYS  51 -11.495  -8.477  -7.081
  409   2HZ   LYS  51          2HZ       LYS  51 -10.874  -8.181  -8.627
  410   3HZ   LYS  51          3HZ       LYS  51 -10.609  -7.067  -7.383
  411    H    ALA  52           H        ALA  52  -5.336 -12.014  -5.481
  412    HA   ALA  52           HA       ALA  52  -6.510 -14.373  -6.722
  413   1HB   ALA  52          1HB       ALA  52  -5.681 -13.709  -8.953
  414   2HB   ALA  52          2HB       ALA  52  -5.251 -12.128  -8.296
  415   3HB   ALA  52          3HB       ALA  52  -6.941 -12.634  -8.347
  416    H    LEU  53           H        LEU  53  -4.909 -14.955  -4.876
  417    HA   LEU  53           HA       LEU  53  -2.124 -14.877  -5.709
  418   1HB   LEU  53          2HB       LEU  53  -3.543 -15.197  -3.221
  419   2HB   LEU  53          1HB       LEU  53  -2.389 -16.500  -3.427
  420    HG   LEU  53           HG       LEU  53  -1.677 -13.574  -3.628
  421   1HD1  LEU  53          1HD1      LEU  53  -0.672 -13.858  -1.411
  422   2HD1  LEU  53          2HD1      LEU  53  -1.351 -15.483  -1.318
  423   3HD1  LEU  53          3HD1      LEU  53  -2.421 -14.082  -1.376
  424   1HD2  LEU  53          1HD2      LEU  53   0.339 -15.628  -3.009
  425   2HD2  LEU  53          2HD2      LEU  53   0.446 -14.204  -4.043
  426   3HD2  LEU  53          3HD2      LEU  53  -0.320 -15.674  -4.644
  427    HA   PRO  54           HA       PRO  54  -2.973 -19.681  -5.636
  428   1HB   PRO  54          2HB       PRO  54  -5.904 -19.777  -5.977
  429   2HB   PRO  54          1HB       PRO  54  -4.867 -20.710  -4.893
  430   1HG   PRO  54          2HG       PRO  54  -6.479 -18.784  -3.965
  431   2HG   PRO  54          1HG       PRO  54  -4.879 -19.079  -3.258
  432   1HD   PRO  54          2HD       PRO  54  -5.742 -16.940  -5.169
  433   2HD   PRO  54          1HD       PRO  54  -4.663 -16.827  -3.763
  434    H    THR  55           H        THR  55  -3.368 -21.115  -7.446
  435    HA   THR  55           HA       THR  55  -4.700 -20.176  -9.793
  436    HB   THR  55           HB       THR  55  -1.730 -20.478 -10.122
  437    HG1  THR  55           1HG      THR  55  -1.623 -18.185 -10.018
  438   1HG2  THR  55          1HG2      THR  55  -1.992 -19.307 -12.135
  439   2HG2  THR  55          2HG2      THR  55  -3.627 -18.792 -11.716
  440   3HG2  THR  55          3HG2      THR  55  -3.306 -20.484 -12.096
  441    H    GLU  56           H        GLU  56  -4.629 -22.520  -8.065
  442    HA   GLU  56           HA       GLU  56  -4.709 -24.528 -10.065
  443   1HB   GLU  56          2HB       GLU  56  -2.922 -25.988  -9.087
  444   2HB   GLU  56          1HB       GLU  56  -2.320 -24.557  -9.912
  445   1HG   GLU  56          2HG       GLU  56  -2.773 -24.455  -6.971
  446   2HG   GLU  56          1HG       GLU  56  -1.348 -25.280  -7.601
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1  -3.314  25.576   0.117
    2   2H    MET   1          2HT       MET   1  -3.295  25.867   1.805
    3   3H    MET   1          3HT       MET   1  -4.750  26.040   0.916
    4    HA   MET   1           HA       MET   1  -4.984  24.042   1.968
    5   1HB   MET   1          2HB       MET   1  -3.793  23.377  -0.730
    6   2HB   MET   1          1HB       MET   1  -5.025  22.476   0.136
    7   1HG   MET   1          2HG       MET   1  -6.637  24.171  -0.223
    8   2HG   MET   1          1HG       MET   1  -5.419  25.302  -0.818
    9   1HE   MET   1          1HE       MET   1  -7.482  24.694  -4.045
   10   2HE   MET   1          2HE       MET   1  -7.058  25.802  -2.737
   11   3HE   MET   1          3HE       MET   1  -8.240  24.521  -2.462
   12    H    GLU   2           H        GLU   2  -4.086  22.560   3.260
   13    HA   GLU   2           HA       GLU   2  -1.186  22.213   3.138
   14   1HB   GLU   2          2HB       GLU   2  -1.367  21.419   5.456
   15   2HB   GLU   2          1HB       GLU   2  -2.033  23.035   5.266
   16   1HG   GLU   2          2HG       GLU   2  -4.295  22.089   5.201
   17   2HG   GLU   2          1HG       GLU   2  -3.616  20.477   5.423
   18    H    ALA   3           H        ALA   3  -0.454  19.985   3.977
   19    HA   ALA   3           HA       ALA   3  -2.100  17.728   3.583
   20   1HB   ALA   3          1HB       ALA   3  -0.656  18.765   1.227
   21   2HB   ALA   3          2HB       ALA   3  -2.139  17.817   1.322
   22   3HB   ALA   3          3HB       ALA   3  -0.570  17.030   1.497
   23    H    VAL   4           H        VAL   4  -1.125  15.865   4.288
   24    HA   VAL   4           HA       VAL   4   1.736  15.646   4.513
   25    HB   VAL   4           HB       VAL   4   1.611  15.250   7.027
   26   1HG1  VAL   4          1HG1      VAL   4   1.076  18.128   6.484
   27   2HG1  VAL   4          2HG1      VAL   4   2.426  17.363   5.663
   28   3HG1  VAL   4          3HG1      VAL   4   2.361  17.371   7.425
   29   1HG2  VAL   4          1HG2      VAL   4  -0.173  16.636   8.156
   30   2HG2  VAL   4          2HG2      VAL   4  -0.720  15.138   7.401
   31   3HG2  VAL   4          3HG2      VAL   4  -1.001  16.682   6.599
   32    H    ASP   5           H        ASP   5  -0.286  14.143   3.227
   33    HA   ASP   5           HA       ASP   5  -1.031  11.871   4.741
   34   1HB   ASP   5          2HB       ASP   5  -1.996  12.808   2.500
   35   2HB   ASP   5          1HB       ASP   5  -0.759  11.795   1.757
   36    H    ALA   6           H        ALA   6   1.948  12.814   3.469
   37    HA   ALA   6           HA       ALA   6   3.141  10.551   2.485
   38   1HB   ALA   6          1HB       ALA   6   4.111  12.933   3.955
   39   2HB   ALA   6          2HB       ALA   6   4.593  12.285   2.386
   40   3HB   ALA   6          3HB       ALA   6   5.203  11.547   3.867
   41    H    ASN   7           H        ASN   7   2.372  11.297   5.827
   42    HA   ASN   7           HA       ASN   7   3.893   9.168   6.962
   43   1HB   ASN   7          2HB       ASN   7   2.678  11.374   7.988
   44   2HB   ASN   7          1HB       ASN   7   1.531  10.126   8.454
   45   1HD2  ASN   7          1HD2      ASN   7   1.884   9.798  10.535
   46   2HD2  ASN   7          2HD2      ASN   7   3.407   9.444  11.261
   47    H    SER   8           H        SER   8   0.451   9.595   6.199
   48    HA   SER   8           HA       SER   8  -0.315   7.002   7.054
   49   1HB   SER   8          2HB       SER   8  -1.834   9.026   6.742
   50   2HB   SER   8          1HB       SER   8  -1.776   8.682   5.013
   51    HG   SER   8           HG       SER   8  -3.572   7.685   5.980
   52    H    LEU   9           H        LEU   9   0.862   8.326   4.050
   53    HA   LEU   9           HA       LEU   9   0.138   6.280   2.291
   54   1HB   LEU   9          2HB       LEU   9   1.107   8.540   1.722
   55   2HB   LEU   9          1HB       LEU   9   2.675   7.899   2.172
   56    HG   LEU   9           HG       LEU   9   0.964   6.759  -0.032
   57   1HD1  LEU   9          1HD1      LEU   9   2.072   9.178  -0.154
   58   2HD1  LEU   9          2HD1      LEU   9   1.948   8.100  -1.545
   59   3HD1  LEU   9          3HD1      LEU   9   3.456   8.199  -0.634
   60   1HD2  LEU   9          1HD2      LEU   9   3.542   6.029   1.188
   61   2HD2  LEU   9          2HD2      LEU   9   3.486   6.011  -0.575
   62   3HD2  LEU   9          3HD2      LEU   9   2.353   5.028   0.354
   63    H    ALA  10           H        ALA  10   3.043   6.716   4.276
   64    HA   ALA  10           HA       ALA  10   4.365   4.374   3.395
   65   1HB   ALA  10          1HB       ALA  10   4.759   6.376   5.527
   66   2HB   ALA  10          2HB       ALA  10   5.893   5.750   4.329
   67   3HB   ALA  10          3HB       ALA  10   5.520   4.803   5.770
   68    H    GLN  11           H        GLN  11   1.815   4.877   5.646
   69    HA   GLN  11           HA       GLN  11   2.291   2.471   7.154
   70   1HB   GLN  11          2HB       GLN  11   1.273   4.267   8.340
   71   2HB   GLN  11          1HB       GLN  11   0.036   4.466   7.103
   72   1HG   GLN  11          2HG       GLN  11  -0.823   2.242   7.661
   73   2HG   GLN  11          1HG       GLN  11   0.346   2.131   8.971
   74   1HE2  GLN  11          1HE2      GLN  11  -0.521   2.520  10.862
   75   2HE2  GLN  11          2HE2      GLN  11  -1.783   3.651  11.199
   76    H    ALA  12           H        ALA  12   0.066   3.523   4.605
   77    HA   ALA  12           HA       ALA  12  -1.601   1.321   4.495
   78   1HB   ALA  12          1HB       ALA  12  -1.379   3.540   3.025
   79   2HB   ALA  12          2HB       ALA  12  -2.303   2.134   2.496
   80   3HB   ALA  12          3HB       ALA  12  -0.658   2.384   1.904
   81    H    LYS  13           H        LYS  13   1.642   1.758   3.247
   82    HA   LYS  13           HA       LYS  13   1.712  -0.907   2.093
   83   1HB   LYS  13          2HB       LYS  13   4.248  -0.123   1.845
   84   2HB   LYS  13          1HB       LYS  13   2.993   0.368   0.728
   85   1HG   LYS  13          2HG       LYS  13   2.916   2.506   1.509
   86   2HG   LYS  13          1HG       LYS  13   3.547   2.057   3.102
   87   1HD   LYS  13          2HD       LYS  13   5.723   2.110   2.397
   88   2HD   LYS  13          1HD       LYS  13   5.309   1.630   0.749
   89   1HE   LYS  13          2HE       LYS  13   5.192   3.747   0.060
   90   2HE   LYS  13          1HE       LYS  13   4.210   4.220   1.445
   91   1HZ   LYS  13          1HZ       LYS  13   7.168   4.024   1.341
   92   2HZ   LYS  13          2HZ       LYS  13   6.290   4.296   2.762
   93   3HZ   LYS  13          3HZ       LYS  13   6.243   5.432   1.510
   94    H    GLU  14           H        GLU  14   3.520   0.902   4.587
   95    HA   GLU  14           HA       GLU  14   5.073  -1.133   5.604
   96   1HB   GLU  14          2HB       GLU  14   3.786   1.279   6.842
   97   2HB   GLU  14          1HB       GLU  14   4.592   0.112   7.883
   98   1HG   GLU  14          2HG       GLU  14   6.664   0.413   6.643
   99   2HG   GLU  14          1HG       GLU  14   5.863   1.559   5.569
  100    H    ALA  15           H        ALA  15   1.696  -0.419   6.072
  101    HA   ALA  15           HA       ALA  15   1.318  -2.567   7.993
  102   1HB   ALA  15          1HB       ALA  15   0.059  -0.292   7.873
  103   2HB   ALA  15          2HB       ALA  15  -0.821  -1.755   8.313
  104   3HB   ALA  15          3HB       ALA  15  -0.937  -1.116   6.674
  105    H    ALA  16           H        ALA  16   0.813  -1.961   4.572
  106    HA   ALA  16           HA       ALA  16  -0.799  -4.262   4.085
  107   1HB   ALA  16          1HB       ALA  16   0.744  -2.421   2.281
  108   2HB   ALA  16          2HB       ALA  16  -1.000  -2.556   2.486
  109   3HB   ALA  16          3HB       ALA  16  -0.108  -3.835   1.666
  110    H    ILE  17           H        ILE  17   2.618  -3.712   4.357
  111    HA   ILE  17           HA       ILE  17   3.375  -6.132   2.996
  112    HB   ILE  17           HB       ILE  17   5.639  -5.699   3.900
  113   1HG1  ILE  17          2HG1      ILE  17   4.341  -3.268   5.144
  114   2HG1  ILE  17          1HG1      ILE  17   4.977  -4.652   6.025
  115   1HG2  ILE  17          1HG2      ILE  17   5.013  -4.749   1.773
  116   2HG2  ILE  17          2HG2      ILE  17   6.028  -3.606   2.653
  117   3HG2  ILE  17          3HG2      ILE  17   4.284  -3.357   2.574
  118   1HD1  ILE  17          1HD1      ILE  17   7.191  -4.104   5.491
  119   2HD1  ILE  17          2HD1      ILE  17   6.422  -2.574   5.916
  120   3HD1  ILE  17          3HD1      ILE  17   6.695  -2.984   4.222
  121    H    LYS  18           H        LYS  18   2.782  -5.118   6.302
  122    HA   LYS  18           HA       LYS  18   3.846  -7.313   7.667
  123   1HB   LYS  18          2HB       LYS  18   2.293  -5.051   8.302
  124   2HB   LYS  18          1HB       LYS  18   1.374  -6.436   8.876
  125   1HG   LYS  18          2HG       LYS  18   3.456  -7.203  10.052
  126   2HG   LYS  18          1HG       LYS  18   4.173  -5.645   9.634
  127   1HD   LYS  18          2HD       LYS  18   3.322  -5.382  11.817
  128   2HD   LYS  18          1HD       LYS  18   2.157  -4.585  10.759
  129   1HE   LYS  18          2HE       LYS  18   0.908  -5.859  12.324
  130   2HE   LYS  18          1HE       LYS  18   0.829  -6.717  10.786
  131   1HZ   LYS  18          1HZ       LYS  18   2.075  -7.503  13.283
  132   2HZ   LYS  18          2HZ       LYS  18   2.971  -7.852  11.891
  133   3HZ   LYS  18          3HZ       LYS  18   1.402  -8.459  12.060
  134    H    GLU  19           H        GLU  19   0.805  -6.884   5.974
  135    HA   GLU  19           HA       GLU  19  -0.400  -9.305   6.852
  136   1HB   GLU  19          2HB       GLU  19  -1.023  -7.156   4.999
  137   2HB   GLU  19          1HB       GLU  19  -1.453  -8.723   4.327
  138   1HG   GLU  19          2HG       GLU  19  -3.363  -7.899   5.445
  139   2HG   GLU  19          1HG       GLU  19  -2.699  -9.188   6.448
  140    H    LEU  20           H        LEU  20   1.614  -8.394   4.112
  141    HA   LEU  20           HA       LEU  20   1.442 -10.793   2.673
  142   1HB   LEU  20          2HB       LEU  20   2.921  -8.378   2.526
  143   2HB   LEU  20          1HB       LEU  20   4.075  -9.697   2.458
  144    HG   LEU  20           HG       LEU  20   2.100 -10.494   0.707
  145   1HD1  LEU  20          1HD1      LEU  20   2.226  -8.308  -0.802
  146   2HD1  LEU  20          2HD1      LEU  20   2.257  -7.541   0.787
  147   3HD1  LEU  20          3HD1      LEU  20   0.915  -8.594   0.342
  148   1HD2  LEU  20          1HD2      LEU  20   3.784 -10.530  -0.819
  149   2HD2  LEU  20          2HD2      LEU  20   4.731 -10.364   0.657
  150   3HD2  LEU  20          3HD2      LEU  20   4.399  -8.948  -0.342
  151    H    LYS  21           H        LYS  21   3.330  -9.839   5.449
  152    HA   LYS  21           HA       LYS  21   4.983 -12.205   5.417
  153   1HB   LYS  21          2HB       LYS  21   5.926 -10.163   6.315
  154   2HB   LYS  21          1HB       LYS  21   4.607 -10.013   7.469
  155   1HG   LYS  21          2HG       LYS  21   6.335 -12.444   7.526
  156   2HG   LYS  21          1HG       LYS  21   6.926 -10.932   8.221
  157   1HD   LYS  21          2HD       LYS  21   4.204 -11.511   9.042
  158   2HD   LYS  21          1HD       LYS  21   5.311 -12.816   9.470
  159   1HE   LYS  21          2HE       LYS  21   6.392 -10.168  10.026
  160   2HE   LYS  21          1HE       LYS  21   4.897 -10.500  10.901
  161   1HZ   LYS  21          1HZ       LYS  21   7.156 -11.186  11.919
  162   2HZ   LYS  21          2HZ       LYS  21   7.048 -12.509  10.872
  163   3HZ   LYS  21          3HZ       LYS  21   5.843 -12.248  12.030
  164    H    GLN  22           H        GLN  22   2.140 -11.009   7.120
  165    HA   GLN  22           HA       GLN  22   1.973 -13.212   8.931
  166   1HB   GLN  22          2HB       GLN  22   0.957 -10.984   9.365
  167   2HB   GLN  22          1HB       GLN  22  -0.201 -11.291   8.079
  168   1HG   GLN  22          2HG       GLN  22  -0.517 -13.504   9.619
  169   2HG   GLN  22          1HG       GLN  22  -0.127 -12.283  10.832
  170   1HE2  GLN  22          1HE2      GLN  22  -2.233 -12.446  11.666
  171   2HE2  GLN  22          2HE2      GLN  22  -3.578 -11.715  10.866
  172    H    TYR  23           H        TYR  23   0.887 -12.594   5.692
  173    HA   TYR  23           HA       TYR  23  -0.944 -14.841   5.660
  174   1HB   TYR  23          2HB       TYR  23  -0.047 -12.868   3.559
  175   2HB   TYR  23          1HB       TYR  23  -1.077 -14.247   3.182
  176    HD1  TYR  23           1HD      TYR  23  -3.008 -14.387   5.265
  177    HD2  TYR  23           2HD      TYR  23  -1.255 -10.930   3.520
  178    HE1  TYR  23           1HE      TYR  23  -4.984 -13.073   5.898
  179    HE2  TYR  23           2HE      TYR  23  -3.222  -9.607   4.144
  180    HH   TYR  23           HH       TYR  23  -6.062 -10.735   4.830
  181    H    GLY  24           H        GLY  24   2.263 -14.009   4.452
  182   1HA   GLY  24          2HA       GLY  24   3.927 -15.770   4.367
  183   2HA   GLY  24          1HA       GLY  24   2.659 -16.864   3.838
  184    H    ILE  25           H        ILE  25   2.089 -14.041   2.208
  185    HA   ILE  25           HA       ILE  25   2.788 -15.091  -0.285
  186    HB   ILE  25           HB       ILE  25   2.909 -12.148  -0.189
  187   1HG1  ILE  25          2HG1      ILE  25   0.397 -13.606   0.671
  188   2HG1  ILE  25          1HG1      ILE  25   1.309 -12.436   1.620
  189   1HG2  ILE  25          1HG2      ILE  25   0.880 -12.832  -1.844
  190   2HG2  ILE  25          2HG2      ILE  25   1.841 -14.310  -1.861
  191   3HG2  ILE  25          3HG2      ILE  25   2.581 -12.776  -2.315
  192   1HD1  ILE  25          1HD1      ILE  25   0.794 -10.898  -0.475
  193   2HD1  ILE  25          2HD1      ILE  25  -0.344 -11.083   0.861
  194   3HD1  ILE  25          3HD1      ILE  25  -0.568 -12.004  -0.625
  195    H    GLY  26           H        GLY  26   4.338 -13.828  -1.863
  196   1HA   GLY  26          2HA       GLY  26   6.980 -14.161  -0.755
  197   2HA   GLY  26          1HA       GLY  26   6.584 -13.771  -2.426
  198    H    ASP  27           H        ASP  27   8.591 -12.639  -0.539
  199    HA   ASP  27           HA       ASP  27   7.872 -10.090   0.346
  200   1HB   ASP  27          2HB       ASP  27  10.441 -11.431  -0.352
  201   2HB   ASP  27          1HB       ASP  27  10.453  -9.680  -0.183
  202    H    TYR  28           H        TYR  28   8.459 -11.256  -2.857
  203    HA   TYR  28           HA       TYR  28   9.289  -9.060  -4.282
  204   1HB   TYR  28          2HB       TYR  28   8.326 -11.470  -5.017
  205   2HB   TYR  28          1HB       TYR  28   6.922 -10.476  -5.395
  206    HD1  TYR  28           1HD      TYR  28  10.619 -10.114  -5.769
  207    HD2  TYR  28           2HD      TYR  28   6.792  -9.868  -7.599
  208    HE1  TYR  28           1HE      TYR  28  11.673  -9.378  -7.855
  209    HE2  TYR  28           2HE      TYR  28   7.832  -9.135  -9.697
  210    HH   TYR  28           HH       TYR  28   9.884  -8.100 -10.476
  211    H    TYR  29           H        TYR  29   6.023  -9.846  -3.271
  212    HA   TYR  29           HA       TYR  29   4.879  -7.459  -4.306
  213   1HB   TYR  29          2HB       TYR  29   3.630  -9.392  -2.351
  214   2HB   TYR  29          1HB       TYR  29   2.801  -8.292  -3.446
  215    HD1  TYR  29           1HD      TYR  29   4.873  -8.805  -5.755
  216    HD2  TYR  29           2HD      TYR  29   2.508 -11.364  -3.298
  217    HE1  TYR  29           1HE      TYR  29   4.948 -10.547  -7.489
  218    HE2  TYR  29           2HE      TYR  29   2.565 -13.099  -5.038
  219    HH   TYR  29           HH       TYR  29   4.706 -13.116  -7.546
  220    H    ILE  30           H        ILE  30   6.382  -8.192  -1.265
  221    HA   ILE  30           HA       ILE  30   5.083  -6.042   0.148
  222    HB   ILE  30           HB       ILE  30   6.351  -6.552   1.972
  223   1HG1  ILE  30          2HG1      ILE  30   8.667  -7.758   1.672
  224   2HG1  ILE  30          1HG1      ILE  30   8.578  -7.064   0.057
  225   1HG2  ILE  30          1HG2      ILE  30   6.963  -9.034   1.939
  226   2HG2  ILE  30          2HG2      ILE  30   6.301  -9.020   0.306
  227   3HG2  ILE  30          3HG2      ILE  30   5.287  -8.566   1.671
  228   1HD1  ILE  30          1HD1      ILE  30   7.923  -4.936   1.609
  229   2HD1  ILE  30          2HD1      ILE  30   9.538  -5.284   0.988
  230   3HD1  ILE  30          3HD1      ILE  30   9.095  -5.782   2.622
  231    H    LYS  31           H        LYS  31   7.884  -6.537  -1.829
  232    HA   LYS  31           HA       LYS  31   9.017  -3.927  -1.384
  233   1HB   LYS  31          2HB       LYS  31   9.682  -6.326  -3.013
  234   2HB   LYS  31          1HB       LYS  31  10.350  -4.781  -3.521
  235   1HG   LYS  31          2HG       LYS  31  11.984  -5.043  -2.052
  236   2HG   LYS  31          1HG       LYS  31  10.795  -4.950  -0.752
  237   1HD   LYS  31          2HD       LYS  31  10.454  -7.509  -1.497
  238   2HD   LYS  31          1HD       LYS  31  12.153  -7.300  -1.927
  239   1HE   LYS  31          2HE       LYS  31  11.211  -6.359   0.740
  240   2HE   LYS  31          1HE       LYS  31  11.448  -8.086   0.483
  241   1HZ   LYS  31          1HZ       LYS  31  13.671  -7.856   0.380
  242   2HZ   LYS  31          2HZ       LYS  31  13.380  -6.445   1.267
  243   3HZ   LYS  31          3HZ       LYS  31  13.608  -6.360  -0.407
  244    H    LEU  32           H        LEU  32   7.399  -5.603  -4.086
  245    HA   LEU  32           HA       LEU  32   7.445  -3.562  -5.929
  246   1HB   LEU  32          2HB       LEU  32   6.205  -4.961  -7.181
  247   2HB   LEU  32          1HB       LEU  32   6.395  -6.071  -5.846
  248    HG   LEU  32           HG       LEU  32   4.122  -6.130  -6.388
  249   1HD1  LEU  32          1HD1      LEU  32   3.584  -4.251  -4.300
  250   2HD1  LEU  32          2HD1      LEU  32   5.061  -5.159  -3.957
  251   3HD1  LEU  32          3HD1      LEU  32   3.541  -6.017  -4.261
  252   1HD2  LEU  32          1HD2      LEU  32   3.568  -3.255  -6.053
  253   2HD2  LEU  32          2HD2      LEU  32   2.876  -4.420  -7.181
  254   3HD2  LEU  32          3HD2      LEU  32   4.449  -3.696  -7.516
  255    H    ILE  33           H        ILE  33   5.765  -3.706  -2.976
  256    HA   ILE  33           HA       ILE  33   3.704  -1.800  -3.567
  257    HB   ILE  33           HB       ILE  33   4.732  -3.168  -1.112
  258   1HG1  ILE  33          2HG1      ILE  33   2.063  -2.921  -2.494
  259   2HG1  ILE  33          1HG1      ILE  33   3.088  -4.343  -2.376
  260   1HG2  ILE  33          1HG2      ILE  33   4.305  -1.448   0.225
  261   2HG2  ILE  33          2HG2      ILE  33   2.605  -1.617  -0.206
  262   3HG2  ILE  33          3HG2      ILE  33   3.632  -0.499  -1.097
  263   1HD1  ILE  33          1HD1      ILE  33   2.125  -4.963  -0.487
  264   2HD1  ILE  33          2HD1      ILE  33   0.943  -3.682  -0.755
  265   3HD1  ILE  33          3HD1      ILE  33   2.367  -3.374   0.239
  266    H    ASN  34           H        ASN  34   6.639  -1.701  -1.543
  267    HA   ASN  34           HA       ASN  34   6.617   0.976  -0.887
  268   1HB   ASN  34          2HB       ASN  34   8.268  -1.065  -0.333
  269   2HB   ASN  34          1HB       ASN  34   9.268  -0.208  -1.503
  270   1HD2  ASN  34          1HD2      ASN  34  10.654   1.098  -0.579
  271   2HD2  ASN  34          2HD2      ASN  34  10.393   2.019   0.859
  272    H    ASN  35           H        ASN  35   7.333  -0.459  -3.955
  273    HA   ASN  35           HA       ASN  35   8.888   1.639  -5.048
  274   1HB   ASN  35          2HB       ASN  35   7.381  -0.689  -6.140
  275   2HB   ASN  35          1HB       ASN  35   7.846   0.590  -7.258
  276   1HD2  ASN  35          1HD2      ASN  35   8.947  -1.965  -5.204
  277   2HD2  ASN  35          2HD2      ASN  35  10.586  -1.978  -5.747
  278    H    ALA  36           H        ALA  36   5.501   1.292  -4.479
  279    HA   ALA  36           HA       ALA  36   4.497   3.039  -6.445
  280   1HB   ALA  36          1HB       ALA  36   3.489   1.930  -3.888
  281   2HB   ALA  36          2HB       ALA  36   2.800   1.853  -5.509
  282   3HB   ALA  36          3HB       ALA  36   2.657   3.333  -4.560
  283    H    LYS  37           H        LYS  37   3.602   5.157  -6.146
  284    HA   LYS  37           HA       LYS  37   5.318   6.818  -4.445
  285   1HB   LYS  37          2HB       LYS  37   3.754   7.467  -6.950
  286   2HB   LYS  37          1HB       LYS  37   4.612   8.660  -5.987
  287   1HG   LYS  37          2HG       LYS  37   5.819   6.340  -7.467
  288   2HG   LYS  37          1HG       LYS  37   5.953   8.043  -7.879
  289   1HD   LYS  37          2HD       LYS  37   7.926   7.812  -6.777
  290   2HD   LYS  37          1HD       LYS  37   6.896   8.145  -5.385
  291   1HE   LYS  37          2HE       LYS  37   7.278   6.133  -4.523
  292   2HE   LYS  37          1HE       LYS  37   6.891   5.339  -6.049
  293   1HZ   LYS  37          1HZ       LYS  37   9.305   5.297  -4.957
  294   2HZ   LYS  37          2HZ       LYS  37   9.465   6.675  -5.920
  295   3HZ   LYS  37          3HZ       LYS  37   9.046   5.194  -6.627
  296    H    THR  38           H        THR  38   1.983   6.247  -5.413
  297    HA   THR  38           HA       THR  38   0.968   8.183  -3.496
  298    HB   THR  38           HB       THR  38  -1.182   7.769  -4.443
  299    HG1  THR  38           1HG      THR  38  -1.646   5.794  -4.917
  300   1HG2  THR  38          1HG2      THR  38   0.720   7.458  -6.749
  301   2HG2  THR  38          2HG2      THR  38   0.361   8.985  -5.949
  302   3HG2  THR  38          3HG2      THR  38  -0.917   8.111  -6.789
  303    H    VAL  39           H        VAL  39  -1.452   6.397  -3.019
  304    HA   VAL  39           HA       VAL  39  -0.248   4.334  -1.354
  305    HB   VAL  39           HB       VAL  39  -0.696   6.589  -0.094
  306   1HG1  VAL  39          1HG1      VAL  39  -2.822   6.689   0.986
  307   2HG1  VAL  39          2HG1      VAL  39  -3.346   5.206   0.187
  308   3HG1  VAL  39          3HG1      VAL  39  -3.082   6.672  -0.759
  309   1HG2  VAL  39          1HG2      VAL  39   0.234   4.836   1.083
  310   2HG2  VAL  39          2HG2      VAL  39  -1.128   3.769   0.750
  311   3HG2  VAL  39          3HG2      VAL  39  -1.302   5.078   1.918
  312    H    GLU  40           H        GLU  40  -3.265   5.771  -2.537
  313    HA   GLU  40           HA       GLU  40  -5.104   3.890  -1.837
  314   1HB   GLU  40          2HB       GLU  40  -5.124   6.037  -3.503
  315   2HB   GLU  40          1HB       GLU  40  -5.309   4.722  -4.654
  316   1HG   GLU  40          2HG       GLU  40  -7.195   3.895  -3.164
  317   2HG   GLU  40          1HG       GLU  40  -7.097   5.463  -2.364
  318    H    GLY  41           H        GLY  41  -2.872   3.689  -4.586
  319   1HA   GLY  41          2HA       GLY  41  -3.872   1.098  -5.375
  320   2HA   GLY  41          1HA       GLY  41  -2.488   1.939  -6.062
  321    H    VAL  42           H        VAL  42  -1.333   2.329  -3.349
  322    HA   VAL  42           HA       VAL  42   0.359   0.094  -3.291
  323    HB   VAL  42           HB       VAL  42  -0.143   2.119  -1.116
  324   1HG1  VAL  42          1HG1      VAL  42   1.889  -0.034  -1.511
  325   2HG1  VAL  42          2HG1      VAL  42   0.982   0.395  -0.055
  326   3HG1  VAL  42          3HG1      VAL  42   2.305   1.429  -0.615
  327   1HG2  VAL  42          1HG2      VAL  42   0.865   3.566  -2.477
  328   2HG2  VAL  42          2HG2      VAL  42   1.113   2.315  -3.691
  329   3HG2  VAL  42          3HG2      VAL  42   2.308   2.560  -2.418
  330    H    GLU  43           H        GLU  43  -2.307   0.995  -1.111
  331    HA   GLU  43           HA       GLU  43  -2.056  -1.308   0.530
  332   1HB   GLU  43          2HB       GLU  43  -4.586  -0.659   1.012
  333   2HB   GLU  43          1HB       GLU  43  -3.253   0.297   1.643
  334   1HG   GLU  43          2HG       GLU  43  -3.539   1.965   0.017
  335   2HG   GLU  43          1HG       GLU  43  -4.592   0.942  -0.963
  336    H    SER  44           H        SER  44  -4.298  -0.511  -2.111
  337    HA   SER  44           HA       SER  44  -5.594  -3.033  -2.098
  338   1HB   SER  44          2HB       SER  44  -6.047  -0.607  -3.317
  339   2HB   SER  44          1HB       SER  44  -5.564  -1.628  -4.673
  340    HG   SER  44           HG       SER  44  -7.641  -2.148  -2.809
  341    H    LEU  45           H        LEU  45  -2.618  -1.881  -3.388
  342    HA   LEU  45           HA       LEU  45  -2.160  -3.574  -5.542
  343   1HB   LEU  45          2HB       LEU  45  -0.570  -1.966  -3.715
  344   2HB   LEU  45          1HB       LEU  45   0.286  -3.406  -4.216
  345   1HD1  LEU  45          1HD1      LEU  45   2.019  -2.136  -6.161
  346   2HD1  LEU  45          2HD1      LEU  45   1.010  -2.723  -7.484
  347   3HD1  LEU  45          3HD1      LEU  45   1.205  -3.696  -6.027
  348   1HD2  LEU  45          1HD2      LEU  45  -2.156  -1.760  -6.270
  349   2HD2  LEU  45          2HD2      LEU  45  -1.273  -2.804  -7.382
  350   3HD2  LEU  45          3HD2      LEU  45  -1.049  -1.056  -7.448
  351    H    LYS  46           H        LYS  46  -1.168  -4.121  -2.158
  352    HA   LYS  46           HA       LYS  46  -0.464  -6.843  -2.630
  353   1HB   LYS  46          2HB       LYS  46   0.675  -6.242  -0.785
  354   2HB   LYS  46          1HB       LYS  46  -0.465  -4.974  -0.362
  355   1HG   LYS  46          2HG       LYS  46  -1.168  -7.845   0.116
  356   2HG   LYS  46          1HG       LYS  46  -0.096  -6.989   1.231
  357   1HD   LYS  46          2HD       LYS  46  -1.874  -5.198   1.373
  358   2HD   LYS  46          1HD       LYS  46  -2.942  -6.307   0.519
  359   1HE   LYS  46          2HE       LYS  46  -3.183  -7.674   2.300
  360   2HE   LYS  46          1HE       LYS  46  -1.536  -7.397   2.871
  361   1HZ   LYS  46          1HZ       LYS  46  -2.719  -6.298   4.460
  362   2HZ   LYS  46          2HZ       LYS  46  -3.976  -5.869   3.413
  363   3HZ   LYS  46          3HZ       LYS  46  -2.509  -5.028   3.363
  364    H    ASN  47           H        ASN  47  -3.286  -5.235  -1.198
  365    HA   ASN  47           HA       ASN  47  -4.670  -7.546  -0.423
  366   1HB   ASN  47          2HB       ASN  47  -5.168  -4.927  -0.126
  367   2HB   ASN  47          1HB       ASN  47  -6.242  -5.241  -1.486
  368   1HD2  ASN  47          1HD2      ASN  47  -5.438  -6.260   1.786
  369   2HD2  ASN  47          2HD2      ASN  47  -7.015  -6.840   2.188
  370    H    GLU  48           H        GLU  48  -4.214  -6.077  -3.531
  371    HA   GLU  48           HA       GLU  48  -6.310  -7.574  -4.830
  372   1HB   GLU  48          2HB       GLU  48  -5.577  -5.362  -5.672
  373   2HB   GLU  48          1HB       GLU  48  -3.993  -6.037  -6.028
  374   1HG   GLU  48          2HG       GLU  48  -5.776  -7.730  -7.315
  375   2HG   GLU  48          1HG       GLU  48  -6.426  -6.112  -7.576
  376    H    ILE  49           H        ILE  49  -2.841  -7.805  -4.380
  377    HA   ILE  49           HA       ILE  49  -2.368  -9.964  -6.146
  378    HB   ILE  49           HB       ILE  49  -0.255 -10.229  -5.105
  379   1HG1  ILE  49          2HG1      ILE  49  -0.831  -8.479  -2.772
  380   2HG1  ILE  49          1HG1      ILE  49  -1.422 -10.127  -2.705
  381   1HG2  ILE  49          1HG2      ILE  49  -1.209  -7.682  -5.827
  382   2HG2  ILE  49          2HG2      ILE  49   0.442  -8.295  -5.906
  383   3HG2  ILE  49          3HG2      ILE  49  -0.121  -7.465  -4.456
  384   1HD1  ILE  49          1HD1      ILE  49   0.915  -9.446  -1.770
  385   2HD1  ILE  49          2HD1      ILE  49   1.393  -9.655  -3.453
  386   3HD1  ILE  49          3HD1      ILE  49   0.665 -10.997  -2.574
  387    H    LEU  50           H        LEU  50  -3.614  -9.698  -2.944
  388    HA   LEU  50           HA       LEU  50  -3.381 -12.468  -2.268
  389   1HB   LEU  50          2HB       LEU  50  -4.835 -10.127  -1.048
  390   2HB   LEU  50          1HB       LEU  50  -4.901 -11.741  -0.361
  391    HG   LEU  50           HG       LEU  50  -2.196 -10.679  -0.882
  392   1HD1  LEU  50          1HD1      LEU  50  -2.264  -9.406   1.277
  393   2HD1  LEU  50          2HD1      LEU  50  -4.023  -9.495   1.187
  394   3HD1  LEU  50          3HD1      LEU  50  -3.116  -8.659  -0.074
  395   1HD2  LEU  50          1HD2      LEU  50  -2.113 -11.596   1.596
  396   2HD2  LEU  50          2HD2      LEU  50  -2.068 -12.678   0.202
  397   3HD2  LEU  50          3HD2      LEU  50  -3.581 -12.427   1.078
  398    H    LYS  51           H        LYS  51  -5.781 -10.391  -3.739
  399    HA   LYS  51           HA       LYS  51  -8.017 -12.086  -3.486
  400   1HB   LYS  51          2HB       LYS  51  -7.847  -9.624  -4.333
  401   2HB   LYS  51          1HB       LYS  51  -7.564 -10.361  -5.904
  402   1HG   LYS  51          2HG       LYS  51  -9.790 -10.258  -6.094
  403   2HG   LYS  51          1HG       LYS  51  -9.766 -11.713  -5.095
  404   1HD   LYS  51          2HD       LYS  51  -9.662  -9.195  -3.592
  405   2HD   LYS  51          1HD       LYS  51 -11.150  -9.443  -4.506
  406   1HE   LYS  51          2HE       LYS  51 -11.407 -11.649  -3.447
  407   2HE   LYS  51          1HE       LYS  51  -9.946 -11.353  -2.506
  408   1HZ   LYS  51          1HZ       LYS  51 -11.998 -10.881  -1.270
  409   2HZ   LYS  51          2HZ       LYS  51 -12.395  -9.677  -2.390
  410   3HZ   LYS  51          3HZ       LYS  51 -11.016  -9.511  -1.425
  411    H    ALA  52           H        ALA  52  -5.185 -12.223  -5.426
  412    HA   ALA  52           HA       ALA  52  -6.071 -14.737  -6.593
  413   1HB   ALA  52          1HB       ALA  52  -5.033 -12.447  -8.260
  414   2HB   ALA  52          2HB       ALA  52  -6.665 -13.114  -8.298
  415   3HB   ALA  52          3HB       ALA  52  -5.302 -14.090  -8.842
  416    H    LEU  53           H        LEU  53  -4.509 -15.348  -4.881
  417    HA   LEU  53           HA       LEU  53  -1.713 -14.793  -5.477
  418   1HB   LEU  53          2HB       LEU  53  -3.117 -15.174  -3.128
  419   2HB   LEU  53          1HB       LEU  53  -2.248 -16.686  -3.324
  420    HG   LEU  53           HG       LEU  53  -0.682 -14.191  -3.675
  421   1HD1  LEU  53          1HD1      LEU  53  -2.083 -14.933  -1.179
  422   2HD1  LEU  53          2HD1      LEU  53  -1.551 -13.354  -1.759
  423   3HD1  LEU  53          3HD1      LEU  53  -0.388 -14.466  -1.037
  424   1HD2  LEU  53          1HD2      LEU  53   1.063 -15.535  -3.234
  425   2HD2  LEU  53          2HD2      LEU  53  -0.074 -16.833  -3.603
  426   3HD2  LEU  53          3HD2      LEU  53   0.222 -16.369  -1.927
  427    HA   PRO  54           HA       PRO  54  -1.684 -18.596  -7.927
  428   1HB   PRO  54          2HB       PRO  54   1.170 -17.905  -8.227
  429   2HB   PRO  54          1HB       PRO  54  -0.059 -18.165  -9.468
  430   1HG   PRO  54          2HG       PRO  54   0.884 -15.716  -8.930
  431   2HG   PRO  54          1HG       PRO  54  -0.814 -15.983  -9.368
  432   1HD   PRO  54          2HD       PRO  54   0.397 -15.516  -6.669
  433   2HD   PRO  54          1HD       PRO  54  -1.110 -14.874  -7.354
  434    H    THR  55           H        THR  55   0.275 -20.330  -8.078
  435    HA   THR  55           HA       THR  55   1.611 -20.780  -5.569
  436    HB   THR  55           HB       THR  55   0.503 -23.010  -5.204
  437    HG1  THR  55           1HG      THR  55  -0.956 -23.636  -6.551
  438   1HG2  THR  55          1HG2      THR  55  -0.148 -20.831  -4.003
  439   2HG2  THR  55          2HG2      THR  55  -1.238 -22.215  -3.911
  440   3HG2  THR  55          3HG2      THR  55  -1.589 -20.887  -5.018
  441    H    GLU  56           H        GLU  56   2.338 -20.498  -8.352
  442    HA   GLU  56           HA       GLU  56   3.714 -23.069  -8.694
  443   1HB   GLU  56          2HB       GLU  56   1.874 -21.747 -10.565
  444   2HB   GLU  56          1HB       GLU  56   3.405 -22.225 -11.282
  445   1HG   GLU  56          2HG       GLU  56   1.666 -23.935 -11.526
  446   2HG   GLU  56          1HG       GLU  56   3.060 -24.511 -10.612
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1   6.217  24.476   4.561
    2   2H    MET   1          2HT       MET   1   4.541  24.353   4.224
    3   3H    MET   1          3HT       MET   1   5.487  22.938   4.446
    4    HA   MET   1           HA       MET   1   5.976  23.817   6.718
    5   1HB   MET   1          2HB       MET   1   4.084  25.787   5.623
    6   2HB   MET   1          1HB       MET   1   3.660  25.192   7.217
    7   1HG   MET   1          2HG       MET   1   6.429  26.144   6.653
    8   2HG   MET   1          1HG       MET   1   5.144  27.300   6.978
    9   1HE   MET   1          1HE       MET   1   7.760  25.262   9.823
   10   2HE   MET   1          2HE       MET   1   7.804  25.312   8.067
   11   3HE   MET   1          3HE       MET   1   6.965  24.004   8.889
   12    H    GLU   2           H        GLU   2   2.590  23.794   5.617
   13    HA   GLU   2           HA       GLU   2   2.053  21.548   7.385
   14   1HB   GLU   2          2HB       GLU   2   0.588  23.727   6.867
   15   2HB   GLU   2          1HB       GLU   2  -0.070  22.666   5.631
   16   1HG   GLU   2          2HG       GLU   2  -0.707  21.043   7.292
   17   2HG   GLU   2          1HG       GLU   2   0.064  22.000   8.560
   18    H    ALA   3           H        ALA   3   2.925  19.748   6.436
   19    HA   ALA   3           HA       ALA   3   1.423  18.444   4.444
   20   1HB   ALA   3          1HB       ALA   3   2.636  20.120   3.029
   21   2HB   ALA   3          2HB       ALA   3   2.893  18.435   2.573
   22   3HB   ALA   3          3HB       ALA   3   4.136  19.306   3.471
   23    H    VAL   4           H        VAL   4   1.484  16.519   5.413
   24    HA   VAL   4           HA       VAL   4   4.022  15.138   5.640
   25    HB   VAL   4           HB       VAL   4   3.457  14.386   8.000
   26   1HG1  VAL   4          1HG1      VAL   4   5.301  15.895   7.524
   27   2HG1  VAL   4          2HG1      VAL   4   4.502  16.350   9.024
   28   3HG1  VAL   4          3HG1      VAL   4   4.203  17.276   7.553
   29   1HG2  VAL   4          1HG2      VAL   4   1.102  15.516   7.692
   30   2HG2  VAL   4          2HG2      VAL   4   1.954  16.936   8.310
   31   3HG2  VAL   4          3HG2      VAL   4   1.885  15.458   9.277
   32    H    ASP   5           H        ASP   5   1.546  14.893   4.085
   33    HA   ASP   5           HA       ASP   5  -0.108  12.848   5.002
   34   1HB   ASP   5          2HB       ASP   5  -0.111  14.419   2.811
   35   2HB   ASP   5          1HB       ASP   5   0.473  12.921   2.097
   36    H    ALA   6           H        ALA   6   3.130  12.744   3.849
   37    HA   ALA   6           HA       ALA   6   3.347  10.211   2.766
   38   1HB   ALA   6          1HB       ALA   6   5.614  10.451   2.963
   39   2HB   ALA   6          2HB       ALA   6   5.508  11.166   4.569
   40   3HB   ALA   6          3HB       ALA   6   5.105  12.128   3.145
   41    H    ASN   7           H        ASN   7   2.998  11.167   6.109
   42    HA   ASN   7           HA       ASN   7   3.867   8.820   7.363
   43   1HB   ASN   7          2HB       ASN   7   1.851  10.916   8.159
   44   2HB   ASN   7          1HB       ASN   7   2.243   9.548   9.195
   45   1HD2  ASN   7          1HD2      ASN   7   3.508  12.410   7.637
   46   2HD2  ASN   7          2HD2      ASN   7   4.869  12.609   8.682
   47    H    SER   8           H        SER   8   0.626   9.758   6.244
   48    HA   SER   8           HA       SER   8  -0.608   7.323   7.024
   49   1HB   SER   8          2HB       SER   8  -1.558   9.757   6.278
   50   2HB   SER   8          1HB       SER   8  -1.827   8.839   4.796
   51    HG   SER   8           HG       SER   8  -2.862   7.242   6.214
   52    H    LEU   9           H        LEU   9   1.025   8.449   4.154
   53    HA   LEU   9           HA       LEU   9   0.152   6.443   2.368
   54   1HB   LEU   9          2HB       LEU   9   1.300   8.610   1.787
   55   2HB   LEU   9          1HB       LEU   9   2.802   7.884   2.322
   56    HG   LEU   9           HG       LEU   9   1.113   6.778   0.082
   57   1HD1  LEU   9          1HD1      LEU   9   2.907   7.716  -1.374
   58   2HD1  LEU   9          2HD1      LEU   9   3.484   8.616   0.028
   59   3HD1  LEU   9          3HD1      LEU   9   1.869   8.920  -0.611
   60   1HD2  LEU   9          1HD2      LEU   9   3.626   5.902  -0.335
   61   2HD2  LEU   9          2HD2      LEU   9   2.397   4.991   0.544
   62   3HD2  LEU   9          3HD2      LEU   9   3.589   5.947   1.428
   63    H    ALA  10           H        ALA  10   3.001   6.715   4.460
   64    HA   ALA  10           HA       ALA  10   4.231   4.306   3.676
   65   1HB   ALA  10          1HB       ALA  10   5.647   5.804   4.734
   66   2HB   ALA  10          2HB       ALA  10   5.385   4.571   5.969
   67   3HB   ALA  10          3HB       ALA  10   4.513   6.102   6.051
   68    H    GLN  11           H        GLN  11   1.534   4.899   5.726
   69    HA   GLN  11           HA       GLN  11   1.784   2.468   7.244
   70   1HB   GLN  11          2HB       GLN  11   0.712   4.291   8.340
   71   2HB   GLN  11          1HB       GLN  11  -0.391   4.535   6.992
   72   1HG   GLN  11          2HG       GLN  11  -1.367   2.332   7.452
   73   2HG   GLN  11          1HG       GLN  11  -0.342   2.193   8.874
   74   1HE2  GLN  11          1HE2      GLN  11  -1.962   2.157  10.363
   75   2HE2  GLN  11          2HE2      GLN  11  -2.999   3.505  10.689
   76    H    ALA  12           H        ALA  12  -0.144   3.601   4.499
   77    HA   ALA  12           HA       ALA  12  -1.875   1.474   4.203
   78   1HB   ALA  12          1HB       ALA  12  -0.617   2.461   1.722
   79   2HB   ALA  12          2HB       ALA  12  -1.373   3.673   2.762
   80   3HB   ALA  12          3HB       ALA  12  -2.325   2.319   2.150
   81    H    LYS  13           H        LYS  13   1.496   1.761   3.303
   82    HA   LYS  13           HA       LYS  13   1.575  -0.918   2.172
   83   1HB   LYS  13          2HB       LYS  13   4.160  -0.220   2.210
   84   2HB   LYS  13          1HB       LYS  13   3.056   0.278   0.944
   85   1HG   LYS  13          2HG       LYS  13   2.899   2.434   1.729
   86   2HG   LYS  13          1HG       LYS  13   3.445   1.984   3.351
   87   1HD   LYS  13          2HD       LYS  13   5.652   2.015   2.758
   88   2HD   LYS  13          1HD       LYS  13   5.319   1.523   1.096
   89   1HE   LYS  13          2HE       LYS  13   5.233   3.635   0.379
   90   2HE   LYS  13          1HE       LYS  13   4.222   4.137   1.732
   91   1HZ   LYS  13          1HZ       LYS  13   7.001   3.598   2.370
   92   2HZ   LYS  13          2HZ       LYS  13   5.989   4.844   2.903
   93   3HZ   LYS  13          3HZ       LYS  13   6.730   4.948   1.387
   94    H    GLU  14           H        GLU  14   3.223   0.835   4.819
   95    HA   GLU  14           HA       GLU  14   4.574  -1.243   6.002
   96   1HB   GLU  14          2HB       GLU  14   3.328   1.264   7.022
   97   2HB   GLU  14          1HB       GLU  14   3.778   0.058   8.218
   98   1HG   GLU  14          2HG       GLU  14   5.498   1.818   7.754
   99   2HG   GLU  14          1HG       GLU  14   6.055   0.153   7.612
  100    H    ALA  15           H        ALA  15   1.191  -0.418   6.128
  101    HA   ALA  15           HA       ALA  15   0.551  -2.542   8.007
  102   1HB   ALA  15          1HB       ALA  15  -1.576  -1.660   8.106
  103   2HB   ALA  15          2HB       ALA  15  -1.524  -1.070   6.444
  104   3HB   ALA  15          3HB       ALA  15  -0.627  -0.228   7.708
  105    H    ALA  16           H        ALA  16  -0.039  -1.822   4.571
  106    HA   ALA  16           HA       ALA  16  -1.492  -4.112   3.925
  107   1HB   ALA  16          1HB       ALA  16  -1.466  -2.400   2.321
  108   2HB   ALA  16          2HB       ALA  16  -0.563  -3.723   1.584
  109   3HB   ALA  16          3HB       ALA  16   0.295  -2.348   2.277
  110    H    ILE  17           H        ILE  17   1.931  -3.665   4.408
  111    HA   ILE  17           HA       ILE  17   2.631  -6.194   3.209
  112    HB   ILE  17           HB       ILE  17   4.898  -5.750   3.912
  113   1HG1  ILE  17          2HG1      ILE  17   3.736  -3.399   5.423
  114   2HG1  ILE  17          1HG1      ILE  17   4.475  -4.828   6.134
  115   1HG2  ILE  17          1HG2      ILE  17   4.480  -4.669   1.916
  116   2HG2  ILE  17          2HG2      ILE  17   5.094  -3.356   2.919
  117   3HG2  ILE  17          3HG2      ILE  17   3.359  -3.522   2.649
  118   1HD1  ILE  17          1HD1      ILE  17   6.617  -4.206   5.404
  119   2HD1  ILE  17          2HD1      ILE  17   5.886  -2.733   6.041
  120   3HD1  ILE  17          3HD1      ILE  17   5.976  -2.991   4.298
  121    H    LYS  18           H        LYS  18   1.827  -4.976   6.368
  122    HA   LYS  18           HA       LYS  18   2.912  -6.945   8.011
  123   1HB   LYS  18          2HB       LYS  18   1.314  -4.774   8.411
  124   2HB   LYS  18          1HB       LYS  18   0.170  -6.080   8.690
  125   1HG   LYS  18          2HG       LYS  18   1.041  -5.606  10.798
  126   2HG   LYS  18          1HG       LYS  18   1.922  -7.044  10.277
  127   1HD   LYS  18          2HD       LYS  18   3.682  -5.785  10.994
  128   2HD   LYS  18          1HD       LYS  18   3.591  -5.209   9.328
  129   1HE   LYS  18          2HE       LYS  18   3.750  -3.259  10.608
  130   2HE   LYS  18          1HE       LYS  18   2.032  -3.396  10.233
  131   1HZ   LYS  18          1HZ       LYS  18   3.407  -3.874  12.795
  132   2HZ   LYS  18          2HZ       LYS  18   1.916  -4.606  12.482
  133   3HZ   LYS  18          3HZ       LYS  18   2.049  -2.921  12.474
  134    H    GLU  19           H        GLU  19   0.184  -7.021   5.856
  135    HA   GLU  19           HA       GLU  19  -0.733  -9.597   6.834
  136   1HB   GLU  19          2HB       GLU  19  -1.886  -7.480   5.342
  137   2HB   GLU  19          1HB       GLU  19  -1.865  -8.886   4.284
  138   1HG   GLU  19          2HG       GLU  19  -3.589  -9.775   5.345
  139   2HG   GLU  19          1HG       GLU  19  -2.764  -9.645   6.898
  140    H    LEU  20           H        LEU  20   1.146  -8.229   4.252
  141    HA   LEU  20           HA       LEU  20   1.287 -10.534   2.611
  142   1HB   LEU  20          2HB       LEU  20   1.899  -8.031   2.151
  143   2HB   LEU  20          1HB       LEU  20   3.475  -8.503   2.755
  144    HG   LEU  20           HG       LEU  20   2.669 -10.431   0.824
  145   1HD1  LEU  20          1HD1      LEU  20   2.614  -7.630  -0.273
  146   2HD1  LEU  20          2HD1      LEU  20   1.161  -8.572   0.062
  147   3HD1  LEU  20          3HD1      LEU  20   2.322  -9.138  -1.135
  148   1HD2  LEU  20          1HD2      LEU  20   4.962  -9.762   1.514
  149   2HD2  LEU  20          2HD2      LEU  20   4.737  -8.266   0.611
  150   3HD2  LEU  20          3HD2      LEU  20   4.720  -9.813  -0.232
  151    H    LYS  21           H        LYS  21   3.034  -9.420   5.418
  152    HA   LYS  21           HA       LYS  21   5.085 -11.451   5.147
  153   1HB   LYS  21          2HB       LYS  21   6.040 -10.508   7.169
  154   2HB   LYS  21          1HB       LYS  21   5.659  -9.220   6.035
  155   1HG   LYS  21          2HG       LYS  21   4.785  -8.257   7.868
  156   2HG   LYS  21          1HG       LYS  21   3.387  -9.251   7.455
  157   1HD   LYS  21          2HD       LYS  21   4.195 -10.998   8.983
  158   2HD   LYS  21          1HD       LYS  21   5.568  -9.975   9.411
  159   1HE   LYS  21          2HE       LYS  21   3.456  -8.296   9.834
  160   2HE   LYS  21          1HE       LYS  21   2.776  -9.857  10.294
  161   1HZ   LYS  21          1HZ       LYS  21   4.146  -8.344  11.966
  162   2HZ   LYS  21          2HZ       LYS  21   5.432  -9.233  11.318
  163   3HZ   LYS  21          3HZ       LYS  21   4.143 -10.034  12.066
  164    H    GLN  22           H        GLN  22   2.153 -10.855   6.998
  165    HA   GLN  22           HA       GLN  22   2.568 -13.060   8.788
  166   1HB   GLN  22          2HB       GLN  22   0.552 -12.482   9.766
  167   2HB   GLN  22          1HB       GLN  22   1.065 -10.944   9.089
  168   1HG   GLN  22          2HG       GLN  22  -0.377 -11.449   7.101
  169   2HG   GLN  22          1HG       GLN  22  -1.000 -12.835   7.993
  170   1HE2  GLN  22          1HE2      GLN  22  -0.245  -9.485   8.896
  171   2HE2  GLN  22          2HE2      GLN  22  -1.801  -9.133   9.559
  172    H    TYR  23           H        TYR  23   1.159 -12.610   5.651
  173    HA   TYR  23           HA       TYR  23  -0.268 -15.103   5.600
  174   1HB   TYR  23          2HB       TYR  23   0.314 -12.912   3.663
  175   2HB   TYR  23          1HB       TYR  23  -0.126 -14.491   3.011
  176    HD1  TYR  23           1HD      TYR  23  -2.164 -15.473   4.782
  177    HD2  TYR  23           2HD      TYR  23  -1.478 -11.498   3.443
  178    HE1  TYR  23           1HE      TYR  23  -4.539 -14.954   5.127
  179    HE2  TYR  23           2HE      TYR  23  -3.847 -10.965   3.782
  180    HH   TYR  23           HH       TYR  23  -5.755 -11.742   5.022
  181    H    GLY  24           H        GLY  24   2.812 -13.885   4.384
  182   1HA   GLY  24          2HA       GLY  24   4.723 -15.370   4.342
  183   2HA   GLY  24          1HA       GLY  24   3.631 -16.680   3.920
  184    H    ILE  25           H        ILE  25   2.584 -14.091   2.176
  185    HA   ILE  25           HA       ILE  25   3.186 -15.088  -0.311
  186    HB   ILE  25           HB       ILE  25   3.262 -12.169  -0.387
  187   1HG1  ILE  25          2HG1      ILE  25   0.986 -13.519   1.082
  188   2HG1  ILE  25          1HG1      ILE  25   2.040 -12.249   1.698
  189   1HG2  ILE  25          1HG2      ILE  25   1.126 -14.038  -1.373
  190   2HG2  ILE  25          2HG2      ILE  25   2.662 -13.810  -2.210
  191   3HG2  ILE  25          3HG2      ILE  25   1.562 -12.448  -1.998
  192   1HD1  ILE  25          1HD1      ILE  25   0.046 -11.168   1.171
  193   2HD1  ILE  25          2HD1      ILE  25  -0.137 -12.048  -0.347
  194   3HD1  ILE  25          3HD1      ILE  25   1.109 -10.811  -0.190
  195    H    GLY  26           H        GLY  26   4.603 -13.945  -2.043
  196   1HA   GLY  26          2HA       GLY  26   7.308 -14.266  -1.235
  197   2HA   GLY  26          1HA       GLY  26   6.754 -13.720  -2.813
  198    H    ASP  27           H        ASP  27   8.987 -12.799  -1.120
  199    HA   ASP  27           HA       ASP  27   8.432 -10.324   0.066
  200   1HB   ASP  27          2HB       ASP  27  10.881 -11.651  -1.002
  201   2HB   ASP  27          1HB       ASP  27  10.958  -9.924  -0.664
  202    H    TYR  28           H        TYR  28   8.641 -11.264  -3.232
  203    HA   TYR  28           HA       TYR  28   9.409  -9.017  -4.609
  204   1HB   TYR  28          2HB       TYR  28   8.358 -11.367  -5.365
  205   2HB   TYR  28          1HB       TYR  28   6.920 -10.364  -5.539
  206    HD1  TYR  28           1HD      TYR  28   6.558  -9.841  -7.745
  207    HD2  TYR  28           2HD      TYR  28  10.537  -9.776  -6.249
  208    HE1  TYR  28           1HE      TYR  28   7.352  -9.007  -9.914
  209    HE2  TYR  28           2HE      TYR  28  11.344  -8.945  -8.409
  210    HH   TYR  28           HH       TYR  28  10.219  -7.582 -10.400
  211    H    TYR  29           H        TYR  29   6.247  -9.749  -3.277
  212    HA   TYR  29           HA       TYR  29   4.973  -7.403  -4.209
  213   1HB   TYR  29          2HB       TYR  29   4.058  -9.180  -1.953
  214   2HB   TYR  29          1HB       TYR  29   3.061  -8.202  -3.029
  215    HD1  TYR  29           1HD      TYR  29   3.005 -11.298  -2.496
  216    HD2  TYR  29           2HD      TYR  29   4.673  -8.859  -5.572
  217    HE1  TYR  29           1HE      TYR  29   2.868 -13.190  -4.062
  218    HE2  TYR  29           2HE      TYR  29   4.544 -10.754  -7.139
  219    HH   TYR  29           HH       TYR  29   3.338 -12.824  -7.435
  220    H    ILE  30           H        ILE  30   6.032  -8.276  -0.879
  221    HA   ILE  30           HA       ILE  30   5.257  -5.915   0.360
  222    HB   ILE  30           HB       ILE  30   6.187  -7.768   1.620
  223   1HG1  ILE  30          2HG1      ILE  30   6.331  -5.392   2.496
  224   2HG1  ILE  30          1HG1      ILE  30   7.419  -6.552   3.243
  225   1HG2  ILE  30          1HG2      ILE  30   8.652  -8.137   1.625
  226   2HG2  ILE  30          2HG2      ILE  30   8.741  -7.086   0.211
  227   3HG2  ILE  30          3HG2      ILE  30   7.821  -8.587   0.135
  228   1HD1  ILE  30          1HD1      ILE  30   9.059  -5.127   2.849
  229   2HD1  ILE  30          2HD1      ILE  30   8.007  -4.107   1.869
  230   3HD1  ILE  30          3HD1      ILE  30   8.860  -5.459   1.129
  231    H    LYS  31           H        LYS  31   7.823  -6.561  -1.866
  232    HA   LYS  31           HA       LYS  31   9.125  -4.003  -1.526
  233   1HB   LYS  31          2HB       LYS  31   9.526  -6.276  -3.462
  234   2HB   LYS  31          1HB       LYS  31  10.492  -4.806  -3.478
  235   1HG   LYS  31          2HG       LYS  31  10.277  -6.458  -0.994
  236   2HG   LYS  31          1HG       LYS  31  11.412  -6.890  -2.277
  237   1HD   LYS  31          2HD       LYS  31  12.775  -5.543  -1.050
  238   2HD   LYS  31          1HD       LYS  31  12.022  -4.308  -2.060
  239   1HE   LYS  31          2HE       LYS  31  10.257  -4.543   0.031
  240   2HE   LYS  31          1HE       LYS  31  11.819  -4.765   0.818
  241   1HZ   LYS  31          1HZ       LYS  31  12.473  -2.680  -0.517
  242   2HZ   LYS  31          2HZ       LYS  31  11.527  -2.492   0.872
  243   3HZ   LYS  31          3HZ       LYS  31  10.807  -2.424  -0.656
  244    H    LEU  32           H        LEU  32   7.299  -5.673  -4.091
  245    HA   LEU  32           HA       LEU  32   7.279  -3.629  -5.945
  246   1HB   LEU  32          2HB       LEU  32   6.054  -5.075  -7.147
  247   2HB   LEU  32          1HB       LEU  32   6.233  -6.156  -5.789
  248    HG   LEU  32           HG       LEU  32   3.959  -6.196  -6.345
  249   1HD1  LEU  32          1HD1      LEU  32   3.385  -4.336  -4.275
  250   2HD1  LEU  32          2HD1      LEU  32   4.907  -5.162  -3.923
  251   3HD1  LEU  32          3HD1      LEU  32   3.434  -6.100  -4.204
  252   1HD2  LEU  32          1HD2      LEU  32   2.759  -4.489  -7.187
  253   2HD2  LEU  32          2HD2      LEU  32   4.333  -3.741  -7.452
  254   3HD2  LEU  32          3HD2      LEU  32   3.395  -3.336  -6.016
  255    H    ILE  33           H        ILE  33   5.763  -3.755  -2.919
  256    HA   ILE  33           HA       ILE  33   3.639  -1.890  -3.440
  257    HB   ILE  33           HB       ILE  33   4.779  -3.212  -1.002
  258   1HG1  ILE  33          2HG1      ILE  33   2.142  -3.170  -2.444
  259   2HG1  ILE  33          1HG1      ILE  33   3.203  -4.539  -2.132
  260   1HG2  ILE  33          1HG2      ILE  33   4.158  -1.628   0.415
  261   2HG2  ILE  33          2HG2      ILE  33   2.521  -1.657  -0.233
  262   3HG2  ILE  33          3HG2      ILE  33   3.725  -0.588  -0.938
  263   1HD1  ILE  33          1HD1      ILE  33   2.353  -3.427   0.357
  264   2HD1  ILE  33          2HD1      ILE  33   2.065  -5.034  -0.308
  265   3HD1  ILE  33          3HD1      ILE  33   0.953  -3.715  -0.675
  266    H    ASN  34           H        ASN  34   6.634  -1.749  -1.507
  267    HA   ASN  34           HA       ASN  34   6.586   0.936  -0.874
  268   1HB   ASN  34          2HB       ASN  34   8.356  -1.168  -0.528
  269   2HB   ASN  34          1HB       ASN  34   9.284  -0.001  -1.465
  270   1HD2  ASN  34          1HD2      ASN  34   7.247  -0.304   1.404
  271   2HD2  ASN  34          2HD2      ASN  34   8.061   0.909   2.327
  272    H    ASN  35           H        ASN  35   7.247  -0.524  -3.941
  273    HA   ASN  35           HA       ASN  35   8.737   1.626  -5.063
  274   1HB   ASN  35          2HB       ASN  35   7.348  -0.786  -6.170
  275   2HB   ASN  35          1HB       ASN  35   7.939   0.462  -7.262
  276   1HD2  ASN  35          1HD2      ASN  35   9.898   0.156  -8.007
  277   2HD2  ASN  35          2HD2      ASN  35  11.157  -0.740  -7.236
  278    H    ALA  36           H        ALA  36   5.342   1.050  -4.620
  279    HA   ALA  36           HA       ALA  36   4.214   2.533  -6.660
  280   1HB   ALA  36          1HB       ALA  36   2.415   1.820  -5.586
  281   2HB   ALA  36          2HB       ALA  36   2.667   3.096  -4.393
  282   3HB   ALA  36          3HB       ALA  36   3.359   1.496  -4.132
  283    H    LYS  37           H        LYS  37   3.598   4.657  -6.943
  284    HA   LYS  37           HA       LYS  37   5.178   6.601  -5.413
  285   1HB   LYS  37          2HB       LYS  37   3.738   7.180  -7.990
  286   2HB   LYS  37          1HB       LYS  37   5.118   8.011  -7.288
  287   1HG   LYS  37          2HG       LYS  37   6.233   6.856  -8.865
  288   2HG   LYS  37          1HG       LYS  37   6.211   5.600  -7.628
  289   1HD   LYS  37          2HD       LYS  37   3.830   5.167  -8.857
  290   2HD   LYS  37          1HD       LYS  37   4.806   5.746 -10.207
  291   1HE   LYS  37          2HE       LYS  37   5.620   3.521  -8.343
  292   2HE   LYS  37          1HE       LYS  37   4.848   3.274  -9.908
  293   1HZ   LYS  37          1HZ       LYS  37   7.478   3.319  -9.568
  294   2HZ   LYS  37          2HZ       LYS  37   7.218   4.956  -9.905
  295   3HZ   LYS  37          3HZ       LYS  37   6.728   3.777 -11.014
  296    H    THR  38           H        THR  38   2.420   5.354  -4.833
  297    HA   THR  38           HA       THR  38   1.191   7.840  -3.950
  298    HB   THR  38           HB       THR  38  -0.964   7.359  -4.861
  299    HG1  THR  38           1HG      THR  38  -1.389   5.446  -5.974
  300   1HG2  THR  38          1HG2      THR  38   1.117   6.849  -6.968
  301   2HG2  THR  38          2HG2      THR  38   0.381   8.392  -6.534
  302   3HG2  THR  38          3HG2      THR  38  -0.590   7.137  -7.303
  303    H    VAL  39           H        VAL  39  -1.282   6.248  -3.225
  304    HA   VAL  39           HA       VAL  39  -0.132   4.370  -1.320
  305    HB   VAL  39           HB       VAL  39  -0.533   6.764  -0.341
  306   1HG1  VAL  39          1HG1      VAL  39  -2.905   6.873  -0.976
  307   2HG1  VAL  39          2HG1      VAL  39  -2.658   6.982   0.769
  308   3HG1  VAL  39          3HG1      VAL  39  -3.217   5.472   0.047
  309   1HG2  VAL  39          1HG2      VAL  39   0.355   5.231   1.088
  310   2HG2  VAL  39          2HG2      VAL  39  -0.901   4.046   0.754
  311   3HG2  VAL  39          3HG2      VAL  39  -1.245   5.412   1.812
  312    H    GLU  40           H        GLU  40  -3.154   5.730  -2.604
  313    HA   GLU  40           HA       GLU  40  -4.938   3.843  -1.702
  314   1HB   GLU  40          2HB       GLU  40  -5.257   5.966  -3.216
  315   2HB   GLU  40          1HB       GLU  40  -5.157   4.798  -4.526
  316   1HG   GLU  40          2HG       GLU  40  -6.970   3.911  -2.462
  317   2HG   GLU  40          1HG       GLU  40  -7.409   5.501  -3.070
  318    H    GLY  41           H        GLY  41  -2.723   3.614  -4.428
  319   1HA   GLY  41          2HA       GLY  41  -3.745   1.030  -5.232
  320   2HA   GLY  41          1HA       GLY  41  -2.353   1.862  -5.912
  321    H    VAL  42           H        VAL  42  -1.206   2.269  -3.202
  322    HA   VAL  42           HA       VAL  42   0.498   0.062  -3.111
  323    HB   VAL  42           HB       VAL  42  -0.118   1.947  -0.839
  324   1HG1  VAL  42          1HG1      VAL  42   1.918  -0.144  -1.349
  325   2HG1  VAL  42          2HG1      VAL  42   1.115   0.312   0.158
  326   3HG1  VAL  42          3HG1      VAL  42   2.423   1.313  -0.488
  327   1HG2  VAL  42          1HG2      VAL  42   2.212   2.216  -2.687
  328   2HG2  VAL  42          2HG2      VAL  42   1.448   3.431  -1.670
  329   3HG2  VAL  42          3HG2      VAL  42   0.650   2.891  -3.146
  330    H    GLU  43           H        GLU  43  -2.178   0.883  -0.907
  331    HA   GLU  43           HA       GLU  43  -1.964  -1.505   0.609
  332   1HB   GLU  43          2HB       GLU  43  -4.451  -0.836   1.183
  333   2HB   GLU  43          1HB       GLU  43  -3.099   0.112   1.788
  334   1HG   GLU  43          2HG       GLU  43  -3.442   1.813   0.216
  335   2HG   GLU  43          1HG       GLU  43  -4.500   0.802  -0.770
  336    H    SER  44           H        SER  44  -4.166  -0.535  -2.000
  337    HA   SER  44           HA       SER  44  -5.584  -2.982  -2.080
  338   1HB   SER  44          2HB       SER  44  -6.750  -2.056  -3.839
  339   2HB   SER  44          1HB       SER  44  -6.082  -0.588  -3.122
  340    HG   SER  44           HG       SER  44  -5.170  -2.003  -5.398
  341    H    LEU  45           H        LEU  45  -2.530  -1.969  -3.293
  342    HA   LEU  45           HA       LEU  45  -2.162  -3.668  -5.475
  343   1HB   LEU  45          2HB       LEU  45  -0.470  -2.142  -3.639
  344   2HB   LEU  45          1HB       LEU  45   0.321  -3.561  -4.284
  345   1HD1  LEU  45          1HD1      LEU  45   1.215  -3.699  -6.071
  346   2HD1  LEU  45          2HD1      LEU  45   1.941  -2.111  -6.324
  347   3HD1  LEU  45          3HD1      LEU  45   0.830  -2.773  -7.522
  348   1HD2  LEU  45          1HD2      LEU  45  -1.173  -1.003  -7.276
  349   2HD2  LEU  45          2HD2      LEU  45  -2.212  -1.790  -6.091
  350   3HD2  LEU  45          3HD2      LEU  45  -1.389  -2.752  -7.316
  351    H    LYS  46           H        LYS  46  -1.060  -4.244  -2.119
  352    HA   LYS  46           HA       LYS  46  -0.409  -6.959  -2.640
  353   1HB   LYS  46          2HB       LYS  46   0.781  -6.397  -0.819
  354   2HB   LYS  46          1HB       LYS  46  -0.343  -5.138  -0.334
  355   1HG   LYS  46          2HG       LYS  46  -1.035  -8.023   0.109
  356   2HG   LYS  46          1HG       LYS  46   0.076  -7.189   1.202
  357   1HD   LYS  46          2HD       LYS  46  -1.678  -5.410   1.478
  358   2HD   LYS  46          1HD       LYS  46  -2.784  -6.458   0.594
  359   1HE   LYS  46          2HE       LYS  46  -2.937  -7.972   2.292
  360   2HE   LYS  46          1HE       LYS  46  -1.324  -7.608   2.906
  361   1HZ   LYS  46          1HZ       LYS  46  -2.092  -5.934   4.186
  362   2HZ   LYS  46          2HZ       LYS  46  -3.537  -6.809   4.109
  363   3HZ   LYS  46          3HZ       LYS  46  -3.300  -5.478   3.093
  364    H    ASN  47           H        ASN  47  -3.198  -5.405  -1.067
  365    HA   ASN  47           HA       ASN  47  -4.527  -7.774  -0.356
  366   1HB   ASN  47          2HB       ASN  47  -5.104  -5.395   0.363
  367   2HB   ASN  47          1HB       ASN  47  -5.918  -5.220  -1.189
  368   1HD2  ASN  47          1HD2      ASN  47  -7.996  -5.636  -1.184
  369   2HD2  ASN  47          2HD2      ASN  47  -8.831  -6.660  -0.070
  370    H    GLU  48           H        GLU  48  -4.188  -6.150  -3.399
  371    HA   GLU  48           HA       GLU  48  -6.333  -7.578  -4.693
  372   1HB   GLU  48          2HB       GLU  48  -5.690  -5.371  -5.520
  373   2HB   GLU  48          1HB       GLU  48  -4.058  -5.942  -5.839
  374   1HG   GLU  48          2HG       GLU  48  -4.751  -7.271  -7.636
  375   2HG   GLU  48          1HG       GLU  48  -6.445  -7.184  -7.157
  376    H    ILE  49           H        ILE  49  -2.859  -7.858  -4.346
  377    HA   ILE  49           HA       ILE  49  -2.471  -9.956  -6.213
  378    HB   ILE  49           HB       ILE  49  -0.313 -10.269  -5.258
  379   1HG1  ILE  49          2HG1      ILE  49  -0.655  -8.496  -2.929
  380   2HG1  ILE  49          1HG1      ILE  49  -1.447 -10.055  -2.800
  381   1HG2  ILE  49          1HG2      ILE  49  -0.192  -7.482  -4.612
  382   2HG2  ILE  49          2HG2      ILE  49  -1.255  -7.745  -5.994
  383   3HG2  ILE  49          3HG2      ILE  49   0.408  -8.330  -6.037
  384   1HD1  ILE  49          1HD1      ILE  49   0.665 -11.161  -3.182
  385   2HD1  ILE  49          2HD1      ILE  49   0.759 -10.046  -1.816
  386   3HD1  ILE  49          3HD1      ILE  49   1.459  -9.597  -3.371
  387    H    LEU  50           H        LEU  50  -3.598  -9.783  -2.962
  388    HA   LEU  50           HA       LEU  50  -3.363 -12.596  -2.412
  389   1HB   LEU  50          2HB       LEU  50  -4.687 -10.296  -0.978
  390   2HB   LEU  50          1HB       LEU  50  -4.707 -11.942  -0.366
  391    HG   LEU  50           HG       LEU  50  -2.038 -10.873  -1.024
  392   1HD1  LEU  50          1HD1      LEU  50  -1.929  -9.641   1.137
  393   2HD1  LEU  50          2HD1      LEU  50  -3.687  -9.755   1.229
  394   3HD1  LEU  50          3HD1      LEU  50  -2.928  -8.871  -0.095
  395   1HD2  LEU  50          1HD2      LEU  50  -1.877 -12.907  -0.004
  396   2HD2  LEU  50          2HD2      LEU  50  -3.312 -12.650   0.989
  397   3HD2  LEU  50          3HD2      LEU  50  -1.795 -11.858   1.411
  398    H    LYS  51           H        LYS  51  -5.806 -10.365  -3.559
  399    HA   LYS  51           HA       LYS  51  -8.058 -12.029  -3.248
  400   1HB   LYS  51          2HB       LYS  51  -8.177  -9.607  -3.772
  401   2HB   LYS  51          1HB       LYS  51  -7.548  -9.941  -5.380
  402   1HG   LYS  51          2HG       LYS  51  -9.566 -11.476  -5.660
  403   2HG   LYS  51          1HG       LYS  51 -10.210 -10.686  -4.220
  404   1HD   LYS  51          2HD       LYS  51 -11.117  -9.427  -5.948
  405   2HD   LYS  51          1HD       LYS  51  -9.696  -8.488  -5.484
  406   1HE   LYS  51          2HE       LYS  51  -8.679 -10.200  -7.364
  407   2HE   LYS  51          1HE       LYS  51 -10.300  -9.884  -7.983
  408   1HZ   LYS  51          1HZ       LYS  51  -8.598  -8.306  -8.787
  409   2HZ   LYS  51          2HZ       LYS  51  -8.374  -7.765  -7.200
  410   3HZ   LYS  51          3HZ       LYS  51  -9.868  -7.548  -7.965
  411    H    ALA  52           H        ALA  52  -5.380 -12.133  -5.383
  412    HA   ALA  52           HA       ALA  52  -6.465 -14.497  -6.675
  413   1HB   ALA  52          1HB       ALA  52  -5.449 -12.132  -8.249
  414   2HB   ALA  52          2HB       ALA  52  -7.117 -12.707  -8.189
  415   3HB   ALA  52          3HB       ALA  52  -5.865 -13.709  -8.924
  416    H    LEU  53           H        LEU  53  -4.672 -14.849  -4.868
  417    HA   LEU  53           HA       LEU  53  -1.980 -14.410  -5.408
  418   1HB   LEU  53          2HB       LEU  53  -3.536 -15.969  -3.567
  419   2HB   LEU  53          1HB       LEU  53  -2.179 -16.923  -4.134
  420    HG   LEU  53           HG       LEU  53  -1.755 -14.136  -3.111
  421   1HD1  LEU  53          1HD1      LEU  53  -3.063 -15.596  -1.469
  422   2HD1  LEU  53          2HD1      LEU  53  -1.568 -14.857  -0.896
  423   3HD1  LEU  53          3HD1      LEU  53  -1.590 -16.560  -1.353
  424   1HD2  LEU  53          1HD2      LEU  53  -0.115 -16.484  -3.813
  425   2HD2  LEU  53          2HD2      LEU  53   0.376 -15.599  -2.368
  426   3HD2  LEU  53          3HD2      LEU  53   0.257 -14.763  -3.916
  427    HA   PRO  54           HA       PRO  54  -1.719 -18.805  -7.469
  428   1HB   PRO  54          2HB       PRO  54  -4.134 -19.848  -8.279
  429   2HB   PRO  54          1HB       PRO  54  -3.317 -20.278  -6.772
  430   1HG   PRO  54          2HG       PRO  54  -5.547 -18.340  -7.235
  431   2HG   PRO  54          1HG       PRO  54  -5.325 -19.501  -5.911
  432   1HD   PRO  54          2HD       PRO  54  -4.801 -16.887  -5.597
  433   2HD   PRO  54          1HD       PRO  54  -3.821 -18.134  -4.799
  434    H    THR  55           H        THR  55  -1.157 -18.785  -9.561
  435    HA   THR  55           HA       THR  55  -1.858 -16.680 -11.262
  436    HB   THR  55           HB       THR  55  -0.842 -19.321 -12.280
  437    HG1  THR  55           1HG      THR  55   0.548 -17.396 -10.744
  438   1HG2  THR  55          1HG2      THR  55   0.728 -17.608 -13.462
  439   2HG2  THR  55          2HG2      THR  55  -0.578 -16.477 -13.108
  440   3HG2  THR  55          3HG2      THR  55  -0.894 -17.914 -14.081
  441    H    GLU  56           H        GLU  56  -3.531 -16.341 -12.570
  442    HA   GLU  56           HA       GLU  56  -5.341 -18.598 -13.119
  443   1HB   GLU  56          2HB       GLU  56  -5.919 -15.639 -12.914
  444   2HB   GLU  56          1HB       GLU  56  -7.093 -16.837 -13.439
  445   1HG   GLU  56          2HG       GLU  56  -6.297 -17.920 -11.098
  446   2HG   GLU  56          1HG       GLU  56  -6.107 -16.203 -10.748
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1  -5.368  12.717   9.815
    2   2H    MET   1          2HT       MET   1  -5.195  11.925   8.302
    3   3H    MET   1          3HT       MET   1  -6.354  11.365   9.435
    4    HA   MET   1           HA       MET   1  -7.582  12.514   7.911
    5   1HB   MET   1          2HB       MET   1  -6.948  13.875  10.461
    6   2HB   MET   1          1HB       MET   1  -7.833  14.834   9.280
    7   1HG   MET   1          2HG       MET   1  -9.729  13.717   9.634
    8   2HG   MET   1          1HG       MET   1  -8.918  12.147   9.611
    9   1HE   MET   1          1HE       MET   1  -7.200  11.950  12.809
   10   2HE   MET   1          2HE       MET   1  -7.611  11.242  11.248
   11   3HE   MET   1          3HE       MET   1  -8.579  10.870  12.673
   12    H    GLU   2           H        GLU   2  -4.940  14.670   8.953
   13    HA   GLU   2           HA       GLU   2  -4.152  15.343   6.336
   14   1HB   GLU   2          2HB       GLU   2  -4.902  17.749   6.387
   15   2HB   GLU   2          1HB       GLU   2  -6.177  16.573   6.110
   16   1HG   GLU   2          2HG       GLU   2  -7.017  16.818   8.292
   17   2HG   GLU   2          1HG       GLU   2  -5.582  17.681   8.837
   18    H    ALA   3           H        ALA   3  -2.121  16.040   6.451
   19    HA   ALA   3           HA       ALA   3  -1.137  17.938   8.267
   20   1HB   ALA   3          1HB       ALA   3   0.176  15.431   9.037
   21   2HB   ALA   3          2HB       ALA   3  -1.496  15.574   9.556
   22   3HB   ALA   3          3HB       ALA   3  -0.319  16.806  10.023
   23    H    VAL   4           H        VAL   4   0.284  14.883   7.128
   24    HA   VAL   4           HA       VAL   4   2.089  16.466   5.421
   25    HB   VAL   4           HB       VAL   4   3.703  14.504   5.750
   26   1HG1  VAL   4          1HG1      VAL   4   4.188  15.476   8.201
   27   2HG1  VAL   4          2HG1      VAL   4   3.070  16.707   7.613
   28   3HG1  VAL   4          3HG1      VAL   4   4.555  16.369   6.721
   29   1HG2  VAL   4          1HG2      VAL   4   3.476  13.300   7.882
   30   2HG2  VAL   4          2HG2      VAL   4   2.151  12.951   6.776
   31   3HG2  VAL   4          3HG2      VAL   4   1.902  14.058   8.126
   32    H    ASP   5           H        ASP   5   0.237  13.522   5.817
   33    HA   ASP   5           HA       ASP   5  -0.834  12.253   4.245
   34   1HB   ASP   5          2HB       ASP   5  -0.185  14.467   2.721
   35   2HB   ASP   5          1HB       ASP   5   0.575  13.146   1.840
   36    H    ALA   6           H        ALA   6   2.626  12.824   3.659
   37    HA   ALA   6           HA       ALA   6   3.219  10.389   2.435
   38   1HB   ALA   6          1HB       ALA   6   5.013  11.752   2.247
   39   2HB   ALA   6          2HB       ALA   6   5.527  10.899   3.704
   40   3HB   ALA   6          3HB       ALA   6   4.761  12.488   3.831
   41    H    ASN   7           H        ASN   7   2.843  11.237   5.817
   42    HA   ASN   7           HA       ASN   7   3.976   8.914   6.937
   43   1HB   ASN   7          2HB       ASN   7   3.023  11.231   7.965
   44   2HB   ASN   7          1HB       ASN   7   1.701  10.143   8.374
   45   1HD2  ASN   7          1HD2      ASN   7   3.440  11.456  10.198
   46   2HD2  ASN   7          2HD2      ASN   7   4.298  10.239  11.068
   47    H    SER   8           H        SER   8   0.623   9.740   6.105
   48    HA   SER   8           HA       SER   8  -0.496   7.285   6.942
   49   1HB   SER   8          2HB       SER   8  -1.550   9.655   6.175
   50   2HB   SER   8          1HB       SER   8  -1.812   8.717   4.705
   51    HG   SER   8           HG       SER   8  -3.540   8.595   6.276
   52    H    LEU   9           H        LEU   9   1.008   8.348   3.979
   53    HA   LEU   9           HA       LEU   9   0.135   6.255   2.299
   54   1HB   LEU   9          2HB       LEU   9   1.187   8.426   1.592
   55   2HB   LEU   9          1HB       LEU   9   2.731   7.777   2.103
   56    HG   LEU   9           HG       LEU   9   1.000   6.594  -0.066
   57   1HD1  LEU   9          1HD1      LEU   9   1.744   8.514  -1.057
   58   2HD1  LEU   9          2HD1      LEU   9   3.070   7.411  -1.426
   59   3HD1  LEU   9          3HD1      LEU   9   3.224   8.560  -0.099
   60   1HD2  LEU   9          1HD2      LEU   9   2.241   4.790   0.522
   61   2HD2  LEU   9          2HD2      LEU   9   3.528   5.768   1.230
   62   3HD2  LEU   9          3HD2      LEU   9   3.420   5.588  -0.521
   63    H    ALA  10           H        ALA  10   3.042   6.698   4.278
   64    HA   ALA  10           HA       ALA  10   4.348   4.327   3.530
   65   1HB   ALA  10          1HB       ALA  10   5.884   5.560   4.575
   66   2HB   ALA  10          2HB       ALA  10   5.280   4.812   6.050
   67   3HB   ALA  10          3HB       ALA  10   4.681   6.393   5.560
   68    H    GLN  11           H        GLN  11   1.661   4.821   5.617
   69    HA   GLN  11           HA       GLN  11   2.066   2.426   7.160
   70   1HB   GLN  11          2HB       GLN  11   0.963   4.213   8.281
   71   2HB   GLN  11          1HB       GLN  11  -0.196   4.406   6.970
   72   1HG   GLN  11          2HG       GLN  11  -1.063   2.164   7.475
   73   2HG   GLN  11          1HG       GLN  11   0.010   2.084   8.867
   74   1HE2  GLN  11          1HE2      GLN  11  -0.479   3.230  10.691
   75   2HE2  GLN  11          2HE2      GLN  11  -1.979   4.055  10.922
   76    H    ALA  12           H        ALA  12  -0.047   3.461   4.503
   77    HA   ALA  12           HA       ALA  12  -1.662   1.227   4.291
   78   1HB   ALA  12          1HB       ALA  12  -2.276   2.044   2.262
   79   2HB   ALA  12          2HB       ALA  12  -0.609   2.339   1.761
   80   3HB   ALA  12          3HB       ALA  12  -1.416   3.465   2.856
   81    H    LYS  13           H        LYS  13   1.629   1.738   3.255
   82    HA   LYS  13           HA       LYS  13   1.841  -0.890   2.035
   83   1HB   LYS  13          2HB       LYS  13   4.375  -0.004   2.006
   84   2HB   LYS  13          1HB       LYS  13   3.190   0.441   0.794
   85   1HG   LYS  13          2HG       LYS  13   2.894   2.556   1.647
   86   2HG   LYS  13          1HG       LYS  13   3.537   2.112   3.234
   87   1HD   LYS  13          2HD       LYS  13   5.134   2.301   0.675
   88   2HD   LYS  13          1HD       LYS  13   5.108   3.516   1.953
   89   1HE   LYS  13          2HE       LYS  13   5.691   1.107   3.240
   90   2HE   LYS  13          1HE       LYS  13   6.645   1.083   1.757
   91   1HZ   LYS  13          1HZ       LYS  13   7.910   2.813   2.431
   92   2HZ   LYS  13          2HZ       LYS  13   7.483   2.247   3.966
   93   3HZ   LYS  13          3HZ       LYS  13   6.659   3.560   3.292
   94    H    GLU  14           H        GLU  14   3.469   0.892   4.667
   95    HA   GLU  14           HA       GLU  14   4.983  -1.144   5.740
   96   1HB   GLU  14          2HB       GLU  14   3.607   1.236   6.952
   97   2HB   GLU  14          1HB       GLU  14   4.415   0.074   7.999
   98   1HG   GLU  14          2HG       GLU  14   6.511   0.579   7.166
   99   2HG   GLU  14          1HG       GLU  14   5.866   1.256   5.671
  100    H    ALA  15           H        ALA  15   1.581  -0.451   6.069
  101    HA   ALA  15           HA       ALA  15   1.132  -2.602   7.964
  102   1HB   ALA  15          1HB       ALA  15  -0.148  -0.336   7.744
  103   2HB   ALA  15          2HB       ALA  15  -1.018  -1.805   8.186
  104   3HB   ALA  15          3HB       ALA  15  -1.082  -1.207   6.528
  105    H    ALA  16           H        ALA  16   0.720  -1.998   4.524
  106    HA   ALA  16           HA       ALA  16  -0.817  -4.318   3.965
  107   1HB   ALA  16          1HB       ALA  16   0.064  -3.894   1.582
  108   2HB   ALA  16          2HB       ALA  16   0.779  -2.436   2.267
  109   3HB   ALA  16          3HB       ALA  16  -0.966  -2.672   2.328
  110    H    ILE  17           H        ILE  17   2.586  -3.743   4.385
  111    HA   ILE  17           HA       ILE  17   3.399  -6.189   3.101
  112    HB   ILE  17           HB       ILE  17   5.634  -5.716   4.041
  113   1HG1  ILE  17          2HG1      ILE  17   4.289  -3.276   5.221
  114   2HG1  ILE  17          1HG1      ILE  17   4.928  -4.639   6.134
  115   1HG2  ILE  17          1HG2      ILE  17   4.117  -3.912   2.301
  116   2HG2  ILE  17          2HG2      ILE  17   5.661  -4.720   2.034
  117   3HG2  ILE  17          3HG2      ILE  17   5.599  -3.221   2.960
  118   1HD1  ILE  17          1HD1      ILE  17   6.644  -2.957   4.339
  119   2HD1  ILE  17          2HD1      ILE  17   7.147  -4.077   5.605
  120   3HD1  ILE  17          3HD1      ILE  17   6.357  -2.560   6.033
  121    H    LYS  18           H        LYS  18   2.602  -5.122   6.331
  122    HA   LYS  18           HA       LYS  18   3.675  -7.267   7.793
  123   1HB   LYS  18          2HB       LYS  18   2.000  -5.022   8.299
  124   2HB   LYS  18          1HB       LYS  18   1.201  -6.440   8.966
  125   1HG   LYS  18          2HG       LYS  18   2.973  -6.898  10.421
  126   2HG   LYS  18          1HG       LYS  18   4.085  -5.850   9.535
  127   1HD   LYS  18          2HD       LYS  18   2.495  -3.944  10.184
  128   2HD   LYS  18          1HD       LYS  18   1.822  -5.082  11.353
  129   1HE   LYS  18          2HE       LYS  18   4.682  -4.143  11.183
  130   2HE   LYS  18          1HE       LYS  18   3.503  -3.713  12.421
  131   1HZ   LYS  18          1HZ       LYS  18   3.405  -6.254  12.788
  132   2HZ   LYS  18          2HZ       LYS  18   4.701  -5.377  13.430
  133   3HZ   LYS  18          3HZ       LYS  18   4.905  -6.266  12.005
  134    H    GLU  19           H        GLU  19   0.775  -6.946   5.881
  135    HA   GLU  19           HA       GLU  19  -0.420  -9.383   6.812
  136   1HB   GLU  19          2HB       GLU  19  -1.131  -7.223   5.021
  137   2HB   GLU  19          1HB       GLU  19  -1.475  -8.778   4.276
  138   1HG   GLU  19          2HG       GLU  19  -3.429  -8.037   5.418
  139   2HG   GLU  19          1HG       GLU  19  -2.757  -9.407   6.302
  140    H    LEU  20           H        LEU  20   1.669  -8.402   4.181
  141    HA   LEU  20           HA       LEU  20   1.518 -10.735   2.635
  142   1HB   LEU  20          2HB       LEU  20   3.170  -8.372   2.756
  143   2HB   LEU  20          1HB       LEU  20   4.141  -9.793   2.419
  144    HG   LEU  20           HG       LEU  20   1.924 -10.034   0.750
  145   1HD1  LEU  20          1HD1      LEU  20   3.007  -7.321   0.223
  146   2HD1  LEU  20          2HD1      LEU  20   1.721  -7.515   1.415
  147   3HD1  LEU  20          3HD1      LEU  20   1.464  -8.036  -0.252
  148   1HD2  LEU  20          1HD2      LEU  20   4.623 -10.246   0.561
  149   2HD2  LEU  20          2HD2      LEU  20   4.310  -8.830  -0.440
  150   3HD2  LEU  20          3HD2      LEU  20   3.507 -10.358  -0.798
  151    H    LYS  21           H        LYS  21   3.383  -9.896   5.480
  152    HA   LYS  21           HA       LYS  21   4.944 -12.327   5.402
  153   1HB   LYS  21          2HB       LYS  21   5.829 -11.553   7.576
  154   2HB   LYS  21          1HB       LYS  21   5.966 -10.324   6.328
  155   1HG   LYS  21          2HG       LYS  21   4.102  -9.119   7.219
  156   2HG   LYS  21          1HG       LYS  21   3.757 -10.413   8.367
  157   1HD   LYS  21          2HD       LYS  21   6.273  -9.933   9.072
  158   2HD   LYS  21          1HD       LYS  21   5.887  -8.343   8.411
  159   1HE   LYS  21          2HE       LYS  21   5.001  -7.872  10.402
  160   2HE   LYS  21          1HE       LYS  21   3.685  -8.959   9.962
  161   1HZ   LYS  21          1HZ       LYS  21   4.596  -9.538  12.109
  162   2HZ   LYS  21          2HZ       LYS  21   6.144  -9.713  11.448
  163   3HZ   LYS  21          3HZ       LYS  21   4.909 -10.779  11.000
  164    H    GLN  22           H        GLN  22   2.155 -11.032   7.112
  165    HA   GLN  22           HA       GLN  22   1.877 -13.223   8.915
  166   1HB   GLN  22          2HB       GLN  22   0.339 -10.821   8.188
  167   2HB   GLN  22          1HB       GLN  22  -0.644 -12.180   8.715
  168   1HG   GLN  22          2HG       GLN  22   1.701 -11.554  10.384
  169   2HG   GLN  22          1HG       GLN  22   0.403 -10.361  10.380
  170   1HE2  GLN  22          1HE2      GLN  22  -1.805 -11.258  10.751
  171   2HE2  GLN  22          2HE2      GLN  22  -1.966 -12.516  11.923
  172    H    TYR  23           H        TYR  23   0.940 -12.618   5.634
  173    HA   TYR  23           HA       TYR  23  -0.930 -14.836   5.533
  174   1HB   TYR  23          2HB       TYR  23   0.040 -12.801   3.539
  175   2HB   TYR  23          1HB       TYR  23  -0.864 -14.221   3.016
  176    HD1  TYR  23           1HD      TYR  23  -2.972 -14.572   4.872
  177    HD2  TYR  23           2HD      TYR  23  -1.266 -10.930   3.496
  178    HE1  TYR  23           1HE      TYR  23  -5.076 -13.405   5.369
  179    HE2  TYR  23           2HE      TYR  23  -3.358  -9.753   3.987
  180    HH   TYR  23           HH       TYR  23  -5.330  -9.998   5.389
  181    H    GLY  24           H        GLY  24   2.321 -14.028   4.420
  182   1HA   GLY  24          2HA       GLY  24   3.963 -15.832   4.409
  183   2HA   GLY  24          1HA       GLY  24   2.703 -16.883   3.784
  184    H    ILE  25           H        ILE  25   2.105 -14.164   2.137
  185    HA   ILE  25           HA       ILE  25   2.990 -15.099  -0.315
  186    HB   ILE  25           HB       ILE  25   3.065 -12.168  -0.205
  187   1HG1  ILE  25          2HG1      ILE  25   0.556 -13.618   0.676
  188   2HG1  ILE  25          1HG1      ILE  25   1.474 -12.440   1.611
  189   1HG2  ILE  25          1HG2      ILE  25   1.009 -12.906  -1.838
  190   2HG2  ILE  25          2HG2      ILE  25   2.044 -14.336  -1.880
  191   3HG2  ILE  25          3HG2      ILE  25   2.700 -12.762  -2.326
  192   1HD1  ILE  25          1HD1      ILE  25   0.957 -10.920  -0.487
  193   2HD1  ILE  25          2HD1      ILE  25  -0.183 -11.096   0.846
  194   3HD1  ILE  25          3HD1      ILE  25  -0.405 -12.026  -0.637
  195    H    GLY  26           H        GLY  26   4.590 -13.791  -1.799
  196   1HA   GLY  26          2HA       GLY  26   7.180 -14.064  -0.553
  197   2HA   GLY  26          1HA       GLY  26   6.861 -13.690  -2.244
  198    H    ASP  27           H        ASP  27   8.875 -12.434  -0.796
  199    HA   ASP  27           HA       ASP  27   8.037  -9.931   0.262
  200   1HB   ASP  27          2HB       ASP  27  10.661 -11.130  -0.532
  201   2HB   ASP  27          1HB       ASP  27  10.569  -9.394  -0.248
  202    H    TYR  28           H        TYR  28   8.626 -11.095  -2.938
  203    HA   TYR  28           HA       TYR  28   9.337  -8.891  -4.402
  204   1HB   TYR  28          2HB       TYR  28   8.410 -11.355  -5.061
  205   2HB   TYR  28          1HB       TYR  28   7.003 -10.380  -5.473
  206    HD1  TYR  28           1HD      TYR  28   8.875 -11.976  -7.365
  207    HD2  TYR  28           2HD      TYR  28   8.712  -7.890  -6.199
  208    HE1  TYR  28           1HE      TYR  28   9.929 -11.330  -9.492
  209    HE2  TYR  28           2HE      TYR  28   9.759  -7.234  -8.309
  210    HH   TYR  28           HH       TYR  28   9.823  -8.760 -10.892
  211    H    TYR  29           H        TYR  29   6.116  -9.772  -3.321
  212    HA   TYR  29           HA       TYR  29   4.906  -7.397  -4.335
  213   1HB   TYR  29          2HB       TYR  29   3.702  -9.408  -2.433
  214   2HB   TYR  29          1HB       TYR  29   2.846  -8.299  -3.495
  215    HD1  TYR  29           1HD      TYR  29   2.584 -11.360  -3.449
  216    HD2  TYR  29           2HD      TYR  29   4.964  -8.717  -5.804
  217    HE1  TYR  29           1HE      TYR  29   2.681 -13.048  -5.234
  218    HE2  TYR  29           2HE      TYR  29   5.073 -10.409  -7.583
  219    HH   TYR  29           HH       TYR  29   4.048 -13.643  -7.133
  220    H    ILE  30           H        ILE  30   6.421  -8.155  -1.305
  221    HA   ILE  30           HA       ILE  30   5.057  -6.062   0.135
  222    HB   ILE  30           HB       ILE  30   6.282  -6.605   1.969
  223   1HG1  ILE  30          2HG1      ILE  30   8.657  -7.688   1.711
  224   2HG1  ILE  30          1HG1      ILE  30   8.582  -6.967   0.106
  225   1HG2  ILE  30          1HG2      ILE  30   6.308  -9.004   0.221
  226   2HG2  ILE  30          2HG2      ILE  30   5.361  -8.663   1.662
  227   3HG2  ILE  30          3HG2      ILE  30   7.067  -9.072   1.808
  228   1HD1  ILE  30          1HD1      ILE  30   9.025  -5.723   2.687
  229   2HD1  ILE  30          2HD1      ILE  30   7.766  -4.924   1.741
  230   3HD1  ILE  30          3HD1      ILE  30   9.382  -5.131   1.063
  231    H    LYS  31           H        LYS  31   7.883  -6.471  -1.823
  232    HA   LYS  31           HA       LYS  31   8.985  -3.857  -1.323
  233   1HB   LYS  31          2HB       LYS  31   9.642  -5.857  -3.487
  234   2HB   LYS  31          1HB       LYS  31  10.612  -4.461  -3.038
  235   1HG   LYS  31          2HG       LYS  31  10.010  -6.769  -1.204
  236   2HG   LYS  31          1HG       LYS  31  11.478  -6.614  -2.169
  237   1HD   LYS  31          2HD       LYS  31  12.237  -4.783  -0.941
  238   2HD   LYS  31          1HD       LYS  31  10.634  -4.434  -0.294
  239   1HE   LYS  31          2HE       LYS  31  11.551  -5.415   1.543
  240   2HE   LYS  31          1HE       LYS  31  10.936  -6.859   0.739
  241   1HZ   LYS  31          1HZ       LYS  31  13.676  -5.992   1.157
  242   2HZ   LYS  31          2HZ       LYS  31  13.351  -6.665  -0.361
  243   3HZ   LYS  31          3HZ       LYS  31  13.038  -7.556   1.043
  244    H    LEU  32           H        LEU  32   7.412  -5.489  -4.080
  245    HA   LEU  32           HA       LEU  32   7.418  -3.405  -5.865
  246   1HB   LEU  32          2HB       LEU  32   6.209  -4.797  -7.152
  247   2HB   LEU  32          1HB       LEU  32   6.405  -5.930  -5.840
  248    HG   LEU  32           HG       LEU  32   4.139  -6.010  -6.404
  249   1HD1  LEU  32          1HD1      LEU  32   3.555  -4.196  -4.275
  250   2HD1  LEU  32          2HD1      LEU  32   5.047  -5.084  -3.943
  251   3HD1  LEU  32          3HD1      LEU  32   3.547  -5.963  -4.279
  252   1HD2  LEU  32          1HD2      LEU  32   3.552  -3.149  -6.004
  253   2HD2  LEU  32          2HD2      LEU  32   2.872  -4.296  -7.157
  254   3HD2  LEU  32          3HD2      LEU  32   4.438  -3.551  -7.473
  255    H    ILE  33           H        ILE  33   5.715  -3.650  -2.924
  256    HA   ILE  33           HA       ILE  33   3.642  -1.749  -3.482
  257    HB   ILE  33           HB       ILE  33   4.671  -3.160  -1.049
  258   1HG1  ILE  33          2HG1      ILE  33   2.012  -2.929  -2.452
  259   2HG1  ILE  33          1HG1      ILE  33   3.061  -4.336  -2.356
  260   1HG2  ILE  33          1HG2      ILE  33   2.453  -1.586  -0.250
  261   2HG2  ILE  33          2HG2      ILE  33   3.664  -0.504  -0.930
  262   3HG2  ILE  33          3HG2      ILE  33   4.093  -1.582   0.393
  263   1HD1  ILE  33          1HD1      ILE  33   2.077  -5.016  -0.500
  264   2HD1  ILE  33          2HD1      ILE  33   0.895  -3.728  -0.730
  265   3HD1  ILE  33          3HD1      ILE  33   2.315  -3.451   0.275
  266    H    ASN  34           H        ASN  34   6.567  -1.674  -1.446
  267    HA   ASN  34           HA       ASN  34   6.531   0.992  -0.742
  268   1HB   ASN  34          2HB       ASN  34   8.098  -0.873   0.043
  269   2HB   ASN  34          1HB       ASN  34   9.081  -0.485  -1.365
  270   1HD2  ASN  34          1HD2      ASN  34   8.693   0.082   1.836
  271   2HD2  ASN  34          2HD2      ASN  34   9.502   1.603   1.966
  272    H    ASN  35           H        ASN  35   7.270  -0.394  -3.825
  273    HA   ASN  35           HA       ASN  35   8.821   1.753  -4.854
  274   1HB   ASN  35          2HB       ASN  35   8.839  -0.529  -5.812
  275   2HB   ASN  35          1HB       ASN  35   7.184  -0.292  -6.364
  276   1HD2  ASN  35          1HD2      ASN  35   6.781   1.009  -8.117
  277   2HD2  ASN  35          2HD2      ASN  35   8.031   1.594  -9.157
  278    H    ALA  36           H        ALA  36   5.423   1.302  -4.406
  279    HA   ALA  36           HA       ALA  36   4.442   2.979  -6.435
  280   1HB   ALA  36          1HB       ALA  36   2.604   2.041  -5.617
  281   2HB   ALA  36          2HB       ALA  36   2.656   3.261  -4.344
  282   3HB   ALA  36          3HB       ALA  36   3.386   1.677  -4.079
  283    H    LYS  37           H        LYS  37   3.635   5.114  -6.336
  284    HA   LYS  37           HA       LYS  37   5.247   6.844  -4.610
  285   1HB   LYS  37          2HB       LYS  37   3.571   7.757  -6.937
  286   2HB   LYS  37          1HB       LYS  37   4.967   8.541  -6.210
  287   1HG   LYS  37          2HG       LYS  37   5.947   7.717  -8.081
  288   2HG   LYS  37          1HG       LYS  37   6.176   6.330  -7.014
  289   1HD   LYS  37          2HD       LYS  37   3.643   5.988  -8.132
  290   2HD   LYS  37          1HD       LYS  37   4.659   6.547  -9.462
  291   1HE   LYS  37          2HE       LYS  37   6.213   4.767  -9.117
  292   2HE   LYS  37          1HE       LYS  37   5.416   4.289  -7.618
  293   1HZ   LYS  37          1HZ       LYS  37   3.753   4.306 -10.000
  294   2HZ   LYS  37          2HZ       LYS  37   3.801   3.201  -8.721
  295   3HZ   LYS  37          3HZ       LYS  37   4.957   3.119  -9.954
  296    H    THR  38           H        THR  38   1.936   6.093  -5.476
  297    HA   THR  38           HA       THR  38   0.898   8.123  -3.654
  298    HB   THR  38           HB       THR  38  -1.248   7.680  -4.593
  299    HG1  THR  38           1HG      THR  38  -1.608   5.625  -4.869
  300   1HG2  THR  38          1HG2      THR  38  -0.171   8.944  -6.200
  301   2HG2  THR  38          2HG2      THR  38  -0.787   7.573  -7.114
  302   3HG2  THR  38          3HG2      THR  38   0.915   7.634  -6.653
  303    H    VAL  39           H        VAL  39  -1.508   6.446  -3.048
  304    HA   VAL  39           HA       VAL  39  -0.304   4.368  -1.396
  305    HB   VAL  39           HB       VAL  39  -0.719   6.641  -0.154
  306   1HG1  VAL  39          1HG1      VAL  39  -2.825   6.733   0.980
  307   2HG1  VAL  39          2HG1      VAL  39  -3.369   5.265   0.167
  308   3HG1  VAL  39          3HG1      VAL  39  -3.112   6.742  -0.761
  309   1HG2  VAL  39          1HG2      VAL  39  -1.319   5.120   1.874
  310   2HG2  VAL  39          2HG2      VAL  39   0.227   4.923   1.043
  311   3HG2  VAL  39          3HG2      VAL  39  -1.104   3.823   0.700
  312    H    GLU  40           H        GLU  40  -3.309   5.788  -2.615
  313    HA   GLU  40           HA       GLU  40  -5.139   3.900  -1.851
  314   1HB   GLU  40          2HB       GLU  40  -5.187   6.041  -3.529
  315   2HB   GLU  40          1HB       GLU  40  -5.401   4.720  -4.671
  316   1HG   GLU  40          2HG       GLU  40  -7.074   4.652  -2.238
  317   2HG   GLU  40          1HG       GLU  40  -7.430   5.911  -3.417
  318    H    GLY  41           H        GLY  41  -2.797   3.673  -4.474
  319   1HA   GLY  41          2HA       GLY  41  -3.816   1.096  -5.330
  320   2HA   GLY  41          1HA       GLY  41  -2.420   1.939  -5.987
  321    H    VAL  42           H        VAL  42  -1.304   2.343  -3.275
  322    HA   VAL  42           HA       VAL  42   0.415   0.153  -3.158
  323    HB   VAL  42           HB       VAL  42  -0.260   2.051  -0.913
  324   1HG1  VAL  42          1HG1      VAL  42   1.946   0.087  -1.395
  325   2HG1  VAL  42          2HG1      VAL  42   0.916   0.273   0.032
  326   3HG1  VAL  42          3HG1      VAL  42   2.163   1.474  -0.325
  327   1HG2  VAL  42          1HG2      VAL  42   0.551   2.980  -3.197
  328   2HG2  VAL  42          2HG2      VAL  42   2.102   2.288  -2.726
  329   3HG2  VAL  42          3HG2      VAL  42   1.347   3.515  -1.717
  330    H    GLU  43           H        GLU  43  -2.414   0.910  -1.152
  331    HA   GLU  43           HA       GLU  43  -2.194  -1.428   0.457
  332   1HB   GLU  43          2HB       GLU  43  -4.774  -0.818   0.790
  333   2HB   GLU  43          1HB       GLU  43  -3.485   0.086   1.572
  334   1HG   GLU  43          2HG       GLU  43  -3.627   1.835  -0.013
  335   2HG   GLU  43          1HG       GLU  43  -4.678   0.885  -1.067
  336    H    SER  44           H        SER  44  -4.443  -0.581  -2.170
  337    HA   SER  44           HA       SER  44  -5.670  -3.105  -2.322
  338   1HB   SER  44          2HB       SER  44  -6.063  -0.656  -3.504
  339   2HB   SER  44          1HB       SER  44  -5.498  -1.637  -4.858
  340    HG   SER  44           HG       SER  44  -7.898  -1.644  -3.654
  341    H    LEU  45           H        LEU  45  -2.632  -1.933  -3.437
  342    HA   LEU  45           HA       LEU  45  -2.082  -3.603  -5.594
  343   1HB   LEU  45          2HB       LEU  45  -0.559  -2.016  -3.675
  344   2HB   LEU  45          1HB       LEU  45   0.321  -3.421  -4.230
  345   1HD1  LEU  45          1HD1      LEU  45   0.938  -2.762  -7.463
  346   2HD1  LEU  45          2HD1      LEU  45   1.326  -3.582  -5.950
  347   3HD1  LEU  45          3HD1      LEU  45   2.014  -1.994  -6.294
  348   1HD2  LEU  45          1HD2      LEU  45  -1.048  -0.879  -7.304
  349   2HD2  LEU  45          2HD2      LEU  45  -2.134  -1.715  -6.195
  350   3HD2  LEU  45          3HD2      LEU  45  -1.232  -2.629  -7.402
  351    H    LYS  46           H        LYS  46  -1.163  -4.152  -2.185
  352    HA   LYS  46           HA       LYS  46  -0.441  -6.870  -2.658
  353   1HB   LYS  46          2HB       LYS  46   0.659  -6.276  -0.787
  354   2HB   LYS  46          1HB       LYS  46  -0.499  -5.022  -0.372
  355   1HG   LYS  46          2HG       LYS  46  -1.183  -7.906   0.060
  356   2HG   LYS  46          1HG       LYS  46  -0.144  -7.050   1.206
  357   1HD   LYS  46          2HD       LYS  46  -1.951  -5.279   1.323
  358   2HD   LYS  46          1HD       LYS  46  -2.987  -6.406   0.451
  359   1HE   LYS  46          2HE       LYS  46  -3.277  -7.733   2.238
  360   2HE   LYS  46          1HE       LYS  46  -1.611  -7.536   2.781
  361   1HZ   LYS  46          1HZ       LYS  46  -3.685  -6.492   4.053
  362   2HZ   LYS  46          2HZ       LYS  46  -3.326  -5.200   3.021
  363   3HZ   LYS  46          3HZ       LYS  46  -2.146  -5.789   4.079
  364    H    ASN  47           H        ASN  47  -3.294  -5.289  -1.252
  365    HA   ASN  47           HA       ASN  47  -4.681  -7.604  -0.523
  366   1HB   ASN  47          2HB       ASN  47  -5.369  -5.308   0.129
  367   2HB   ASN  47          1HB       ASN  47  -5.856  -4.993  -1.535
  368   1HD2  ASN  47          1HD2      ASN  47  -7.946  -5.130  -1.832
  369   2HD2  ASN  47          2HD2      ASN  47  -9.034  -6.189  -1.009
  370    H    GLU  48           H        GLU  48  -4.200  -6.100  -3.618
  371    HA   GLU  48           HA       GLU  48  -6.236  -7.609  -4.976
  372   1HB   GLU  48          2HB       GLU  48  -5.508  -5.432  -5.844
  373   2HB   GLU  48          1HB       GLU  48  -3.878  -6.054  -6.065
  374   1HG   GLU  48          2HG       GLU  48  -5.142  -7.839  -7.544
  375   2HG   GLU  48          1HG       GLU  48  -6.332  -6.543  -7.658
  376    H    ILE  49           H        ILE  49  -2.770  -7.839  -4.463
  377    HA   ILE  49           HA       ILE  49  -2.279 -10.029  -6.178
  378    HB   ILE  49           HB       ILE  49  -0.181 -10.268  -5.114
  379   1HG1  ILE  49          2HG1      ILE  49  -0.762  -8.505  -2.800
  380   2HG1  ILE  49          1HG1      ILE  49  -1.389 -10.138  -2.727
  381   1HG2  ILE  49          1HG2      ILE  49  -0.056  -7.504  -4.476
  382   2HG2  ILE  49          2HG2      ILE  49  -1.143  -7.723  -5.848
  383   3HG2  ILE  49          3HG2      ILE  49   0.509  -8.335  -5.925
  384   1HD1  ILE  49          1HD1      ILE  49   1.447  -9.726  -3.444
  385   2HD1  ILE  49          2HD1      ILE  49   0.679 -11.055  -2.576
  386   3HD1  ILE  49          3HD1      ILE  49   0.948  -9.508  -1.768
  387    H    LEU  50           H        LEU  50  -3.609  -9.710  -3.020
  388    HA   LEU  50           HA       LEU  50  -3.406 -12.498  -2.347
  389   1HB   LEU  50          2HB       LEU  50  -4.782 -10.149  -1.053
  390   2HB   LEU  50          1HB       LEU  50  -4.814 -11.770  -0.379
  391    HG   LEU  50           HG       LEU  50  -2.135 -10.695  -0.996
  392   1HD1  LEU  50          1HD1      LEU  50  -3.071  -8.683  -0.146
  393   2HD1  LEU  50          2HD1      LEU  50  -2.105  -9.412   1.138
  394   3HD1  LEU  50          3HD1      LEU  50  -3.863  -9.542   1.176
  395   1HD2  LEU  50          1HD2      LEU  50  -3.442 -12.458   1.001
  396   2HD2  LEU  50          2HD2      LEU  50  -1.964 -11.622   1.477
  397   3HD2  LEU  50          3HD2      LEU  50  -1.957 -12.695   0.076
  398    H    LYS  51           H        LYS  51  -5.823 -10.319  -3.680
  399    HA   LYS  51           HA       LYS  51  -8.105 -11.872  -3.335
  400   1HB   LYS  51          2HB       LYS  51  -9.125 -10.565  -4.985
  401   2HB   LYS  51          1HB       LYS  51  -7.869  -9.511  -4.356
  402   1HG   LYS  51          2HG       LYS  51  -7.231  -9.197  -6.456
  403   2HG   LYS  51          1HG       LYS  51  -6.639 -10.858  -6.445
  404   1HD   LYS  51          2HD       LYS  51  -8.700 -11.671  -7.350
  405   2HD   LYS  51          1HD       LYS  51  -9.465 -10.092  -7.160
  406   1HE   LYS  51          2HE       LYS  51  -8.076  -9.135  -8.849
  407   2HE   LYS  51          1HE       LYS  51  -7.068 -10.581  -8.918
  408   1HZ   LYS  51          1HZ       LYS  51  -8.904 -10.186 -10.684
  409   2HZ   LYS  51          2HZ       LYS  51  -9.937 -10.806  -9.497
  410   3HZ   LYS  51          3HZ       LYS  51  -8.648 -11.744 -10.068
  411    H    ALA  52           H        ALA  52  -5.368 -12.296  -5.397
  412    HA   ALA  52           HA       ALA  52  -6.562 -14.766  -6.442
  413   1HB   ALA  52          1HB       ALA  52  -6.566 -13.204  -8.268
  414   2HB   ALA  52          2HB       ALA  52  -5.299 -14.397  -8.553
  415   3HB   ALA  52          3HB       ALA  52  -4.879 -12.786  -7.969
  416    H    LEU  53           H        LEU  53  -5.180 -14.915  -4.177
  417    HA   LEU  53           HA       LEU  53  -2.435 -15.091  -4.185
  418   1HB   LEU  53          2HB       LEU  53  -4.569 -16.558  -2.696
  419   2HB   LEU  53          1HB       LEU  53  -2.899 -17.059  -2.510
  420    HG   LEU  53           HG       LEU  53  -3.962 -14.295  -1.923
  421   1HD1  LEU  53          1HD1      LEU  53  -4.765 -15.383  -0.117
  422   2HD1  LEU  53          2HD1      LEU  53  -3.098 -15.219   0.436
  423   3HD1  LEU  53          3HD1      LEU  53  -3.642 -16.732  -0.290
  424   1HD2  LEU  53          1HD2      LEU  53  -1.858 -13.594  -1.743
  425   2HD2  LEU  53          2HD2      LEU  53  -1.364 -15.095  -2.525
  426   3HD2  LEU  53          3HD2      LEU  53  -1.408 -14.990  -0.765
  427    HA   PRO  54           HA       PRO  54  -1.775 -18.474  -7.038
  428   1HB   PRO  54          2HB       PRO  54   0.908 -18.500  -6.968
  429   2HB   PRO  54          1HB       PRO  54   0.015 -17.201  -7.768
  430   1HG   PRO  54          2HG       PRO  54   1.293 -17.235  -5.062
  431   2HG   PRO  54          1HG       PRO  54   1.297 -15.952  -6.285
  432   1HD   PRO  54          2HD       PRO  54  -0.372 -15.985  -4.110
  433   2HD   PRO  54          1HD       PRO  54  -0.752 -15.161  -5.635
  434    H    THR  55           H        THR  55  -0.977 -20.641  -6.994
  435    HA   THR  55           HA       THR  55  -1.216 -21.899  -4.455
  436    HB   THR  55           HB       THR  55  -0.207 -23.864  -6.035
  437    HG1  THR  55           1HG      THR  55  -1.640 -22.261  -7.855
  438   1HG2  THR  55          1HG2      THR  55  -2.282 -24.704  -6.062
  439   2HG2  THR  55          2HG2      THR  55  -2.993 -23.219  -6.694
  440   3HG2  THR  55          3HG2      THR  55  -2.627 -23.358  -4.975
  441    H    GLU  56           H        GLU  56   0.293 -22.261  -2.975
  442    HA   GLU  56           HA       GLU  56   3.093 -21.780  -3.667
  443   1HB   GLU  56          2HB       GLU  56   1.523 -21.779  -1.122
  444   2HB   GLU  56          1HB       GLU  56   3.259 -22.057  -1.051
  445   1HG   GLU  56          2HG       GLU  56   3.488 -19.920  -2.417
  446   2HG   GLU  56          1HG       GLU  56   1.796 -19.627  -2.017
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  -6.439  20.357  10.607
    2   2H    MET   1          2HT       MET   1  -6.938  18.905  11.386
    3   3H    MET   1          3HT       MET   1  -8.081  20.141  11.048
    4    HA   MET   1           HA       MET   1  -8.086  18.168   9.563
    5   1HB   MET   1          2HB       MET   1  -9.146  20.363   9.108
    6   2HB   MET   1          1HB       MET   1  -7.646  20.905   8.369
    7   1HG   MET   1          2HG       MET   1  -8.080  18.660   6.954
    8   2HG   MET   1          1HG       MET   1  -9.739  19.128   7.323
    9   1HE   MET   1          1HE       MET   1  -9.316  22.599   7.175
   10   2HE   MET   1          2HE       MET   1 -10.627  21.422   7.035
   11   3HE   MET   1          3HE       MET   1 -10.227  22.482   5.673
   12    H    GLU   2           H        GLU   2  -6.984  16.908   8.157
   13    HA   GLU   2           HA       GLU   2  -5.226  15.992   7.028
   14   1HB   GLU   2          2HB       GLU   2  -5.558  18.445   5.961
   15   2HB   GLU   2          1HB       GLU   2  -3.900  18.590   6.520
   16   1HG   GLU   2          2HG       GLU   2  -3.113  17.151   4.987
   17   2HG   GLU   2          1HG       GLU   2  -4.541  16.125   5.039
   18    H    ALA   3           H        ALA   3  -2.587  16.500   6.797
   19    HA   ALA   3           HA       ALA   3  -1.370  17.355   9.231
   20   1HB   ALA   3          1HB       ALA   3  -0.535  14.675   9.225
   21   2HB   ALA   3          2HB       ALA   3  -2.298  14.647   9.125
   22   3HB   ALA   3          3HB       ALA   3  -1.505  15.501  10.446
   23    H    VAL   4           H        VAL   4  -0.411  14.602   7.233
   24    HA   VAL   4           HA       VAL   4   1.600  16.279   5.917
   25    HB   VAL   4           HB       VAL   4   2.320  13.533   6.911
   26   1HG1  VAL   4          1HG1      VAL   4   3.560  15.226   5.156
   27   2HG1  VAL   4          2HG1      VAL   4   4.360  13.955   6.083
   28   3HG1  VAL   4          3HG1      VAL   4   4.365  15.622   6.675
   29   1HG2  VAL   4          1HG2      VAL   4   3.624  14.984   8.682
   30   2HG2  VAL   4          2HG2      VAL   4   1.959  14.480   8.972
   31   3HG2  VAL   4          3HG2      VAL   4   2.298  16.111   8.408
   32    H    ASP   5           H        ASP   5  -0.271  13.299   5.939
   33    HA   ASP   5           HA       ASP   5  -1.220  12.157   4.208
   34   1HB   ASP   5          2HB       ASP   5  -0.526  14.551   2.948
   35   2HB   ASP   5          1HB       ASP   5   0.170  13.297   1.931
   36    H    ALA   6           H        ALA   6   2.228  12.930   3.710
   37    HA   ALA   6           HA       ALA   6   2.864  10.548   2.337
   38   1HB   ALA   6          1HB       ALA   6   4.357  12.736   3.632
   39   2HB   ALA   6          2HB       ALA   6   4.581  11.986   2.052
   40   3HB   ALA   6          3HB       ALA   6   5.214  11.199   3.500
   41    H    ASN   7           H        ASN   7   2.694  11.356   5.756
   42    HA   ASN   7           HA       ASN   7   4.008   9.076   6.761
   43   1HB   ASN   7          2HB       ASN   7   2.988  11.340   7.877
   44   2HB   ASN   7          1HB       ASN   7   1.787  10.149   8.384
   45   1HD2  ASN   7          1HD2      ASN   7   3.463   7.929   8.631
   46   2HD2  ASN   7          2HD2      ASN   7   4.521   8.188   9.971
   47    H    SER   8           H        SER   8   0.569   9.754   6.177
   48    HA   SER   8           HA       SER   8  -0.397   7.258   7.052
   49   1HB   SER   8          2HB       SER   8  -1.492   9.638   5.962
   50   2HB   SER   8          1HB       SER   8  -2.065   8.306   4.964
   51    HG   SER   8           HG       SER   8  -2.642   7.277   7.018
   52    H    LEU   9           H        LEU   9   0.930   8.372   4.028
   53    HA   LEU   9           HA       LEU   9   0.087   6.283   2.355
   54   1HB   LEU   9          2HB       LEU   9   1.119   8.459   1.652
   55   2HB   LEU   9          1HB       LEU   9   2.670   7.830   2.168
   56    HG   LEU   9           HG       LEU   9   0.981   6.569   0.014
   57   1HD1  LEU   9          1HD1      LEU   9   3.242   8.532  -0.160
   58   2HD1  LEU   9          2HD1      LEU   9   1.601   8.702  -0.788
   59   3HD1  LEU   9          3HD1      LEU   9   2.702   7.531  -1.517
   60   1HD2  LEU   9          1HD2      LEU   9   3.516   5.884   1.325
   61   2HD2  LEU   9          2HD2      LEU   9   3.537   5.813  -0.437
   62   3HD2  LEU   9          3HD2      LEU   9   2.361   4.860   0.470
   63    H    ALA  10           H        ALA  10   3.006   6.721   4.309
   64    HA   ALA  10           HA       ALA  10   4.309   4.351   3.544
   65   1HB   ALA  10          1HB       ALA  10   5.203   4.891   6.103
   66   2HB   ALA  10          2HB       ALA  10   4.700   6.464   5.486
   67   3HB   ALA  10          3HB       ALA  10   5.887   5.507   4.599
   68    H    GLN  11           H        GLN  11   1.632   4.851   5.629
   69    HA   GLN  11           HA       GLN  11   2.040   2.480   7.206
   70   1HB   GLN  11          2HB       GLN  11   0.896   4.273   8.279
   71   2HB   GLN  11          1HB       GLN  11  -0.246   4.425   6.949
   72   1HG   GLN  11          2HG       GLN  11  -1.097   2.189   7.481
   73   2HG   GLN  11          1HG       GLN  11  -0.034   2.132   8.880
   74   1HE2  GLN  11          1HE2      GLN  11  -2.185   1.782   9.907
   75   2HE2  GLN  11          2HE2      GLN  11  -3.058   3.181  10.423
   76    H    ALA  12           H        ALA  12   0.017   3.438   4.463
   77    HA   ALA  12           HA       ALA  12  -1.596   1.194   4.265
   78   1HB   ALA  12          1HB       ALA  12  -1.345   3.394   2.797
   79   2HB   ALA  12          2HB       ALA  12  -2.134   1.941   2.180
   80   3HB   ALA  12          3HB       ALA  12  -0.454   2.283   1.754
   81    H    LYS  13           H        LYS  13   1.725   1.702   3.316
   82    HA   LYS  13           HA       LYS  13   1.982  -0.962   2.184
   83   1HB   LYS  13          2HB       LYS  13   4.510  -0.065   2.189
   84   2HB   LYS  13          1HB       LYS  13   3.353   0.335   0.932
   85   1HG   LYS  13          2HG       LYS  13   2.988   2.468   1.757
   86   2HG   LYS  13          1HG       LYS  13   3.677   2.073   3.336
   87   1HD   LYS  13          2HD       LYS  13   5.176   2.322   0.723
   88   2HD   LYS  13          1HD       LYS  13   5.216   3.468   2.062
   89   1HE   LYS  13          2HE       LYS  13   5.869   0.995   3.187
   90   2HE   LYS  13          1HE       LYS  13   6.745   1.057   1.658
   91   1HZ   LYS  13          1HZ       LYS  13   7.092   2.653   4.060
   92   2HZ   LYS  13          2HZ       LYS  13   7.236   3.490   2.598
   93   3HZ   LYS  13          3HZ       LYS  13   8.232   2.160   2.912
   94    H    GLU  14           H        GLU  14   3.470   0.906   4.845
   95    HA   GLU  14           HA       GLU  14   4.964  -1.117   6.005
   96   1HB   GLU  14          2HB       GLU  14   3.696   1.384   6.998
   97   2HB   GLU  14          1HB       GLU  14   4.160   0.205   8.216
   98   1HG   GLU  14          2HG       GLU  14   6.328   0.651   7.995
   99   2HG   GLU  14          1HG       GLU  14   6.240   0.674   6.236
  100    H    ALA  15           H        ALA  15   1.558  -0.434   6.127
  101    HA   ALA  15           HA       ALA  15   1.030  -2.524   8.080
  102   1HB   ALA  15          1HB       ALA  15  -1.073  -1.074   6.511
  103   2HB   ALA  15          2HB       ALA  15  -0.239  -0.297   7.856
  104   3HB   ALA  15          3HB       ALA  15  -1.174  -1.766   8.130
  105    H    ALA  16           H        ALA  16   0.890  -2.032   4.621
  106    HA   ALA  16           HA       ALA  16  -0.666  -4.354   4.037
  107   1HB   ALA  16          1HB       ALA  16   0.330  -3.977   1.691
  108   2HB   ALA  16          2HB       ALA  16   1.010  -2.504   2.378
  109   3HB   ALA  16          3HB       ALA  16  -0.736  -2.741   2.358
  110    H    ILE  17           H        ILE  17   2.709  -3.744   4.611
  111    HA   ILE  17           HA       ILE  17   3.651  -6.172   3.408
  112    HB   ILE  17           HB       ILE  17   5.176  -4.284   3.657
  113   1HG1  ILE  17          2HG1      ILE  17   6.168  -6.431   5.522
  114   2HG1  ILE  17          1HG1      ILE  17   5.942  -6.739   3.803
  115   1HG2  ILE  17          1HG2      ILE  17   5.579  -3.169   5.568
  116   2HG2  ILE  17          2HG2      ILE  17   5.531  -4.630   6.556
  117   3HG2  ILE  17          3HG2      ILE  17   4.031  -3.856   6.051
  118   1HD1  ILE  17          1HD1      ILE  17   7.453  -4.723   3.425
  119   2HD1  ILE  17          2HD1      ILE  17   8.198  -6.203   4.028
  120   3HD1  ILE  17          3HD1      ILE  17   7.864  -4.870   5.133
  121    H    LYS  18           H        LYS  18   2.686  -5.125   6.623
  122    HA   LYS  18           HA       LYS  18   3.549  -7.334   8.103
  123   1HB   LYS  18          2HB       LYS  18   2.102  -5.017   8.603
  124   2HB   LYS  18          1HB       LYS  18   0.957  -6.303   8.961
  125   1HG   LYS  18          2HG       LYS  18   3.685  -6.580  10.076
  126   2HG   LYS  18          1HG       LYS  18   2.645  -5.334  10.770
  127   1HD   LYS  18          2HD       LYS  18   1.905  -8.244  10.469
  128   2HD   LYS  18          1HD       LYS  18   2.478  -7.493  11.960
  129   1HE   LYS  18          2HE       LYS  18   0.308  -5.964  10.883
  130   2HE   LYS  18          1HE       LYS  18  -0.166  -7.658  11.006
  131   1HZ   LYS  18          1HZ       LYS  18   1.230  -6.585  13.303
  132   2HZ   LYS  18          2HZ       LYS  18  -0.125  -7.597  13.232
  133   3HZ   LYS  18          3HZ       LYS  18  -0.305  -5.929  13.018
  134    H    GLU  19           H        GLU  19   0.755  -6.860   6.053
  135    HA   GLU  19           HA       GLU  19  -0.543  -9.302   6.829
  136   1HB   GLU  19          2HB       GLU  19  -1.246  -7.007   5.356
  137   2HB   GLU  19          1HB       GLU  19  -1.350  -8.350   4.225
  138   1HG   GLU  19          2HG       GLU  19  -3.439  -8.483   5.050
  139   2HG   GLU  19          1HG       GLU  19  -2.636  -9.443   6.292
  140    H    LEU  20           H        LEU  20   1.496  -8.233   4.148
  141    HA   LEU  20           HA       LEU  20   1.357 -10.584   2.621
  142   1HB   LEU  20          2HB       LEU  20   2.672  -8.140   2.432
  143   2HB   LEU  20          1HB       LEU  20   3.971  -9.314   2.534
  144    HG   LEU  20           HG       LEU  20   2.150 -10.379   0.696
  145   1HD1  LEU  20          1HD1      LEU  20   2.267  -7.430   0.568
  146   2HD1  LEU  20          2HD1      LEU  20   0.990  -8.539   0.070
  147   3HD1  LEU  20          3HD1      LEU  20   2.407  -8.308  -0.955
  148   1HD2  LEU  20          1HD2      LEU  20   4.541  -8.879  -0.221
  149   2HD2  LEU  20          2HD2      LEU  20   3.961 -10.478  -0.686
  150   3HD2  LEU  20          3HD2      LEU  20   4.762 -10.248   0.867
  151    H    LYS  21           H        LYS  21   3.204  -9.713   5.446
  152    HA   LYS  21           HA       LYS  21   4.908 -12.043   5.312
  153   1HB   LYS  21          2HB       LYS  21   5.570  -9.800   6.320
  154   2HB   LYS  21          1HB       LYS  21   4.522 -10.201   7.673
  155   1HG   LYS  21          2HG       LYS  21   6.317 -12.377   7.107
  156   2HG   LYS  21          1HG       LYS  21   7.209 -10.874   7.344
  157   1HD   LYS  21          2HD       LYS  21   7.048 -11.418   9.525
  158   2HD   LYS  21          1HD       LYS  21   5.434 -10.721   9.378
  159   1HE   LYS  21          2HE       LYS  21   4.485 -12.914   8.990
  160   2HE   LYS  21          1HE       LYS  21   6.092 -13.642   9.008
  161   1HZ   LYS  21          1HZ       LYS  21   4.426 -12.771  11.220
  162   2HZ   LYS  21          2HZ       LYS  21   6.073 -12.418  11.370
  163   3HZ   LYS  21          3HZ       LYS  21   5.569 -14.017  11.148
  164    H    GLN  22           H        GLN  22   2.039 -10.965   7.049
  165    HA   GLN  22           HA       GLN  22   1.902 -13.208   8.805
  166   1HB   GLN  22          2HB       GLN  22   0.773 -11.035   9.243
  167   2HB   GLN  22          1HB       GLN  22  -0.325 -11.365   7.910
  168   1HG   GLN  22          2HG       GLN  22  -1.001 -13.456   9.138
  169   2HG   GLN  22          1HG       GLN  22  -0.090 -12.840  10.516
  170   1HE2  GLN  22          1HE2      GLN  22  -2.955 -12.580   8.635
  171   2HE2  GLN  22          2HE2      GLN  22  -3.756 -11.402   9.614
  172    H    TYR  23           H        TYR  23   0.742 -12.500   5.591
  173    HA   TYR  23           HA       TYR  23  -0.989 -14.782   5.400
  174   1HB   TYR  23          2HB       TYR  23  -0.068 -12.608   3.603
  175   2HB   TYR  23          1HB       TYR  23  -0.544 -14.117   2.822
  176    HD1  TYR  23           1HD      TYR  23  -1.686 -11.025   4.053
  177    HD2  TYR  23           2HD      TYR  23  -2.856 -15.085   3.580
  178    HE1  TYR  23           1HE      TYR  23  -4.042 -10.355   4.199
  179    HE2  TYR  23           2HE      TYR  23  -5.216 -14.429   3.725
  180    HH   TYR  23           HH       TYR  23  -6.334 -11.833   4.972
  181    H    GLY  24           H        GLY  24   2.279 -13.957   4.344
  182   1HA   GLY  24          2HA       GLY  24   3.967 -15.717   4.418
  183   2HA   GLY  24          1HA       GLY  24   2.739 -16.829   3.830
  184    H    ILE  25           H        ILE  25   2.115 -14.153   2.112
  185    HA   ILE  25           HA       ILE  25   2.948 -15.130  -0.330
  186    HB   ILE  25           HB       ILE  25   3.065 -12.195  -0.242
  187   1HG1  ILE  25          2HG1      ILE  25   0.567 -13.635   0.681
  188   2HG1  ILE  25          1HG1      ILE  25   1.487 -12.430   1.580
  189   1HG2  ILE  25          1HG2      ILE  25   2.762 -12.918  -2.358
  190   2HG2  ILE  25          2HG2      ILE  25   1.059 -12.808  -1.899
  191   3HG2  ILE  25          3HG2      ILE  25   1.886 -14.364  -1.859
  192   1HD1  ILE  25          1HD1      ILE  25  -0.408 -12.076  -0.674
  193   2HD1  ILE  25          2HD1      ILE  25   0.922 -10.936  -0.508
  194   3HD1  ILE  25          3HD1      ILE  25  -0.227 -11.145   0.813
  195    H    GLY  26           H        GLY  26   4.531 -13.866  -1.858
  196   1HA   GLY  26          2HA       GLY  26   7.145 -14.185  -0.685
  197   2HA   GLY  26          1HA       GLY  26   6.788 -13.799  -2.366
  198    H    ASP  27           H        ASP  27   8.845 -12.633  -0.808
  199    HA   ASP  27           HA       ASP  27   8.135 -10.100   0.231
  200   1HB   ASP  27          2HB       ASP  27  10.616  -9.605  -0.150
  201   2HB   ASP  27          1HB       ASP  27  10.242 -10.980   0.885
  202    H    TYR  28           H        TYR  28   8.578 -11.251  -3.000
  203    HA   TYR  28           HA       TYR  28   9.323  -9.033  -4.444
  204   1HB   TYR  28          2HB       TYR  28   8.350 -11.474  -5.125
  205   2HB   TYR  28          1HB       TYR  28   6.955 -10.469  -5.508
  206    HD1  TYR  28           1HD      TYR  28   8.649  -7.994  -6.240
  207    HD2  TYR  28           2HD      TYR  28   8.829 -12.075  -7.418
  208    HE1  TYR  28           1HE      TYR  28   9.684  -7.326  -8.352
  209    HE2  TYR  28           2HE      TYR  28   9.870 -11.418  -9.548
  210    HH   TYR  28           HH       TYR  28  10.076  -9.501 -10.984
  211    H    TYR  29           H        TYR  29   6.113  -9.868  -3.288
  212    HA   TYR  29           HA       TYR  29   4.913  -7.487  -4.288
  213   1HB   TYR  29          2HB       TYR  29   3.729  -9.425  -2.303
  214   2HB   TYR  29          1HB       TYR  29   2.871  -8.326  -3.376
  215    HD1  TYR  29           1HD      TYR  29   2.585 -11.397  -3.211
  216    HD2  TYR  29           2HD      TYR  29   4.866  -8.835  -5.743
  217    HE1  TYR  29           1HE      TYR  29   2.592 -13.134  -4.951
  218    HE2  TYR  29           2HE      TYR  29   4.884 -10.576  -7.481
  219    HH   TYR  29           HH       TYR  29   4.635 -13.053  -7.623
  220    H    ILE  30           H        ILE  30   6.508  -8.225  -1.296
  221    HA   ILE  30           HA       ILE  30   5.220  -6.111   0.169
  222    HB   ILE  30           HB       ILE  30   6.548  -6.611   1.946
  223   1HG1  ILE  30          2HG1      ILE  30   8.904  -7.683   1.599
  224   2HG1  ILE  30          1HG1      ILE  30   8.748  -7.029  -0.029
  225   1HG2  ILE  30          1HG2      ILE  30   5.617  -8.675   1.740
  226   2HG2  ILE  30          2HG2      ILE  30   7.329  -9.081   1.785
  227   3HG2  ILE  30          3HG2      ILE  30   6.475  -9.042   0.246
  228   1HD1  ILE  30          1HD1      ILE  30   8.029  -4.911   1.541
  229   2HD1  ILE  30          2HD1      ILE  30   9.619  -5.172   0.821
  230   3HD1  ILE  30          3HD1      ILE  30   9.309  -5.682   2.481
  231    H    LYS  31           H        LYS  31   7.979  -6.527  -1.891
  232    HA   LYS  31           HA       LYS  31   9.051  -3.887  -1.480
  233   1HB   LYS  31          2HB       LYS  31   9.718  -6.243  -3.182
  234   2HB   LYS  31          1HB       LYS  31  10.370  -4.673  -3.625
  235   1HG   LYS  31          2HG       LYS  31  11.997  -4.930  -2.148
  236   2HG   LYS  31          1HG       LYS  31  10.807  -5.024  -0.849
  237   1HD   LYS  31          2HD       LYS  31  10.565  -7.503  -1.696
  238   2HD   LYS  31          1HD       LYS  31  12.186  -7.212  -2.331
  239   1HE   LYS  31          2HE       LYS  31  12.447  -6.229   0.173
  240   2HE   LYS  31          1HE       LYS  31  11.260  -7.503   0.450
  241   1HZ   LYS  31          1HZ       LYS  31  12.932  -8.897  -0.953
  242   2HZ   LYS  31          2HZ       LYS  31  13.213  -8.640   0.695
  243   3HZ   LYS  31          3HZ       LYS  31  14.044  -7.721  -0.458
  244    H    LEU  32           H        LEU  32   7.394  -5.596  -4.136
  245    HA   LEU  32           HA       LEU  32   7.342  -3.548  -5.975
  246   1HB   LEU  32          2HB       LEU  32   6.105  -4.976  -7.196
  247   2HB   LEU  32          1HB       LEU  32   6.355  -6.083  -5.869
  248    HG   LEU  32           HG       LEU  32   4.072  -6.194  -6.351
  249   1HD1  LEU  32          1HD1      LEU  32   5.049  -5.203  -3.943
  250   2HD1  LEU  32          2HD1      LEU  32   3.539  -6.092  -4.209
  251   3HD1  LEU  32          3HD1      LEU  32   3.546  -4.327  -4.248
  252   1HD2  LEU  32          1HD2      LEU  32   4.329  -3.732  -7.463
  253   2HD2  LEU  32          2HD2      LEU  32   3.433  -3.348  -5.994
  254   3HD2  LEU  32          3HD2      LEU  32   2.785  -4.520  -7.140
  255    H    ILE  33           H        ILE  33   5.758  -3.731  -2.974
  256    HA   ILE  33           HA       ILE  33   3.633  -1.878  -3.504
  257    HB   ILE  33           HB       ILE  33   4.742  -3.258  -1.096
  258   1HG1  ILE  33          2HG1      ILE  33   2.073  -3.023  -2.461
  259   2HG1  ILE  33          1HG1      ILE  33   3.077  -4.453  -2.257
  260   1HG2  ILE  33          1HG2      ILE  33   4.154  -1.746   0.416
  261   2HG2  ILE  33          2HG2      ILE  33   2.557  -1.568  -0.303
  262   3HG2  ILE  33          3HG2      ILE  33   3.899  -0.594  -0.890
  263   1HD1  ILE  33          1HD1      ILE  33   2.404  -3.477   0.320
  264   2HD1  ILE  33          2HD1      ILE  33   1.936  -4.991  -0.450
  265   3HD1  ILE  33          3HD1      ILE  33   0.936  -3.553  -0.655
  266    H    ASN  34           H        ASN  34   6.625  -1.719  -1.573
  267    HA   ASN  34           HA       ASN  34   6.565   0.965  -0.925
  268   1HB   ASN  34          2HB       ASN  34   8.166  -0.674  -0.002
  269   2HB   ASN  34          1HB       ASN  34   9.019  -0.690  -1.542
  270   1HD2  ASN  34          1HD2      ASN  34   9.119   0.505   1.472
  271   2HD2  ASN  34          2HD2      ASN  34  10.027   1.950   1.201
  272    H    ASN  35           H        ASN  35   7.227  -0.485  -3.996
  273    HA   ASN  35           HA       ASN  35   8.717   1.637  -5.138
  274   1HB   ASN  35          2HB       ASN  35   8.257  -0.861  -5.929
  275   2HB   ASN  35          1HB       ASN  35   6.991  -0.070  -6.862
  276   1HD2  ASN  35          1HD2      ASN  35  10.163  -1.002  -6.852
  277   2HD2  ASN  35          2HD2      ASN  35  10.750  -0.003  -8.134
  278    H    ALA  36           H        ALA  36   5.352   1.248  -4.484
  279    HA   ALA  36           HA       ALA  36   4.290   2.906  -6.503
  280   1HB   ALA  36          1HB       ALA  36   2.586   3.218  -4.358
  281   2HB   ALA  36          2HB       ALA  36   3.327   1.642  -4.078
  282   3HB   ALA  36          3HB       ALA  36   2.491   1.965  -5.596
  283    H    LYS  37           H        LYS  37   3.549   5.059  -6.406
  284    HA   LYS  37           HA       LYS  37   5.233   6.770  -4.734
  285   1HB   LYS  37          2HB       LYS  37   4.048   6.970  -7.414
  286   2HB   LYS  37          1HB       LYS  37   3.922   8.445  -6.467
  287   1HG   LYS  37          2HG       LYS  37   5.930   8.391  -7.869
  288   2HG   LYS  37          1HG       LYS  37   6.319   8.490  -6.149
  289   1HD   LYS  37          2HD       LYS  37   7.775   6.899  -7.306
  290   2HD   LYS  37          1HD       LYS  37   6.760   6.085  -6.109
  291   1HE   LYS  37          2HE       LYS  37   6.934   4.869  -8.266
  292   2HE   LYS  37          1HE       LYS  37   5.282   5.287  -7.814
  293   1HZ   LYS  37          1HZ       LYS  37   5.363   7.146  -9.335
  294   2HZ   LYS  37          2HZ       LYS  37   5.717   5.717 -10.157
  295   3HZ   LYS  37          3HZ       LYS  37   6.963   6.785  -9.751
  296    H    THR  38           H        THR  38   1.883   6.069  -5.486
  297    HA   THR  38           HA       THR  38   0.941   8.114  -3.628
  298    HB   THR  38           HB       THR  38  -1.245   7.708  -4.502
  299    HG1  THR  38           1HG      THR  38  -1.744   5.735  -4.944
  300   1HG2  THR  38          1HG2      THR  38  -1.060   8.173  -6.777
  301   2HG2  THR  38          2HG2      THR  38   0.449   7.275  -6.933
  302   3HG2  THR  38          3HG2      THR  38   0.423   8.814  -6.074
  303    H    VAL  39           H        VAL  39  -1.485   6.423  -3.004
  304    HA   VAL  39           HA       VAL  39  -0.244   4.373  -1.338
  305    HB   VAL  39           HB       VAL  39  -0.731   6.652  -0.122
  306   1HG1  VAL  39          1HG1      VAL  39  -3.131   6.646  -0.765
  307   2HG1  VAL  39          2HG1      VAL  39  -2.846   6.719   0.977
  308   3HG1  VAL  39          3HG1      VAL  39  -3.335   5.200   0.224
  309   1HG2  VAL  39          1HG2      VAL  39  -1.309   5.126   1.914
  310   2HG2  VAL  39          2HG2      VAL  39   0.255   4.983   1.105
  311   3HG2  VAL  39          3HG2      VAL  39  -1.030   3.832   0.751
  312    H    GLU  40           H        GLU  40  -3.282   5.732  -2.554
  313    HA   GLU  40           HA       GLU  40  -5.044   3.765  -1.804
  314   1HB   GLU  40          2HB       GLU  40  -4.896   5.688  -4.040
  315   2HB   GLU  40          1HB       GLU  40  -5.973   4.322  -4.287
  316   1HG   GLU  40          2HG       GLU  40  -6.154   5.815  -1.728
  317   2HG   GLU  40          1HG       GLU  40  -6.805   6.560  -3.185
  318    H    GLY  41           H        GLY  41  -2.598   3.636  -4.285
  319   1HA   GLY  41          2HA       GLY  41  -3.590   1.097  -5.312
  320   2HA   GLY  41          1HA       GLY  41  -2.186   1.983  -5.897
  321    H    VAL  42           H        VAL  42  -1.077   2.325  -3.225
  322    HA   VAL  42           HA       VAL  42   0.620   0.124  -3.100
  323    HB   VAL  42           HB       VAL  42  -0.066   1.969  -0.814
  324   1HG1  VAL  42          1HG1      VAL  42   1.151   0.202   0.080
  325   2HG1  VAL  42          2HG1      VAL  42   2.389   1.410  -0.286
  326   3HG1  VAL  42          3HG1      VAL  42   2.147   0.037  -1.372
  327   1HG2  VAL  42          1HG2      VAL  42   0.761   2.918  -3.135
  328   2HG2  VAL  42          2HG2      VAL  42   2.322   2.351  -2.546
  329   3HG2  VAL  42          3HG2      VAL  42   1.409   3.530  -1.614
  330    H    GLU  43           H        GLU  43  -2.163   0.905  -1.029
  331    HA   GLU  43           HA       GLU  43  -1.982  -1.495   0.493
  332   1HB   GLU  43          2HB       GLU  43  -4.498  -0.801   0.977
  333   2HB   GLU  43          1HB       GLU  43  -3.149   0.079   1.683
  334   1HG   GLU  43          2HG       GLU  43  -3.356   1.838   0.133
  335   2HG   GLU  43          1HG       GLU  43  -4.447   0.907  -0.894
  336    H    SER  44           H        SER  44  -4.200  -0.462  -2.087
  337    HA   SER  44           HA       SER  44  -5.607  -2.890  -2.258
  338   1HB   SER  44          2HB       SER  44  -6.731  -1.913  -4.007
  339   2HB   SER  44          1HB       SER  44  -6.016  -0.465  -3.296
  340    HG   SER  44           HG       SER  44  -4.257  -0.789  -4.822
  341    H    LEU  45           H        LEU  45  -2.511  -1.913  -3.387
  342    HA   LEU  45           HA       LEU  45  -2.119  -3.602  -5.575
  343   1HB   LEU  45          2HB       LEU  45  -0.446  -2.104  -3.695
  344   2HB   LEU  45          1HB       LEU  45   0.341  -3.528  -4.335
  345   1HD1  LEU  45          1HD1      LEU  45   1.994  -2.114  -6.409
  346   2HD1  LEU  45          2HD1      LEU  45   0.847  -2.774  -7.577
  347   3HD1  LEU  45          3HD1      LEU  45   1.243  -3.684  -6.118
  348   1HD2  LEU  45          1HD2      LEU  45  -1.081  -0.880  -7.289
  349   2HD2  LEU  45          2HD2      LEU  45  -2.141  -1.686  -6.135
  350   3HD2  LEU  45          3HD2      LEU  45  -1.335  -2.621  -7.392
  351    H    LYS  46           H        LYS  46  -1.085  -4.191  -2.206
  352    HA   LYS  46           HA       LYS  46  -0.459  -6.916  -2.719
  353   1HB   LYS  46          2HB       LYS  46   0.713  -6.431  -0.882
  354   2HB   LYS  46          1HB       LYS  46  -0.315  -5.072  -0.462
  355   1HG   LYS  46          2HG       LYS  46  -1.210  -7.878   0.084
  356   2HG   LYS  46          1HG       LYS  46  -0.072  -7.069   1.167
  357   1HD   LYS  46          2HD       LYS  46  -1.632  -5.297   1.591
  358   2HD   LYS  46          1HD       LYS  46  -2.739  -5.909   0.367
  359   1HE   LYS  46          2HE       LYS  46  -3.600  -7.460   1.744
  360   2HE   LYS  46          1HE       LYS  46  -2.029  -7.854   2.439
  361   1HZ   LYS  46          1HZ       LYS  46  -2.178  -6.021   3.908
  362   2HZ   LYS  46          2HZ       LYS  46  -3.659  -6.831   4.005
  363   3HZ   LYS  46          3HZ       LYS  46  -3.539  -5.395   3.120
  364    H    ASN  47           H        ASN  47  -3.284  -5.273  -1.387
  365    HA   ASN  47           HA       ASN  47  -4.651  -7.604  -0.559
  366   1HB   ASN  47          2HB       ASN  47  -5.241  -5.219   0.067
  367   2HB   ASN  47          1HB       ASN  47  -5.945  -5.048  -1.538
  368   1HD2  ASN  47          1HD2      ASN  47  -8.009  -4.721  -0.799
  369   2HD2  ASN  47          2HD2      ASN  47  -8.953  -5.968  -0.065
  370    H    GLU  48           H        GLU  48  -4.157  -6.144  -3.652
  371    HA   GLU  48           HA       GLU  48  -6.277  -7.616  -4.957
  372   1HB   GLU  48          2HB       GLU  48  -4.212  -5.653  -5.783
  373   2HB   GLU  48          1HB       GLU  48  -4.709  -6.808  -7.009
  374   1HG   GLU  48          2HG       GLU  48  -6.922  -5.561  -5.555
  375   2HG   GLU  48          1HG       GLU  48  -5.940  -4.445  -6.504
  376    H    ILE  49           H        ILE  49  -2.843  -7.899  -4.414
  377    HA   ILE  49           HA       ILE  49  -2.372 -10.069  -6.193
  378    HB   ILE  49           HB       ILE  49  -0.252 -10.330  -5.150
  379   1HG1  ILE  49          2HG1      ILE  49  -0.802  -8.508  -2.871
  380   2HG1  ILE  49          1HG1      ILE  49  -1.416 -10.143  -2.750
  381   1HG2  ILE  49          1HG2      ILE  49   0.553  -8.389  -5.862
  382   2HG2  ILE  49          2HG2      ILE  49  -0.269  -7.492  -4.586
  383   3HG2  ILE  49          3HG2      ILE  49  -1.124  -7.887  -6.077
  384   1HD1  ILE  49          1HD1      ILE  49   0.684 -11.047  -2.680
  385   2HD1  ILE  49          2HD1      ILE  49   0.888  -9.533  -1.793
  386   3HD1  ILE  49          3HD1      ILE  49   1.419  -9.652  -3.470
  387    H    LEU  50           H        LEU  50  -3.604  -9.744  -2.990
  388    HA   LEU  50           HA       LEU  50  -3.400 -12.528  -2.312
  389   1HB   LEU  50          2HB       LEU  50  -4.755 -10.160  -1.027
  390   2HB   LEU  50          1HB       LEU  50  -4.818 -11.775  -0.345
  391    HG   LEU  50           HG       LEU  50  -2.122 -10.731  -0.956
  392   1HD1  LEU  50          1HD1      LEU  50  -3.138  -8.729  -0.081
  393   2HD1  LEU  50          2HD1      LEU  50  -2.049  -9.421   1.122
  394   3HD1  LEU  50          3HD1      LEU  50  -3.793  -9.624   1.290
  395   1HD2  LEU  50          1HD2      LEU  50  -3.446 -12.528   0.989
  396   2HD2  LEU  50          2HD2      LEU  50  -2.000 -11.676   1.534
  397   3HD2  LEU  50          3HD2      LEU  50  -1.926 -12.723   0.112
  398    H    LYS  51           H        LYS  51  -5.810 -10.334  -3.607
  399    HA   LYS  51           HA       LYS  51  -8.075 -11.971  -3.302
  400   1HB   LYS  51          2HB       LYS  51  -7.402  -9.523  -4.651
  401   2HB   LYS  51          1HB       LYS  51  -8.338 -10.544  -5.735
  402   1HG   LYS  51          2HG       LYS  51  -9.980  -9.340  -4.674
  403   2HG   LYS  51          1HG       LYS  51  -9.924 -10.809  -3.698
  404   1HD   LYS  51          2HD       LYS  51  -8.754  -9.745  -1.964
  405   2HD   LYS  51          1HD       LYS  51  -8.302  -8.382  -2.991
  406   1HE   LYS  51          2HE       LYS  51 -10.295  -7.340  -2.715
  407   2HE   LYS  51          1HE       LYS  51 -11.196  -8.854  -2.633
  408   1HZ   LYS  51          1HZ       LYS  51 -10.575  -9.147  -0.382
  409   2HZ   LYS  51          2HZ       LYS  51 -11.109  -7.548  -0.522
  410   3HZ   LYS  51          3HZ       LYS  51  -9.452  -7.882  -0.440
  411    H    ALA  52           H        ALA  52  -5.338 -12.185  -5.359
  412    HA   ALA  52           HA       ALA  52  -6.412 -14.604  -6.566
  413   1HB   ALA  52          1HB       ALA  52  -5.713 -13.936  -8.824
  414   2HB   ALA  52          2HB       ALA  52  -5.292 -12.336  -8.211
  415   3HB   ALA  52          3HB       ALA  52  -6.972 -12.877  -8.187
  416    H    LEU  53           H        LEU  53  -4.819 -15.342  -4.924
  417    HA   LEU  53           HA       LEU  53  -2.045 -14.841  -5.288
  418   1HB   LEU  53          2HB       LEU  53  -3.724 -16.372  -3.501
  419   2HB   LEU  53          1HB       LEU  53  -2.312 -17.299  -3.972
  420    HG   LEU  53           HG       LEU  53  -1.352 -14.735  -3.322
  421   1HD1  LEU  53          1HD1      LEU  53  -2.206 -14.204  -1.205
  422   2HD1  LEU  53          2HD1      LEU  53  -3.063 -15.739  -1.069
  423   3HD1  LEU  53          3HD1      LEU  53  -3.629 -14.511  -2.201
  424   1HD2  LEU  53          1HD2      LEU  53   0.072 -16.450  -2.827
  425   2HD2  LEU  53          2HD2      LEU  53  -1.209 -17.480  -2.188
  426   3HD2  LEU  53          3HD2      LEU  53  -0.591 -16.141  -1.222
  427    HA   PRO  54           HA       PRO  54  -1.475 -17.371  -8.946
  428   1HB   PRO  54          2HB       PRO  54   1.342 -17.299  -7.987
  429   2HB   PRO  54          1HB       PRO  54   0.686 -16.917  -9.583
  430   1HG   PRO  54          2HG       PRO  54   1.471 -14.975  -7.943
  431   2HG   PRO  54          1HG       PRO  54   0.020 -14.788  -8.945
  432   1HD   PRO  54          2HD       PRO  54   0.246 -15.380  -6.025
  433   2HD   PRO  54          1HD       PRO  54  -0.935 -14.370  -6.884
  434    H    THR  55           H        THR  55  -2.543 -19.211  -8.016
  435    HA   THR  55           HA       THR  55  -2.663 -21.379  -7.338
  436    HB   THR  55           HB       THR  55   0.313 -21.630  -7.597
  437    HG1  THR  55           1HG      THR  55   0.114 -20.747  -9.495
  438   1HG2  THR  55          1HG2      THR  55  -0.667 -23.664  -8.989
  439   2HG2  THR  55          2HG2      THR  55  -2.026 -23.409  -7.894
  440   3HG2  THR  55          3HG2      THR  55  -0.418 -23.736  -7.245
  441    H    GLU  56           H        GLU  56  -3.251 -20.960  -5.210
  442    HA   GLU  56           HA       GLU  56  -1.191 -20.600  -3.199
  443   1HB   GLU  56          2HB       GLU  56  -3.569 -19.517  -3.275
  444   2HB   GLU  56          1HB       GLU  56  -4.089 -21.042  -2.572
  445   1HG   GLU  56          2HG       GLU  56  -2.521 -20.702  -0.715
  446   2HG   GLU  56          1HG       GLU  56  -2.052 -19.153  -1.414
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1   1.667  19.425  13.150
    2   2H    MET   1          2HT       MET   1   0.518  20.544  12.540
    3   3H    MET   1          3HT       MET   1   2.010  20.300  11.717
    4    HA   MET   1           HA       MET   1   1.422  18.152  11.101
    5   1HB   MET   1          2HB       MET   1   0.031  18.110  13.430
    6   2HB   MET   1          1HB       MET   1  -1.287  18.292  12.281
    7   1HG   MET   1          2HG       MET   1   0.795  16.114  12.206
    8   2HG   MET   1          1HG       MET   1  -0.844  15.951  12.839
    9   1HE   MET   1          1HE       MET   1  -1.951  14.085  11.149
   10   2HE   MET   1          2HE       MET   1  -2.888  14.997   9.967
   11   3HE   MET   1          3HE       MET   1  -2.810  15.546  11.641
   12    H    GLU   2           H        GLU   2   1.349  20.583   9.852
   13    HA   GLU   2           HA       GLU   2  -1.145  21.365   8.824
   14   1HB   GLU   2          2HB       GLU   2   1.656  21.957   8.316
   15   2HB   GLU   2          1HB       GLU   2   0.707  21.958   6.834
   16   1HG   GLU   2          2HG       GLU   2   0.261  24.071   7.365
   17   2HG   GLU   2          1HG       GLU   2  -0.892  23.386   8.497
   18    H    ALA   3           H        ALA   3   1.378  19.309   7.372
   19    HA   ALA   3           HA       ALA   3  -0.616  17.648   6.114
   20   1HB   ALA   3          1HB       ALA   3   1.270  19.017   4.229
   21   2HB   ALA   3          2HB       ALA   3  -0.292  19.731   4.630
   22   3HB   ALA   3          3HB       ALA   3  -0.213  18.139   3.871
   23    H    VAL   4           H        VAL   4   0.125  15.632   6.077
   24    HA   VAL   4           HA       VAL   4   2.923  15.078   5.542
   25    HB   VAL   4           HB       VAL   4   1.704  14.030   8.099
   26   1HG1  VAL   4          1HG1      VAL   4   4.619  14.121   7.460
   27   2HG1  VAL   4          2HG1      VAL   4   3.614  12.847   6.772
   28   3HG1  VAL   4          3HG1      VAL   4   3.737  13.030   8.523
   29   1HG2  VAL   4          1HG2      VAL   4   1.974  16.423   8.335
   30   2HG2  VAL   4          2HG2      VAL   4   3.625  16.331   7.724
   31   3HG2  VAL   4          3HG2      VAL   4   3.216  15.596   9.273
   32    H    ASP   5           H        ASP   5   1.002  14.456   3.845
   33    HA   ASP   5           HA       ASP   5  -0.461  12.123   4.188
   34   1HB   ASP   5          2HB       ASP   5  -0.254  11.935   1.644
   35   2HB   ASP   5          1HB       ASP   5  -0.956  13.417   2.279
   36    H    ALA   6           H        ALA   6   2.935  12.565   3.519
   37    HA   ALA   6           HA       ALA   6   3.601  10.054   2.510
   38   1HB   ALA   6          1HB       ALA   6   5.796  10.650   3.973
   39   2HB   ALA   6          2HB       ALA   6   5.034  12.236   3.857
   40   3HB   ALA   6          3HB       ALA   6   5.438  11.344   2.391
   41    H    ASN   7           H        ASN   7   3.004  11.094   5.812
   42    HA   ASN   7           HA       ASN   7   3.987   8.776   7.104
   43   1HB   ASN   7          2HB       ASN   7   3.252  11.147   8.035
   44   2HB   ASN   7          1HB       ASN   7   1.720  10.322   8.281
   45   1HD2  ASN   7          1HD2      ASN   7   3.762  11.387  10.163
   46   2HD2  ASN   7          2HD2      ASN   7   4.144  10.062  11.203
   47    H    SER   8           H        SER   8   0.735   9.757   6.080
   48    HA   SER   8           HA       SER   8  -0.535   7.368   6.946
   49   1HB   SER   8          2HB       SER   8  -2.309   8.225   5.192
   50   2HB   SER   8          1HB       SER   8  -2.051   9.105   6.700
   51    HG   SER   8           HG       SER   8  -1.614   9.892   4.139
   52    H    LEU   9           H        LEU   9   1.058   8.372   4.012
   53    HA   LEU   9           HA       LEU   9   0.107   6.292   2.336
   54   1HB   LEU   9          2HB       LEU   9   1.160   8.444   1.590
   55   2HB   LEU   9          1HB       LEU   9   2.706   7.802   2.107
   56    HG   LEU   9           HG       LEU   9   0.987   6.540  -0.022
   57   1HD1  LEU   9          1HD1      LEU   9   3.285   8.455  -0.216
   58   2HD1  LEU   9          2HD1      LEU   9   1.659   8.640  -0.871
   59   3HD1  LEU   9          3HD1      LEU   9   2.756   7.441  -1.559
   60   1HD2  LEU   9          1HD2      LEU   9   3.498   5.691  -0.477
   61   2HD2  LEU   9          2HD2      LEU   9   2.327   4.806   0.500
   62   3HD2  LEU   9          3HD2      LEU   9   3.531   5.832   1.280
   63    H    ALA  10           H        ALA  10   3.045   6.715   4.272
   64    HA   ALA  10           HA       ALA  10   4.299   4.310   3.525
   65   1HB   ALA  10          1HB       ALA  10   4.854   5.344   6.228
   66   2HB   ALA  10          2HB       ALA  10   5.090   6.478   4.897
   67   3HB   ALA  10          3HB       ALA  10   5.958   4.943   4.912
   68    H    GLN  11           H        GLN  11   1.648   4.882   5.617
   69    HA   GLN  11           HA       GLN  11   2.038   2.535   7.235
   70   1HB   GLN  11          2HB       GLN  11   0.940   4.362   8.296
   71   2HB   GLN  11          1HB       GLN  11  -0.211   4.522   6.975
   72   1HG   GLN  11          2HG       GLN  11  -1.098   2.304   7.548
   73   2HG   GLN  11          1HG       GLN  11  -0.029   2.259   8.944
   74   1HE2  GLN  11          1HE2      GLN  11  -1.732   2.153  10.393
   75   2HE2  GLN  11          2HE2      GLN  11  -2.752   3.506  10.723
   76    H    ALA  12           H        ALA  12  -0.029   3.494   4.521
   77    HA   ALA  12           HA       ALA  12  -1.665   1.263   4.377
   78   1HB   ALA  12          1HB       ALA  12  -0.591   2.322   1.827
   79   2HB   ALA  12          2HB       ALA  12  -1.429   3.457   2.891
   80   3HB   ALA  12          3HB       ALA  12  -2.260   2.011   2.311
   81    H    LYS  13           H        LYS  13   1.634   1.734   3.336
   82    HA   LYS  13           HA       LYS  13   1.833  -0.931   2.192
   83   1HB   LYS  13          2HB       LYS  13   4.371  -0.070   2.138
   84   2HB   LYS  13          1HB       LYS  13   3.190   0.366   0.917
   85   1HG   LYS  13          2HG       LYS  13   2.912   2.501   1.743
   86   2HG   LYS  13          1HG       LYS  13   3.573   2.076   3.328
   87   1HD   LYS  13          2HD       LYS  13   5.129   2.230   0.740
   88   2HD   LYS  13          1HD       LYS  13   5.147   3.442   2.021
   89   1HE   LYS  13          2HE       LYS  13   5.715   0.935   3.210
   90   2HE   LYS  13          1HE       LYS  13   6.718   1.075   1.765
   91   1HZ   LYS  13          1HZ       LYS  13   7.045   3.490   2.819
   92   2HZ   LYS  13          2HZ       LYS  13   8.053   2.181   3.179
   93   3HZ   LYS  13          3HZ       LYS  13   6.802   2.600   4.237
   94    H    GLU  14           H        GLU  14   3.404   0.914   4.817
   95    HA   GLU  14           HA       GLU  14   4.913  -1.114   5.937
   96   1HB   GLU  14          2HB       GLU  14   3.594   1.341   7.026
   97   2HB   GLU  14          1HB       GLU  14   4.232   0.169   8.171
   98   1HG   GLU  14          2HG       GLU  14   6.275   0.495   6.330
   99   2HG   GLU  14          1HG       GLU  14   5.622   2.116   6.552
  100    H    ALA  15           H        ALA  15   1.520  -0.359   6.225
  101    HA   ALA  15           HA       ALA  15   0.980  -2.440   8.160
  102   1HB   ALA  15          1HB       ALA  15  -0.302  -0.227   7.839
  103   2HB   ALA  15          2HB       ALA  15  -1.227  -1.694   8.162
  104   3HB   ALA  15          3HB       ALA  15  -1.118  -1.066   6.517
  105    H    ALA  16           H        ALA  16   0.408  -1.931   4.689
  106    HA   ALA  16           HA       ALA  16  -0.931  -4.356   4.189
  107   1HB   ALA  16          1HB       ALA  16   0.614  -2.462   2.445
  108   2HB   ALA  16          2HB       ALA  16  -1.124  -2.761   2.498
  109   3HB   ALA  16          3HB       ALA  16  -0.043  -3.968   1.802
  110    H    ILE  17           H        ILE  17   2.411  -3.596   4.654
  111    HA   ILE  17           HA       ILE  17   3.495  -5.925   3.420
  112    HB   ILE  17           HB       ILE  17   4.505  -3.588   4.757
  113   1HG1  ILE  17          2HG1      ILE  17   6.477  -5.319   3.485
  114   2HG1  ILE  17          1HG1      ILE  17   5.036  -5.098   2.497
  115   1HG2  ILE  17          1HG2      ILE  17   6.456  -4.537   5.884
  116   2HG2  ILE  17          2HG2      ILE  17   5.815  -6.160   5.625
  117   3HG2  ILE  17          3HG2      ILE  17   4.951  -5.027   6.664
  118   1HD1  ILE  17          1HD1      ILE  17   6.741  -2.898   3.641
  119   2HD1  ILE  17          2HD1      ILE  17   5.304  -2.682   2.639
  120   3HD1  ILE  17          3HD1      ILE  17   6.741  -3.453   1.966
  121    H    LYS  18           H        LYS  18   2.416  -5.064   6.641
  122    HA   LYS  18           HA       LYS  18   3.395  -7.268   8.060
  123   1HB   LYS  18          2HB       LYS  18   1.585  -5.088   8.506
  124   2HB   LYS  18          1HB       LYS  18   0.868  -6.566   9.135
  125   1HG   LYS  18          2HG       LYS  18   2.447  -6.810  10.756
  126   2HG   LYS  18          1HG       LYS  18   3.705  -6.017   9.805
  127   1HD   LYS  18          2HD       LYS  18   2.709  -3.853  10.225
  128   2HD   LYS  18          1HD       LYS  18   1.356  -4.607  11.071
  129   1HE   LYS  18          2HE       LYS  18   2.943  -5.490  12.746
  130   2HE   LYS  18          1HE       LYS  18   4.251  -4.644  11.920
  131   1HZ   LYS  18          1HZ       LYS  18   1.957  -3.023  12.661
  132   2HZ   LYS  18          2HZ       LYS  18   3.607  -2.664  12.741
  133   3HZ   LYS  18          3HZ       LYS  18   2.893  -3.609  13.942
  134    H    GLU  19           H        GLU  19   0.588  -6.884   6.004
  135    HA   GLU  19           HA       GLU  19  -0.626  -9.369   6.746
  136   1HB   GLU  19          2HB       GLU  19  -1.231  -7.151   4.973
  137   2HB   GLU  19          1HB       GLU  19  -1.557  -8.693   4.194
  138   1HG   GLU  19          2HG       GLU  19  -3.565  -8.069   5.223
  139   2HG   GLU  19          1HG       GLU  19  -2.870  -9.310   6.264
  140    H    LEU  20           H        LEU  20   1.437  -8.264   4.095
  141    HA   LEU  20           HA       LEU  20   1.424 -10.667   2.634
  142   1HB   LEU  20          2HB       LEU  20   2.633  -8.157   2.399
  143   2HB   LEU  20          1HB       LEU  20   3.965  -9.294   2.487
  144    HG   LEU  20           HG       LEU  20   2.152 -10.437   0.699
  145   1HD1  LEU  20          1HD1      LEU  20   2.102  -7.496   0.573
  146   2HD1  LEU  20          2HD1      LEU  20   0.909  -8.679   0.036
  147   3HD1  LEU  20          3HD1      LEU  20   2.323  -8.337  -0.962
  148   1HD2  LEU  20          1HD2      LEU  20   3.926 -10.436  -0.755
  149   2HD2  LEU  20          2HD2      LEU  20   4.743 -10.245   0.794
  150   3HD2  LEU  20          3HD2      LEU  20   4.483  -8.843  -0.243
  151    H    LYS  21           H        LYS  21   3.167  -9.617   5.457
  152    HA   LYS  21           HA       LYS  21   5.023 -11.833   5.405
  153   1HB   LYS  21          2HB       LYS  21   5.664  -9.629   6.342
  154   2HB   LYS  21          1HB       LYS  21   4.454  -9.832   7.602
  155   1HG   LYS  21          2HG       LYS  21   5.744 -12.031   8.115
  156   2HG   LYS  21          1HG       LYS  21   7.053 -11.246   7.230
  157   1HD   LYS  21          2HD       LYS  21   7.592 -10.219   9.133
  158   2HD   LYS  21          1HD       LYS  21   6.106  -9.284   8.959
  159   1HE   LYS  21          2HE       LYS  21   6.332 -10.381  11.172
  160   2HE   LYS  21          1HE       LYS  21   4.885 -10.870  10.289
  161   1HZ   LYS  21          1HZ       LYS  21   7.339 -12.477  10.065
  162   2HZ   LYS  21          2HZ       LYS  21   5.727 -12.956   9.892
  163   3HZ   LYS  21          3HZ       LYS  21   6.355 -12.646  11.431
  164    H    GLN  22           H        GLN  22   2.022 -10.941   6.995
  165    HA   GLN  22           HA       GLN  22   2.037 -13.183   8.794
  166   1HB   GLN  22          2HB       GLN  22   0.842 -10.990   9.199
  167   2HB   GLN  22          1HB       GLN  22  -0.331 -11.490   7.989
  168   1HG   GLN  22          2HG       GLN  22  -1.322 -12.057  10.010
  169   2HG   GLN  22          1HG       GLN  22  -0.654 -13.578   9.422
  170   1HE2  GLN  22          1HE2      GLN  22  -0.340 -14.593  11.325
  171   2HE2  GLN  22          2HE2      GLN  22   0.734 -14.040  12.559
  172    H    TYR  23           H        TYR  23   0.859 -12.501   5.592
  173    HA   TYR  23           HA       TYR  23  -0.850 -14.803   5.414
  174   1HB   TYR  23          2HB       TYR  23   0.048 -12.635   3.586
  175   2HB   TYR  23          1HB       TYR  23  -0.471 -14.148   2.839
  176    HD1  TYR  23           1HD      TYR  23  -2.760 -15.083   3.899
  177    HD2  TYR  23           2HD      TYR  23  -1.545 -11.009   3.834
  178    HE1  TYR  23           1HE      TYR  23  -5.105 -14.387   4.105
  179    HE2  TYR  23           2HE      TYR  23  -3.885 -10.300   4.041
  180    HH   TYR  23           HH       TYR  23  -6.245 -11.510   3.377
  181    H    GLY  24           H        GLY  24   2.391 -13.928   4.298
  182   1HA   GLY  24          2HA       GLY  24   4.099 -15.676   4.374
  183   2HA   GLY  24          1HA       GLY  24   2.879 -16.795   3.786
  184    H    ILE  25           H        ILE  25   2.193 -14.151   2.060
  185    HA   ILE  25           HA       ILE  25   3.058 -15.115  -0.374
  186    HB   ILE  25           HB       ILE  25   3.115 -12.177  -0.303
  187   1HG1  ILE  25          2HG1      ILE  25   0.638 -13.659   0.614
  188   2HG1  ILE  25          1HG1      ILE  25   1.533 -12.437   1.514
  189   1HG2  ILE  25          1HG2      ILE  25   2.837 -12.926  -2.416
  190   2HG2  ILE  25          2HG2      ILE  25   1.130 -12.830  -1.966
  191   3HG2  ILE  25          3HG2      ILE  25   1.974 -14.378  -1.910
  192   1HD1  ILE  25          1HD1      ILE  25   0.956 -10.959  -0.587
  193   2HD1  ILE  25          2HD1      ILE  25  -0.193 -11.177   0.733
  194   3HD1  ILE  25          3HD1      ILE  25  -0.358 -12.121  -0.747
  195    H    GLY  26           H        GLY  26   4.621 -13.834  -1.907
  196   1HA   GLY  26          2HA       GLY  26   7.238 -14.100  -0.733
  197   2HA   GLY  26          1HA       GLY  26   6.877 -13.705  -2.411
  198    H    ASP  27           H        ASP  27   8.913 -12.499  -0.847
  199    HA   ASP  27           HA       ASP  27   8.115  -9.996   0.202
  200   1HB   ASP  27          2HB       ASP  27  10.670 -11.315  -0.493
  201   2HB   ASP  27          1HB       ASP  27  10.698  -9.554  -0.506
  202    H    TYR  28           H        TYR  28   8.611 -11.123  -3.024
  203    HA   TYR  28           HA       TYR  28   9.325  -8.892  -4.461
  204   1HB   TYR  28          2HB       TYR  28   8.385 -11.340  -5.157
  205   2HB   TYR  28          1HB       TYR  28   6.971 -10.357  -5.524
  206    HD1  TYR  28           1HD      TYR  28   8.665  -7.853  -6.230
  207    HD2  TYR  28           2HD      TYR  28   8.810 -11.914  -7.478
  208    HE1  TYR  28           1HE      TYR  28   9.674  -7.155  -8.346
  209    HE2  TYR  28           2HE      TYR  28   9.825 -11.227  -9.610
  210    HH   TYR  28           HH       TYR  28  11.181  -9.265 -10.458
  211    H    TYR  29           H        TYR  29   6.121  -9.778  -3.325
  212    HA   TYR  29           HA       TYR  29   4.898  -7.394  -4.290
  213   1HB   TYR  29          2HB       TYR  29   3.725  -9.374  -2.339
  214   2HB   TYR  29          1HB       TYR  29   2.863  -8.283  -3.416
  215    HD1  TYR  29           1HD      TYR  29   4.850  -8.725  -5.777
  216    HD2  TYR  29           2HD      TYR  29   2.667 -11.378  -3.254
  217    HE1  TYR  29           1HE      TYR  29   4.926 -10.457  -7.524
  218    HE2  TYR  29           2HE      TYR  29   2.723 -13.103  -5.005
  219    HH   TYR  29           HH       TYR  29   2.967 -13.144  -7.543
  220    H    ILE  30           H        ILE  30   6.491  -8.173  -1.303
  221    HA   ILE  30           HA       ILE  30   5.180  -6.090   0.192
  222    HB   ILE  30           HB       ILE  30   6.506  -6.609   1.970
  223   1HG1  ILE  30          2HG1      ILE  30   8.853  -7.728   1.583
  224   2HG1  ILE  30          1HG1      ILE  30   8.701  -6.993  -0.010
  225   1HG2  ILE  30          1HG2      ILE  30   7.253  -9.083   1.792
  226   2HG2  ILE  30          2HG2      ILE  30   6.423  -9.020   0.240
  227   3HG2  ILE  30          3HG2      ILE  30   5.546  -8.660   1.723
  228   1HD1  ILE  30          1HD1      ILE  30   9.222  -5.765   2.585
  229   2HD1  ILE  30          2HD1      ILE  30   8.016  -4.929   1.604
  230   3HD1  ILE  30          3HD1      ILE  30   9.633  -5.217   0.960
  231    H    LYS  31           H        LYS  31   7.942  -6.460  -1.868
  232    HA   LYS  31           HA       LYS  31   9.013  -3.828  -1.399
  233   1HB   LYS  31          2HB       LYS  31   9.678  -6.134  -3.179
  234   2HB   LYS  31          1HB       LYS  31  10.357  -4.552  -3.534
  235   1HG   LYS  31          2HG       LYS  31  11.823  -4.666  -1.847
  236   2HG   LYS  31          1HG       LYS  31  10.643  -5.368  -0.740
  237   1HD   LYS  31          2HD       LYS  31  11.015  -7.437  -2.435
  238   2HD   LYS  31          1HD       LYS  31  12.606  -6.679  -2.503
  239   1HE   LYS  31          2HE       LYS  31  12.634  -6.714  -0.002
  240   2HE   LYS  31          1HE       LYS  31  11.151  -7.665  -0.056
  241   1HZ   LYS  31          1HZ       LYS  31  12.736  -9.292   0.068
  242   2HZ   LYS  31          2HZ       LYS  31  13.876  -8.431  -0.836
  243   3HZ   LYS  31          3HZ       LYS  31  12.567  -9.170  -1.611
  244    H    LEU  32           H        LEU  32   7.378  -5.495  -4.093
  245    HA   LEU  32           HA       LEU  32   7.322  -3.421  -5.897
  246   1HB   LEU  32          2HB       LEU  32   6.098  -4.834  -7.146
  247   2HB   LEU  32          1HB       LEU  32   6.347  -5.961  -5.836
  248    HG   LEU  32           HG       LEU  32   4.068  -6.078  -6.328
  249   1HD1  LEU  32          1HD1      LEU  32   5.023  -5.113  -3.902
  250   2HD1  LEU  32          2HD1      LEU  32   3.516  -6.000  -4.190
  251   3HD1  LEU  32          3HD1      LEU  32   3.522  -4.235  -4.208
  252   1HD2  LEU  32          1HD2      LEU  32   3.420  -3.235  -5.947
  253   2HD2  LEU  32          2HD2      LEU  32   2.774  -4.402  -7.101
  254   3HD2  LEU  32          3HD2      LEU  32   4.317  -3.610  -7.419
  255    H    ILE  33           H        ILE  33   5.717  -3.654  -2.906
  256    HA   ILE  33           HA       ILE  33   3.596  -1.793  -3.436
  257    HB   ILE  33           HB       ILE  33   4.676  -3.194  -1.021
  258   1HG1  ILE  33          2HG1      ILE  33   2.036  -3.003  -2.449
  259   2HG1  ILE  33          1HG1      ILE  33   3.059  -4.414  -2.222
  260   1HG2  ILE  33          1HG2      ILE  33   3.729  -0.542  -0.851
  261   2HG2  ILE  33          2HG2      ILE  33   4.075  -1.662   0.462
  262   3HG2  ILE  33          3HG2      ILE  33   2.455  -1.583  -0.224
  263   1HD1  ILE  33          1HD1      ILE  33   0.861  -3.561  -0.674
  264   2HD1  ILE  33          2HD1      ILE  33   2.302  -3.449   0.339
  265   3HD1  ILE  33          3HD1      ILE  33   1.888  -4.975  -0.439
  266    H    ASN  34           H        ASN  34   6.557  -1.670  -1.455
  267    HA   ASN  34           HA       ASN  34   6.489   0.998  -0.754
  268   1HB   ASN  34          2HB       ASN  34   8.079  -0.667   0.150
  269   2HB   ASN  34          1HB       ASN  34   8.956  -0.635  -1.375
  270   1HD2  ASN  34          1HD2      ASN  34  10.849   0.094  -0.473
  271   2HD2  ASN  34          2HD2      ASN  34  11.039   1.697   0.142
  272    H    ASN  35           H        ASN  35   7.191  -0.381  -3.849
  273    HA   ASN  35           HA       ASN  35   8.677   1.802  -4.905
  274   1HB   ASN  35          2HB       ASN  35   8.372  -0.694  -5.740
  275   2HB   ASN  35          1HB       ASN  35   7.078   0.028  -6.691
  276   1HD2  ASN  35          1HD2      ASN  35   7.669   0.586  -8.646
  277   2HD2  ASN  35          2HD2      ASN  35   9.238   1.122  -9.128
  278    H    ALA  36           H        ALA  36   5.307   1.281  -4.383
  279    HA   ALA  36           HA       ALA  36   4.250   2.898  -6.426
  280   1HB   ALA  36          1HB       ALA  36   3.262   1.601  -4.038
  281   2HB   ALA  36          2HB       ALA  36   2.455   1.912  -5.574
  282   3HB   ALA  36          3HB       ALA  36   2.481   3.156  -4.325
  283    H    LYS  37           H        LYS  37   3.669   5.040  -6.519
  284    HA   LYS  37           HA       LYS  37   5.155   6.804  -4.759
  285   1HB   LYS  37          2HB       LYS  37   4.876   8.486  -6.375
  286   2HB   LYS  37          1HB       LYS  37   5.092   7.014  -7.309
  287   1HG   LYS  37          2HG       LYS  37   2.380   8.147  -6.671
  288   2HG   LYS  37          1HG       LYS  37   3.299   8.613  -8.094
  289   1HD   LYS  37          2HD       LYS  37   2.253   5.880  -7.412
  290   2HD   LYS  37          1HD       LYS  37   1.779   6.911  -8.758
  291   1HE   LYS  37          2HE       LYS  37   4.381   6.726  -9.293
  292   2HE   LYS  37          1HE       LYS  37   4.182   5.208  -8.419
  293   1HZ   LYS  37          1HZ       LYS  37   2.572   6.047 -10.770
  294   2HZ   LYS  37          2HZ       LYS  37   2.448   4.570  -9.954
  295   3HZ   LYS  37          3HZ       LYS  37   3.857   4.947 -10.811
  296    H    THR  38           H        THR  38   1.855   5.984  -5.537
  297    HA   THR  38           HA       THR  38   0.822   8.010  -3.701
  298    HB   THR  38           HB       THR  38  -1.308   6.467  -4.713
  299    HG1  THR  38           1HG      THR  38   0.561   7.087  -6.749
  300   1HG2  THR  38          1HG2      THR  38  -0.882   9.062  -4.446
  301   2HG2  THR  38          2HG2      THR  38  -2.097   8.416  -5.549
  302   3HG2  THR  38          3HG2      THR  38  -0.524   8.919  -6.167
  303    H    VAL  39           H        VAL  39  -1.509   6.576  -2.856
  304    HA   VAL  39           HA       VAL  39  -0.292   4.394  -1.318
  305    HB   VAL  39           HB       VAL  39  -0.751   6.654  -0.070
  306   1HG1  VAL  39          1HG1      VAL  39  -2.868   6.724   1.039
  307   2HG1  VAL  39          2HG1      VAL  39  -3.384   5.242   0.233
  308   3HG1  VAL  39          3HG1      VAL  39  -3.143   6.716  -0.704
  309   1HG2  VAL  39          1HG2      VAL  39  -1.131   3.832   0.784
  310   2HG2  VAL  39          2HG2      VAL  39  -1.331   5.137   1.953
  311   3HG2  VAL  39          3HG2      VAL  39   0.209   4.926   1.113
  312    H    GLU  40           H        GLU  40  -3.328   5.761  -2.525
  313    HA   GLU  40           HA       GLU  40  -5.107   3.815  -1.768
  314   1HB   GLU  40          2HB       GLU  40  -5.386   5.982  -3.235
  315   2HB   GLU  40          1HB       GLU  40  -5.253   4.845  -4.569
  316   1HG   GLU  40          2HG       GLU  40  -7.471   4.689  -4.347
  317   2HG   GLU  40          1HG       GLU  40  -7.083   3.591  -3.030
  318    H    GLY  41           H        GLY  41  -2.748   3.678  -4.371
  319   1HA   GLY  41          2HA       GLY  41  -3.730   1.118  -5.316
  320   2HA   GLY  41          1HA       GLY  41  -2.320   1.983  -5.913
  321    H    VAL  42           H        VAL  42  -1.253   2.319  -3.184
  322    HA   VAL  42           HA       VAL  42   0.460   0.127  -3.079
  323    HB   VAL  42           HB       VAL  42  -0.267   1.946  -0.787
  324   1HG1  VAL  42          1HG1      VAL  42   2.165   1.368  -0.203
  325   2HG1  VAL  42          2HG1      VAL  42   1.947   0.006  -1.307
  326   3HG1  VAL  42          3HG1      VAL  42   0.915   0.161   0.122
  327   1HG2  VAL  42          1HG2      VAL  42   2.102   2.266  -2.587
  328   2HG2  VAL  42          2HG2      VAL  42   1.370   3.440  -1.500
  329   3HG2  VAL  42          3HG2      VAL  42   0.552   2.996  -2.999
  330    H    GLU  43           H        GLU  43  -2.346   0.850  -1.012
  331    HA   GLU  43           HA       GLU  43  -2.156  -1.571   0.469
  332   1HB   GLU  43          2HB       GLU  43  -4.685  -0.938   0.934
  333   2HB   GLU  43          1HB       GLU  43  -3.367  -0.021   1.652
  334   1HG   GLU  43          2HG       GLU  43  -3.616   1.739   0.114
  335   2HG   GLU  43          1HG       GLU  43  -4.659   0.776  -0.937
  336    H    SER  44           H        SER  44  -4.324  -0.547  -2.154
  337    HA   SER  44           HA       SER  44  -5.689  -3.002  -2.377
  338   1HB   SER  44          2HB       SER  44  -6.799  -2.025  -4.136
  339   2HB   SER  44          1HB       SER  44  -6.127  -0.570  -3.396
  340    HG   SER  44           HG       SER  44  -4.329  -0.850  -4.890
  341    H    LEU  45           H        LEU  45  -2.595  -1.936  -3.444
  342    HA   LEU  45           HA       LEU  45  -2.120  -3.591  -5.638
  343   1HB   LEU  45          2HB       LEU  45  -0.521  -2.080  -3.706
  344   2HB   LEU  45          1HB       LEU  45   0.311  -3.475  -4.349
  345   1HD1  LEU  45          1HD1      LEU  45   1.973  -1.992  -6.356
  346   2HD1  LEU  45          2HD1      LEU  45   0.874  -2.650  -7.568
  347   3HD1  LEU  45          3HD1      LEU  45   1.249  -3.583  -6.118
  348   1HD2  LEU  45          1HD2      LEU  45  -1.315  -2.564  -7.436
  349   2HD2  LEU  45          2HD2      LEU  45  -1.119  -0.817  -7.292
  350   3HD2  LEU  45          3HD2      LEU  45  -2.180  -1.680  -6.179
  351    H    LYS  46           H        LYS  46  -1.149  -4.202  -2.253
  352    HA   LYS  46           HA       LYS  46  -0.470  -6.915  -2.793
  353   1HB   LYS  46          2HB       LYS  46   0.698  -6.413  -0.954
  354   2HB   LYS  46          1HB       LYS  46  -0.368  -5.090  -0.511
  355   1HG   LYS  46          2HG       LYS  46  -1.175  -7.934  -0.008
  356   2HG   LYS  46          1HG       LYS  46  -0.070  -7.098   1.088
  357   1HD   LYS  46          2HD       LYS  46  -1.789  -5.259   1.244
  358   2HD   LYS  46          1HD       LYS  46  -2.898  -6.329   0.389
  359   1HE   LYS  46          2HE       LYS  46  -3.089  -7.774   2.151
  360   2HE   LYS  46          1HE       LYS  46  -1.496  -7.373   2.790
  361   1HZ   LYS  46          1HZ       LYS  46  -2.961  -6.408   4.286
  362   2HZ   LYS  46          2HZ       LYS  46  -4.028  -5.885   3.082
  363   3HZ   LYS  46          3HZ       LYS  46  -2.540  -5.107   3.290
  364    H    ASN  47           H        ASN  47  -3.284  -5.344  -1.305
  365    HA   ASN  47           HA       ASN  47  -4.623  -7.686  -0.542
  366   1HB   ASN  47          2HB       ASN  47  -5.230  -5.274   0.053
  367   2HB   ASN  47          1HB       ASN  47  -6.013  -5.183  -1.523
  368   1HD2  ASN  47          1HD2      ASN  47  -7.368  -4.807   0.867
  369   2HD2  ASN  47          2HD2      ASN  47  -8.495  -6.099   1.079
  370    H    GLU  48           H        GLU  48  -4.211  -6.192  -3.646
  371    HA   GLU  48           HA       GLU  48  -6.313  -7.697  -4.929
  372   1HB   GLU  48          2HB       GLU  48  -4.207  -5.781  -5.823
  373   2HB   GLU  48          1HB       GLU  48  -4.873  -6.883  -7.018
  374   1HG   GLU  48          2HG       GLU  48  -7.163  -6.058  -6.214
  375   2HG   GLU  48          1HG       GLU  48  -6.266  -4.737  -5.467
  376    H    ILE  49           H        ILE  49  -2.840  -7.907  -4.511
  377    HA   ILE  49           HA       ILE  49  -2.368 -10.071  -6.269
  378    HB   ILE  49           HB       ILE  49  -0.240 -10.306  -5.252
  379   1HG1  ILE  49          2HG1      ILE  49  -0.804  -8.554  -2.920
  380   2HG1  ILE  49          1HG1      ILE  49  -1.390 -10.202  -2.838
  381   1HG2  ILE  49          1HG2      ILE  49  -0.076  -7.558  -4.616
  382   2HG2  ILE  49          2HG2      ILE  49  -1.252  -7.743  -5.916
  383   3HG2  ILE  49          3HG2      ILE  49   0.383  -8.371  -6.111
  384   1HD1  ILE  49          1HD1      ILE  49   1.430  -9.655  -3.572
  385   2HD1  ILE  49          2HD1      ILE  49   0.722 -11.074  -2.799
  386   3HD1  ILE  49          3HD1      ILE  49   0.917  -9.574  -1.888
  387    H    LEU  50           H        LEU  50  -3.599  -9.799  -3.065
  388    HA   LEU  50           HA       LEU  50  -3.351 -12.584  -2.408
  389   1HB   LEU  50          2HB       LEU  50  -4.743 -10.246  -1.107
  390   2HB   LEU  50          1HB       LEU  50  -4.774 -11.867  -0.434
  391    HG   LEU  50           HG       LEU  50  -2.098 -10.785  -1.053
  392   1HD1  LEU  50          1HD1      LEU  50  -2.078  -9.519   1.102
  393   2HD1  LEU  50          2HD1      LEU  50  -3.838  -9.639   1.115
  394   3HD1  LEU  50          3HD1      LEU  50  -3.021  -8.779  -0.192
  395   1HD2  LEU  50          1HD2      LEU  50  -1.879 -12.771   0.022
  396   2HD2  LEU  50          2HD2      LEU  50  -3.396 -12.587   0.905
  397   3HD2  LEU  50          3HD2      LEU  50  -1.957 -11.720   1.438
  398    H    LYS  51           H        LYS  51  -5.780 -10.435  -3.726
  399    HA   LYS  51           HA       LYS  51  -8.049 -12.042  -3.407
  400   1HB   LYS  51          2HB       LYS  51  -7.355  -9.659  -4.812
  401   2HB   LYS  51          1HB       LYS  51  -8.178 -10.727  -5.941
  402   1HG   LYS  51          2HG       LYS  51  -9.534 -10.643  -3.392
  403   2HG   LYS  51          1HG       LYS  51  -9.349  -9.031  -4.086
  404   1HD   LYS  51          2HD       LYS  51 -10.273  -9.960  -6.231
  405   2HD   LYS  51          1HD       LYS  51 -10.647 -11.441  -5.346
  406   1HE   LYS  51          2HE       LYS  51 -11.743  -8.680  -4.870
  407   2HE   LYS  51          1HE       LYS  51 -12.626 -10.116  -5.392
  408   1HZ   LYS  51          1HZ       LYS  51 -11.762  -9.328  -2.732
  409   2HZ   LYS  51          2HZ       LYS  51 -11.609 -10.974  -3.094
  410   3HZ   LYS  51          3HZ       LYS  51 -13.118 -10.220  -3.212
  411    H    ALA  52           H        ALA  52  -5.300 -12.333  -5.461
  412    HA   ALA  52           HA       ALA  52  -6.397 -14.799  -6.578
  413   1HB   ALA  52          1HB       ALA  52  -5.111 -12.609  -8.202
  414   2HB   ALA  52          2HB       ALA  52  -6.775 -13.182  -8.319
  415   3HB   ALA  52          3HB       ALA  52  -5.444 -14.234  -8.802
  416    H    LEU  53           H        LEU  53  -4.832 -15.124  -4.573
  417    HA   LEU  53           HA       LEU  53  -2.030 -15.096  -5.270
  418   1HB   LEU  53          2HB       LEU  53  -3.218 -14.833  -2.921
  419   2HB   LEU  53          1HB       LEU  53  -3.069 -16.580  -2.903
  420    HG   LEU  53           HG       LEU  53  -0.574 -15.258  -3.634
  421   1HD1  LEU  53          1HD1      LEU  53  -1.978 -14.492  -1.112
  422   2HD1  LEU  53          2HD1      LEU  53  -1.018 -13.500  -2.210
  423   3HD1  LEU  53          3HD1      LEU  53  -0.221 -14.648  -1.135
  424   1HD2  LEU  53          1HD2      LEU  53   0.167 -16.720  -1.663
  425   2HD2  LEU  53          2HD2      LEU  53  -0.460 -17.528  -3.100
  426   3HD2  LEU  53          3HD2      LEU  53  -1.485 -17.340  -1.677
  427    HA   PRO  54           HA       PRO  54  -3.054 -19.973  -4.965
  428   1HB   PRO  54          2HB       PRO  54  -5.661 -19.647  -6.387
  429   2HB   PRO  54          1HB       PRO  54  -5.177 -20.855  -5.191
  430   1HG   PRO  54          2HG       PRO  54  -6.749 -18.825  -4.498
  431   2HG   PRO  54          1HG       PRO  54  -5.478 -19.403  -3.406
  432   1HD   PRO  54          2HD       PRO  54  -5.561 -16.946  -5.088
  433   2HD   PRO  54          1HD       PRO  54  -4.804 -17.208  -3.505
  434    H    THR  55           H        THR  55  -1.408 -20.086  -6.447
  435    HA   THR  55           HA       THR  55  -2.204 -19.939  -9.279
  436    HB   THR  55           HB       THR  55   0.620 -19.399  -8.447
  437    HG1  THR  55           1HG      THR  55  -0.042 -17.719  -7.393
  438   1HG2  THR  55          1HG2      THR  55   0.667 -17.997 -10.405
  439   2HG2  THR  55          2HG2      THR  55  -1.053 -18.274 -10.678
  440   3HG2  THR  55          3HG2      THR  55   0.090 -19.608 -10.832
  441    H    GLU  56           H        GLU  56   0.272 -21.251  -7.077
  442    HA   GLU  56           HA       GLU  56   1.336 -23.258  -7.004
  443   1HB   GLU  56          2HB       GLU  56  -1.358 -23.814  -7.627
  444   2HB   GLU  56          1HB       GLU  56  -0.392 -24.846  -8.673
  445   1HG   GLU  56          2HG       GLU  56  -0.825 -26.086  -6.720
  446   2HG   GLU  56          1HG       GLU  56   0.860 -25.574  -6.620
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1   0.079  25.705  12.086
    2   2H    MET   1          2HT       MET   1   1.426  24.781  12.612
    3   3H    MET   1          3HT       MET   1  -0.133  24.071  12.554
    4    HA   MET   1           HA       MET   1  -0.187  24.044  10.273
    5   1HB   MET   1          2HB       MET   1   1.616  25.166   8.954
    6   2HB   MET   1          1HB       MET   1   0.613  26.278   9.862
    7   1HG   MET   1          2HG       MET   1   3.001  25.366  11.286
    8   2HG   MET   1          1HG       MET   1   3.321  26.291   9.822
    9   1HE   MET   1          1HE       MET   1   4.577  28.144  11.487
   10   2HE   MET   1          2HE       MET   1   3.578  29.595  11.426
   11   3HE   MET   1          3HE       MET   1   3.798  28.621   9.979
   12    H    GLU   2           H        GLU   2   0.465  22.158   9.437
   13    HA   GLU   2           HA       GLU   2   3.158  21.208   9.694
   14   1HB   GLU   2          2HB       GLU   2   1.269  20.488  11.705
   15   2HB   GLU   2          1HB       GLU   2   1.634  19.053  10.754
   16   1HG   GLU   2          2HG       GLU   2   4.091  19.674  11.099
   17   2HG   GLU   2          1HG       GLU   2   3.499  20.763  12.354
   18    H    ALA   3           H        ALA   3   3.143  18.742   8.939
   19    HA   ALA   3           HA       ALA   3   1.071  18.056   7.082
   20   1HB   ALA   3          1HB       ALA   3   2.808  19.841   6.061
   21   2HB   ALA   3          2HB       ALA   3   1.985  18.620   5.098
   22   3HB   ALA   3          3HB       ALA   3   3.634  18.339   5.656
   23    H    VAL   4           H        VAL   4   1.076  15.908   6.655
   24    HA   VAL   4           HA       VAL   4   3.466  14.315   6.874
   25    HB   VAL   4           HB       VAL   4   2.432  12.787   8.613
   26   1HG1  VAL   4          1HG1      VAL   4   3.398  13.964  10.425
   27   2HG1  VAL   4          2HG1      VAL   4   3.121  15.525   9.647
   28   3HG1  VAL   4          3HG1      VAL   4   4.315  14.413   8.993
   29   1HG2  VAL   4          1HG2      VAL   4   0.570  13.332   9.752
   30   2HG2  VAL   4          2HG2      VAL   4   0.215  14.291   8.317
   31   3HG2  VAL   4          3HG2      VAL   4   0.928  15.056   9.735
   32    H    ASP   5           H        ASP   5   1.817  14.724   4.721
   33    HA   ASP   5           HA       ASP   5  -0.258  12.829   4.429
   34   1HB   ASP   5          2HB       ASP   5   0.111  13.203   1.959
   35   2HB   ASP   5          1HB       ASP   5  -0.162  14.669   2.899
   36    H    ALA   6           H        ALA   6   3.212  12.664   3.858
   37    HA   ALA   6           HA       ALA   6   3.211  10.170   2.508
   38   1HB   ALA   6          1HB       ALA   6   5.593  10.857   4.107
   39   2HB   ALA   6          2HB       ALA   6   5.078  12.064   2.935
   40   3HB   ALA   6          3HB       ALA   6   5.450  10.432   2.401
   41    H    ASN   7           H        ASN   7   3.199  11.081   5.886
   42    HA   ASN   7           HA       ASN   7   4.068   8.689   7.035
   43   1HB   ASN   7          2HB       ASN   7   2.294  10.916   7.970
   44   2HB   ASN   7          1HB       ASN   7   2.462   9.467   8.956
   45   1HD2  ASN   7          1HD2      ASN   7   4.893   8.762   9.072
   46   2HD2  ASN   7          2HD2      ASN   7   5.976  10.030   9.532
   47    H    SER   8           H        SER   8   0.783   9.737   6.169
   48    HA   SER   8           HA       SER   8  -0.483   7.346   7.015
   49   1HB   SER   8          2HB       SER   8  -1.414   9.779   6.329
   50   2HB   SER   8          1HB       SER   8  -1.722   8.922   4.822
   51    HG   SER   8           HG       SER   8  -2.793   7.309   6.169
   52    H    LEU   9           H        LEU   9   1.039   8.387   4.057
   53    HA   LEU   9           HA       LEU   9   0.042   6.340   2.364
   54   1HB   LEU   9          2HB       LEU   9   1.094   8.503   1.639
   55   2HB   LEU   9          1HB       LEU   9   2.645   7.849   2.123
   56    HG   LEU   9           HG       LEU   9   0.900   6.596   0.013
   57   1HD1  LEU   9          1HD1      LEU   9   2.549   7.565  -1.577
   58   2HD1  LEU   9          2HD1      LEU   9   3.175   8.538  -0.243
   59   3HD1  LEU   9          3HD1      LEU   9   1.508   8.748  -0.787
   60   1HD2  LEU   9          1HD2      LEU   9   2.292   4.893   0.458
   61   2HD2  LEU   9          2HD2      LEU   9   3.475   5.933   1.255
   62   3HD2  LEU   9          3HD2      LEU   9   3.432   5.832  -0.506
   63    H    ALA  10           H        ALA  10   3.014   6.719   4.256
   64    HA   ALA  10           HA       ALA  10   4.247   4.316   3.465
   65   1HB   ALA  10          1HB       ALA  10   5.383   4.722   5.841
   66   2HB   ALA  10          2HB       ALA  10   4.657   6.311   5.607
   67   3HB   ALA  10          3HB       ALA  10   5.788   5.675   4.413
   68    H    GLN  11           H        GLN  11   1.616   4.875   5.582
   69    HA   GLN  11           HA       GLN  11   2.011   2.514   7.182
   70   1HB   GLN  11          2HB       GLN  11   0.914   4.333   8.258
   71   2HB   GLN  11          1HB       GLN  11  -0.242   4.497   6.941
   72   1HG   GLN  11          2HG       GLN  11  -1.128   2.281   7.500
   73   2HG   GLN  11          1HG       GLN  11  -0.050   2.219   8.888
   74   1HE2  GLN  11          1HE2      GLN  11  -2.393   1.895   9.726
   75   2HE2  GLN  11          2HE2      GLN  11  -3.158   3.326  10.321
   76    H    ALA  12           H        ALA  12  -0.018   3.485   4.453
   77    HA   ALA  12           HA       ALA  12  -1.681   1.277   4.296
   78   1HB   ALA  12          1HB       ALA  12  -0.550   2.311   1.761
   79   2HB   ALA  12          2HB       ALA  12  -1.399   3.456   2.805
   80   3HB   ALA  12          3HB       ALA  12  -2.231   2.016   2.214
   81    H    LYS  13           H        LYS  13   1.639   1.700   3.280
   82    HA   LYS  13           HA       LYS  13   1.802  -0.989   2.190
   83   1HB   LYS  13          2HB       LYS  13   4.347  -0.190   2.113
   84   2HB   LYS  13          1HB       LYS  13   3.173   0.267   0.894
   85   1HG   LYS  13          2HG       LYS  13   2.971   2.418   1.685
   86   2HG   LYS  13          1HG       LYS  13   3.607   1.992   3.280
   87   1HD   LYS  13          2HD       LYS  13   5.773   2.147   2.599
   88   2HD   LYS  13          1HD       LYS  13   5.409   1.561   0.974
   89   1HE   LYS  13          2HE       LYS  13   5.202   3.631   0.166
   90   2HE   LYS  13          1HE       LYS  13   4.200   4.143   1.522
   91   1HZ   LYS  13          1HZ       LYS  13   6.242   5.406   1.442
   92   2HZ   LYS  13          2HZ       LYS  13   7.166   3.990   1.511
   93   3HZ   LYS  13          3HZ       LYS  13   6.217   4.446   2.836
   94    H    GLU  14           H        GLU  14   3.383   0.881   4.794
   95    HA   GLU  14           HA       GLU  14   4.866  -1.139   5.958
   96   1HB   GLU  14          2HB       GLU  14   3.583   1.355   6.964
   97   2HB   GLU  14          1HB       GLU  14   4.089   0.181   8.171
   98   1HG   GLU  14          2HG       GLU  14   5.755   1.972   7.638
   99   2HG   GLU  14          1HG       GLU  14   6.349   0.318   7.506
  100    H    ALA  15           H        ALA  15   1.469  -0.403   6.146
  101    HA   ALA  15           HA       ALA  15   0.913  -2.492   8.083
  102   1HB   ALA  15          1HB       ALA  15  -0.348  -0.253   7.788
  103   2HB   ALA  15          2HB       ALA  15  -1.278  -1.716   8.116
  104   3HB   ALA  15          3HB       ALA  15  -1.182  -1.081   6.473
  105    H    ALA  16           H        ALA  16   0.587  -1.960   4.610
  106    HA   ALA  16           HA       ALA  16  -0.886  -4.302   4.031
  107   1HB   ALA  16          1HB       ALA  16   0.046  -3.958   1.690
  108   2HB   ALA  16          2HB       ALA  16   0.866  -2.540   2.338
  109   3HB   ALA  16          3HB       ALA  16  -0.894  -2.632   2.371
  110    H    ILE  17           H        ILE  17   2.499  -3.711   4.594
  111    HA   ILE  17           HA       ILE  17   3.399  -6.181   3.443
  112    HB   ILE  17           HB       ILE  17   4.936  -4.290   3.610
  113   1HG1  ILE  17          2HG1      ILE  17   5.957  -6.425   5.474
  114   2HG1  ILE  17          1HG1      ILE  17   5.690  -6.741   3.763
  115   1HG2  ILE  17          1HG2      ILE  17   4.358  -4.536   6.528
  116   2HG2  ILE  17          2HG2      ILE  17   4.402  -3.099   5.508
  117   3HG2  ILE  17          3HG2      ILE  17   5.905  -3.891   5.982
  118   1HD1  ILE  17          1HD1      ILE  17   7.208  -4.744   3.334
  119   2HD1  ILE  17          2HD1      ILE  17   7.956  -6.223   3.937
  120   3HD1  ILE  17          3HD1      ILE  17   7.655  -4.875   5.035
  121    H    LYS  18           H        LYS  18   2.351  -5.063   6.583
  122    HA   LYS  18           HA       LYS  18   3.255  -7.193   8.165
  123   1HB   LYS  18          2HB       LYS  18   1.410  -4.977   8.418
  124   2HB   LYS  18          1HB       LYS  18   0.765  -6.414   9.202
  125   1HG   LYS  18          2HG       LYS  18   3.501  -6.182   9.916
  126   2HG   LYS  18          1HG       LYS  18   2.735  -4.610  10.148
  127   1HD   LYS  18          2HD       LYS  18   1.383  -7.084  11.142
  128   2HD   LYS  18          1HD       LYS  18   2.706  -6.374  12.071
  129   1HE   LYS  18          2HE       LYS  18   0.984  -5.236  13.002
  130   2HE   LYS  18          1HE       LYS  18   1.293  -4.164  11.644
  131   1HZ   LYS  18          1HZ       LYS  18  -0.560  -6.348  11.155
  132   2HZ   LYS  18          2HZ       LYS  18  -0.625  -4.737  10.643
  133   3HZ   LYS  18          3HZ       LYS  18  -1.104  -5.146  12.210
  134    H    GLU  19           H        GLU  19   0.627  -6.915   5.917
  135    HA   GLU  19           HA       GLU  19  -0.657  -9.357   6.782
  136   1HB   GLU  19          2HB       GLU  19  -1.193  -7.236   4.793
  137   2HB   GLU  19          1HB       GLU  19  -1.745  -8.843   4.345
  138   1HG   GLU  19          2HG       GLU  19  -3.582  -8.376   5.500
  139   2HG   GLU  19          1HG       GLU  19  -2.599  -8.597   6.947
  140    H    LEU  20           H        LEU  20   1.447  -8.265   4.181
  141    HA   LEU  20           HA       LEU  20   1.417 -10.650   2.688
  142   1HB   LEU  20          2HB       LEU  20   2.642  -8.144   2.490
  143   2HB   LEU  20          1HB       LEU  20   3.964  -9.294   2.554
  144    HG   LEU  20           HG       LEU  20   2.129 -10.394   0.759
  145   1HD1  LEU  20          1HD1      LEU  20   0.913  -8.645   0.070
  146   2HD1  LEU  20          2HD1      LEU  20   2.358  -8.229  -0.850
  147   3HD1  LEU  20          3HD1      LEU  20   2.056  -7.466   0.711
  148   1HD2  LEU  20          1HD2      LEU  20   3.900 -10.422  -0.680
  149   2HD2  LEU  20          2HD2      LEU  20   4.734 -10.199   0.856
  150   3HD2  LEU  20          3HD2      LEU  20   4.455  -8.818  -0.205
  151    H    LYS  21           H        LYS  21   3.148  -9.668   5.548
  152    HA   LYS  21           HA       LYS  21   4.947 -11.939   5.418
  153   1HB   LYS  21          2HB       LYS  21   5.945 -11.071   7.435
  154   2HB   LYS  21          1HB       LYS  21   5.733  -9.756   6.290
  155   1HG   LYS  21          2HG       LYS  21   4.539  -8.605   7.750
  156   2HG   LYS  21          1HG       LYS  21   3.427  -9.952   7.975
  157   1HD   LYS  21          2HD       LYS  21   4.582 -10.779   9.794
  158   2HD   LYS  21          1HD       LYS  21   6.098 -10.020   9.303
  159   1HE   LYS  21          2HE       LYS  21   3.789  -8.283  10.026
  160   2HE   LYS  21          1HE       LYS  21   4.687  -9.078  11.318
  161   1HZ   LYS  21          1HZ       LYS  21   5.887  -7.335   9.234
  162   2HZ   LYS  21          2HZ       LYS  21   6.705  -8.049  10.530
  163   3HZ   LYS  21          3HZ       LYS  21   5.541  -6.858  10.820
  164    H    GLN  22           H        GLN  22   2.006 -10.961   7.076
  165    HA   GLN  22           HA       GLN  22   2.073 -13.172   8.917
  166   1HB   GLN  22          2HB       GLN  22   0.128 -12.320   9.826
  167   2HB   GLN  22          1HB       GLN  22   0.851 -10.870   9.146
  168   1HG   GLN  22          2HG       GLN  22  -0.588 -11.236   7.117
  169   2HG   GLN  22          1HG       GLN  22  -1.416 -12.495   8.029
  170   1HE2  GLN  22          1HE2      GLN  22  -0.233  -9.249   8.852
  171   2HE2  GLN  22          2HE2      GLN  22  -1.741  -8.669   9.462
  172    H    TYR  23           H        TYR  23   0.876 -12.595   5.714
  173    HA   TYR  23           HA       TYR  23  -0.835 -14.923   5.667
  174   1HB   TYR  23          2HB       TYR  23   0.032 -12.911   3.597
  175   2HB   TYR  23          1HB       TYR  23  -0.860 -14.365   3.147
  176    HD1  TYR  23           1HD      TYR  23  -2.884 -14.679   5.131
  177    HD2  TYR  23           2HD      TYR  23  -1.333 -11.083   3.481
  178    HE1  TYR  23           1HE      TYR  23  -4.994 -13.536   5.655
  179    HE2  TYR  23           2HE      TYR  23  -3.433  -9.929   3.997
  180    HH   TYR  23           HH       TYR  23  -5.519 -10.735   6.067
  181    H    GLY  24           H        GLY  24   2.371 -14.010   4.518
  182   1HA   GLY  24          2HA       GLY  24   4.087 -15.731   4.498
  183   2HA   GLY  24          1HA       GLY  24   2.864 -16.858   3.931
  184    H    ILE  25           H        ILE  25   2.212 -14.087   2.295
  185    HA   ILE  25           HA       ILE  25   2.973 -15.051  -0.193
  186    HB   ILE  25           HB       ILE  25   3.073 -12.114  -0.052
  187   1HG1  ILE  25          2HG1      ILE  25   0.645 -13.616   0.941
  188   2HG1  ILE  25          1HG1      ILE  25   1.518 -12.320   1.755
  189   1HG2  ILE  25          1HG2      ILE  25   0.935 -13.454  -1.532
  190   2HG2  ILE  25          2HG2      ILE  25   2.564 -13.998  -1.950
  191   3HG2  ILE  25          3HG2      ILE  25   2.143 -12.292  -2.073
  192   1HD1  ILE  25          1HD1      ILE  25  -0.292 -11.173   0.971
  193   2HD1  ILE  25          2HD1      ILE  25  -0.447 -12.184  -0.465
  194   3HD1  ILE  25          3HD1      ILE  25   0.816 -10.959  -0.387
  195    H    GLY  26           H        GLY  26   4.534 -13.742  -1.733
  196   1HA   GLY  26          2HA       GLY  26   7.165 -14.055  -0.573
  197   2HA   GLY  26          1HA       GLY  26   6.796 -13.702  -2.258
  198    H    ASP  27           H        ASP  27   8.857 -12.482  -0.733
  199    HA   ASP  27           HA       ASP  27   8.107  -9.942   0.254
  200   1HB   ASP  27          2HB       ASP  27  10.657 -11.268  -0.513
  201   2HB   ASP  27          1HB       ASP  27  10.663  -9.508  -0.430
  202    H    TYR  28           H        TYR  28   8.634 -11.152  -2.951
  203    HA   TYR  28           HA       TYR  28   9.320  -8.958  -4.449
  204   1HB   TYR  28          2HB       TYR  28   8.385 -11.434  -5.068
  205   2HB   TYR  28          1HB       TYR  28   6.977 -10.460  -5.475
  206    HD1  TYR  28           1HD      TYR  28   8.608  -7.977  -6.277
  207    HD2  TYR  28           2HD      TYR  28   8.896 -12.085  -7.336
  208    HE1  TYR  28           1HE      TYR  28   9.629  -7.344  -8.407
  209    HE2  TYR  28           2HE      TYR  28   9.925 -11.463  -9.483
  210    HH   TYR  28           HH       TYR  28  11.359  -8.874 -10.153
  211    H    TYR  29           H        TYR  29   6.135  -9.841  -3.283
  212    HA   TYR  29           HA       TYR  29   4.878  -7.503  -4.316
  213   1HB   TYR  29          2HB       TYR  29   3.746  -9.501  -2.353
  214   2HB   TYR  29          1HB       TYR  29   2.846  -8.414  -3.405
  215    HD1  TYR  29           1HD      TYR  29   4.885  -8.802  -5.774
  216    HD2  TYR  29           2HD      TYR  29   2.672 -11.495  -3.323
  217    HE1  TYR  29           1HE      TYR  29   4.993 -10.506  -7.541
  218    HE2  TYR  29           2HE      TYR  29   2.758 -13.193  -5.096
  219    HH   TYR  29           HH       TYR  29   4.077 -13.766  -7.031
  220    H    ILE  30           H        ILE  30   6.481  -8.171  -1.312
  221    HA   ILE  30           HA       ILE  30   5.138  -6.058   0.119
  222    HB   ILE  30           HB       ILE  30   6.460  -6.515   1.918
  223   1HG1  ILE  30          2HG1      ILE  30   8.822  -7.606   1.583
  224   2HG1  ILE  30          1HG1      ILE  30   8.669  -6.941  -0.040
  225   1HG2  ILE  30          1HG2      ILE  30   7.250  -8.986   1.803
  226   2HG2  ILE  30          2HG2      ILE  30   6.401  -8.975   0.261
  227   3HG2  ILE  30          3HG2      ILE  30   5.535  -8.587   1.744
  228   1HD1  ILE  30          1HD1      ILE  30   7.946  -4.822   1.495
  229   2HD1  ILE  30          2HD1      ILE  30   9.565  -5.107   0.850
  230   3HD1  ILE  30          3HD1      ILE  30   9.173  -5.599   2.498
  231    H    LYS  31           H        LYS  31   7.907  -6.489  -1.918
  232    HA   LYS  31           HA       LYS  31   8.989  -3.852  -1.537
  233   1HB   LYS  31          2HB       LYS  31   9.948  -6.266  -2.502
  234   2HB   LYS  31          1HB       LYS  31   9.833  -5.265  -3.940
  235   1HG   LYS  31          2HG       LYS  31  12.023  -5.000  -3.085
  236   2HG   LYS  31          1HG       LYS  31  11.147  -3.515  -2.711
  237   1HD   LYS  31          2HD       LYS  31  12.521  -4.307  -0.820
  238   2HD   LYS  31          1HD       LYS  31  10.801  -4.252  -0.430
  239   1HE   LYS  31          2HE       LYS  31  10.706  -6.457  -0.068
  240   2HE   LYS  31          1HE       LYS  31  11.628  -6.819  -1.528
  241   1HZ   LYS  31          1HZ       LYS  31  13.642  -6.108  -0.210
  242   2HZ   LYS  31          2HZ       LYS  31  12.929  -7.569   0.252
  243   3HZ   LYS  31          3HZ       LYS  31  12.663  -6.172   1.168
  244    H    LEU  32           H        LEU  32   7.347  -5.566  -4.203
  245    HA   LEU  32           HA       LEU  32   7.278  -3.514  -6.030
  246   1HB   LEU  32          2HB       LEU  32   6.045  -4.937  -7.261
  247   2HB   LEU  32          1HB       LEU  32   6.313  -6.053  -5.945
  248    HG   LEU  32           HG       LEU  32   4.029  -6.187  -6.419
  249   1HD1  LEU  32          1HD1      LEU  32   3.504  -6.107  -4.274
  250   2HD1  LEU  32          2HD1      LEU  32   3.487  -4.342  -4.302
  251   3HD1  LEU  32          3HD1      LEU  32   5.002  -5.204  -4.006
  252   1HD2  LEU  32          1HD2      LEU  32   2.709  -4.520  -7.175
  253   2HD2  LEU  32          2HD2      LEU  32   4.246  -3.730  -7.530
  254   3HD2  LEU  32          3HD2      LEU  32   3.377  -3.341  -6.045
  255    H    ILE  33           H        ILE  33   5.674  -3.729  -3.039
  256    HA   ILE  33           HA       ILE  33   3.534  -1.903  -3.564
  257    HB   ILE  33           HB       ILE  33   4.680  -3.260  -1.165
  258   1HG1  ILE  33          2HG1      ILE  33   1.976  -3.015  -2.462
  259   2HG1  ILE  33          1HG1      ILE  33   2.989  -4.444  -2.314
  260   1HG2  ILE  33          1HG2      ILE  33   3.844  -0.595  -0.946
  261   2HG2  ILE  33          2HG2      ILE  33   4.125  -1.745   0.355
  262   3HG2  ILE  33          3HG2      ILE  33   2.513  -1.570  -0.332
  263   1HD1  ILE  33          1HD1      ILE  33   2.354  -3.449   0.290
  264   2HD1  ILE  33          2HD1      ILE  33   1.977  -5.009  -0.437
  265   3HD1  ILE  33          3HD1      ILE  33   0.881  -3.645  -0.660
  266    H    ASN  34           H        ASN  34   6.537  -1.674  -1.660
  267    HA   ASN  34           HA       ASN  34   6.437   1.014  -1.033
  268   1HB   ASN  34          2HB       ASN  34   8.180  -0.978  -0.527
  269   2HB   ASN  34          1HB       ASN  34   9.111  -0.067  -1.711
  270   1HD2  ASN  34          1HD2      ASN  34  10.637   0.610  -0.249
  271   2HD2  ASN  34          2HD2      ASN  34  10.303   1.769   0.989
  272    H    ASN  35           H        ASN  35   7.103  -0.447  -4.099
  273    HA   ASN  35           HA       ASN  35   8.569   1.656  -5.281
  274   1HB   ASN  35          2HB       ASN  35   7.654  -0.878  -6.059
  275   2HB   ASN  35          1HB       ASN  35   6.921   0.248  -7.197
  276   1HD2  ASN  35          1HD2      ASN  35   9.611  -1.561  -6.516
  277   2HD2  ASN  35          2HD2      ASN  35  10.739  -0.785  -7.571
  278    H    ALA  36           H        ALA  36   5.175   1.221  -4.676
  279    HA   ALA  36           HA       ALA  36   4.104   2.950  -6.600
  280   1HB   ALA  36          1HB       ALA  36   2.325   1.992  -5.672
  281   2HB   ALA  36          2HB       ALA  36   2.441   3.242  -4.433
  282   3HB   ALA  36          3HB       ALA  36   3.185   1.665  -4.168
  283    H    LYS  37           H        LYS  37   3.375   5.084  -6.474
  284    HA   LYS  37           HA       LYS  37   5.078   6.786  -4.810
  285   1HB   LYS  37          2HB       LYS  37   3.465   7.328  -7.305
  286   2HB   LYS  37          1HB       LYS  37   4.276   8.581  -6.389
  287   1HG   LYS  37          2HG       LYS  37   5.542   6.282  -7.846
  288   2HG   LYS  37          1HG       LYS  37   5.667   7.994  -8.226
  289   1HD   LYS  37          2HD       LYS  37   7.611   7.837  -7.092
  290   2HD   LYS  37          1HD       LYS  37   6.565   7.985  -5.678
  291   1HE   LYS  37          2HE       LYS  37   6.440   5.321  -6.136
  292   2HE   LYS  37          1HE       LYS  37   8.074   5.669  -6.682
  293   1HZ   LYS  37          1HZ       LYS  37   7.219   6.785  -4.114
  294   2HZ   LYS  37          2HZ       LYS  37   8.745   6.244  -4.601
  295   3HZ   LYS  37          3HZ       LYS  37   7.553   5.129  -4.183
  296    H    THR  38           H        THR  38   1.725   6.085  -5.542
  297    HA   THR  38           HA       THR  38   0.782   8.132  -3.693
  298    HB   THR  38           HB       THR  38  -1.407   7.688  -4.534
  299    HG1  THR  38           1HG      THR  38  -1.880   5.692  -4.911
  300   1HG2  THR  38          1HG2      THR  38  -1.246   8.251  -6.738
  301   2HG2  THR  38          2HG2      THR  38   0.111   7.168  -7.037
  302   3HG2  THR  38          3HG2      THR  38   0.364   8.685  -6.174
  303    H    VAL  39           H        VAL  39  -1.614   6.404  -3.021
  304    HA   VAL  39           HA       VAL  39  -0.323   4.401  -1.339
  305    HB   VAL  39           HB       VAL  39  -0.811   6.688  -0.147
  306   1HG1  VAL  39          1HG1      VAL  39  -2.911   6.726   1.007
  307   2HG1  VAL  39          2HG1      VAL  39  -3.408   5.224   0.226
  308   3HG1  VAL  39          3HG1      VAL  39  -3.210   6.692  -0.732
  309   1HG2  VAL  39          1HG2      VAL  39   0.205   5.051   1.093
  310   2HG2  VAL  39          2HG2      VAL  39  -1.062   3.875   0.760
  311   3HG2  VAL  39          3HG2      VAL  39  -1.352   5.175   1.915
  312    H    GLU  40           H        GLU  40  -3.414   5.714  -2.486
  313    HA   GLU  40           HA       GLU  40  -5.130   3.729  -1.689
  314   1HB   GLU  40          2HB       GLU  40  -5.299   5.902  -3.372
  315   2HB   GLU  40          1HB       GLU  40  -5.599   4.553  -4.457
  316   1HG   GLU  40          2HG       GLU  40  -7.457   3.826  -3.170
  317   2HG   GLU  40          1HG       GLU  40  -7.069   4.946  -1.866
  318    H    GLY  41           H        GLY  41  -2.767   3.626  -4.262
  319   1HA   GLY  41          2HA       GLY  41  -3.745   1.072  -5.250
  320   2HA   GLY  41          1HA       GLY  41  -2.353   1.963  -5.853
  321    H    VAL  42           H        VAL  42  -1.161   2.312  -3.241
  322    HA   VAL  42           HA       VAL  42   0.521   0.107  -3.134
  323    HB   VAL  42           HB       VAL  42  -0.102   1.975  -0.850
  324   1HG1  VAL  42          1HG1      VAL  42   2.358   1.410  -0.362
  325   2HG1  VAL  42          2HG1      VAL  42   2.092   0.031  -1.433
  326   3HG1  VAL  42          3HG1      VAL  42   1.124   0.208   0.037
  327   1HG2  VAL  42          1HG2      VAL  42   0.716   2.835  -3.242
  328   2HG2  VAL  42          2HG2      VAL  42   2.274   2.352  -2.576
  329   3HG2  VAL  42          3HG2      VAL  42   1.290   3.542  -1.734
  330    H    GLU  43           H        GLU  43  -2.236   0.883  -1.029
  331    HA   GLU  43           HA       GLU  43  -2.001  -1.476   0.540
  332   1HB   GLU  43          2HB       GLU  43  -4.566  -0.834   0.954
  333   2HB   GLU  43          1HB       GLU  43  -3.240   0.032   1.716
  334   1HG   GLU  43          2HG       GLU  43  -3.391   1.810   0.163
  335   2HG   GLU  43          1HG       GLU  43  -4.493   0.900  -0.873
  336    H    SER  44           H        SER  44  -4.377  -0.579  -1.959
  337    HA   SER  44           HA       SER  44  -5.621  -3.084  -2.102
  338   1HB   SER  44          2HB       SER  44  -5.986  -0.608  -3.275
  339   2HB   SER  44          1HB       SER  44  -5.549  -1.635  -4.642
  340    HG   SER  44           HG       SER  44  -7.206  -3.119  -3.736
  341    H    LEU  45           H        LEU  45  -2.612  -1.950  -3.331
  342    HA   LEU  45           HA       LEU  45  -2.174  -3.605  -5.522
  343   1HB   LEU  45          2HB       LEU  45  -0.554  -2.054  -3.659
  344   2HB   LEU  45          1HB       LEU  45   0.282  -3.477  -4.230
  345   1HD1  LEU  45          1HD1      LEU  45   1.322  -3.604  -5.903
  346   2HD1  LEU  45          2HD1      LEU  45   1.840  -2.082  -6.628
  347   3HD1  LEU  45          3HD1      LEU  45   0.639  -3.082  -7.443
  348   1HD2  LEU  45          1HD2      LEU  45  -1.148  -0.820  -7.181
  349   2HD2  LEU  45          2HD2      LEU  45  -2.200  -1.706  -6.078
  350   3HD2  LEU  45          3HD2      LEU  45  -1.375  -2.557  -7.383
  351    H    LYS  46           H        LYS  46  -1.123  -4.211  -2.162
  352    HA   LYS  46           HA       LYS  46  -0.425  -6.911  -2.691
  353   1HB   LYS  46          2HB       LYS  46   0.686  -6.398  -0.814
  354   2HB   LYS  46          1HB       LYS  46  -0.423  -5.105  -0.388
  355   1HG   LYS  46          2HG       LYS  46  -1.187  -7.971   0.055
  356   2HG   LYS  46          1HG       LYS  46  -0.125  -7.132   1.193
  357   1HD   LYS  46          2HD       LYS  46  -1.873  -5.329   1.344
  358   2HD   LYS  46          1HD       LYS  46  -2.942  -6.385   0.424
  359   1HE   LYS  46          2HE       LYS  46  -3.267  -7.802   2.155
  360   2HE   LYS  46          1HE       LYS  46  -1.633  -7.581   2.782
  361   1HZ   LYS  46          1HZ       LYS  46  -3.694  -6.629   4.044
  362   2HZ   LYS  46          2HZ       LYS  46  -3.522  -5.344   2.958
  363   3HZ   LYS  46          3HZ       LYS  46  -2.245  -5.757   3.987
  364    H    ASN  47           H        ASN  47  -3.292  -5.364  -1.310
  365    HA   ASN  47           HA       ASN  47  -4.659  -7.713  -0.594
  366   1HB   ASN  47          2HB       ASN  47  -5.379  -5.457   0.121
  367   2HB   ASN  47          1HB       ASN  47  -5.828  -5.075  -1.538
  368   1HD2  ASN  47          1HD2      ASN  47  -7.911  -5.198  -1.893
  369   2HD2  ASN  47          2HD2      ASN  47  -9.018  -6.284  -1.133
  370    H    GLU  48           H        GLU  48  -4.130  -6.180  -3.655
  371    HA   GLU  48           HA       GLU  48  -6.168  -7.668  -5.050
  372   1HB   GLU  48          2HB       GLU  48  -4.068  -5.695  -5.783
  373   2HB   GLU  48          1HB       GLU  48  -4.583  -6.807  -7.044
  374   1HG   GLU  48          2HG       GLU  48  -6.875  -6.078  -6.797
  375   2HG   GLU  48          1HG       GLU  48  -6.418  -5.023  -5.460
  376    H    ILE  49           H        ILE  49  -2.738  -7.920  -4.423
  377    HA   ILE  49           HA       ILE  49  -2.203 -10.056  -6.217
  378    HB   ILE  49           HB       ILE  49  -0.111 -10.317  -5.122
  379   1HG1  ILE  49          2HG1      ILE  49  -0.644  -8.514  -2.844
  380   2HG1  ILE  49          1HG1      ILE  49  -1.386 -10.098  -2.742
  381   1HG2  ILE  49          1HG2      ILE  49  -0.232  -7.470  -4.537
  382   2HG2  ILE  49          2HG2      ILE  49  -0.950  -7.905  -6.087
  383   3HG2  ILE  49          3HG2      ILE  49   0.721  -8.346  -5.734
  384   1HD1  ILE  49          1HD1      ILE  49   0.961  -9.640  -1.750
  385   2HD1  ILE  49          2HD1      ILE  49   1.488  -9.867  -3.417
  386   3HD1  ILE  49          3HD1      ILE  49   0.625 -11.159  -2.584
  387    H    LEU  50           H        LEU  50  -3.547  -9.804  -3.056
  388    HA   LEU  50           HA       LEU  50  -3.322 -12.591  -2.400
  389   1HB   LEU  50          2HB       LEU  50  -4.780 -10.261  -1.162
  390   2HB   LEU  50          1HB       LEU  50  -4.861 -11.886  -0.504
  391    HG   LEU  50           HG       LEU  50  -2.142 -10.835  -0.961
  392   1HD1  LEU  50          1HD1      LEU  50  -2.228  -9.557   1.184
  393   2HD1  LEU  50          2HD1      LEU  50  -3.986  -9.654   1.099
  394   3HD1  LEU  50          3HD1      LEU  50  -3.088  -8.810  -0.163
  395   1HD2  LEU  50          1HD2      LEU  50  -2.078 -12.852   0.112
  396   2HD2  LEU  50          2HD2      LEU  50  -3.583 -12.559   0.988
  397   3HD2  LEU  50          3HD2      LEU  50  -2.094 -11.764   1.502
  398    H    LYS  51           H        LYS  51  -5.684 -10.460  -3.853
  399    HA   LYS  51           HA       LYS  51  -7.921 -12.178  -3.673
  400   1HB   LYS  51          2HB       LYS  51  -8.106  -9.787  -4.241
  401   2HB   LYS  51          1HB       LYS  51  -7.276 -10.084  -5.762
  402   1HG   LYS  51          2HG       LYS  51  -9.179 -11.717  -6.269
  403   2HG   LYS  51          1HG       LYS  51 -10.024 -10.940  -4.929
  404   1HD   LYS  51          2HD       LYS  51  -9.453  -8.735  -6.150
  405   2HD   LYS  51          1HD       LYS  51  -9.156  -9.769  -7.549
  406   1HE   LYS  51          2HE       LYS  51 -11.450  -8.865  -7.502
  407   2HE   LYS  51          1HE       LYS  51 -11.406 -10.629  -7.442
  408   1HZ   LYS  51          1HZ       LYS  51 -11.472  -9.195  -4.899
  409   2HZ   LYS  51          2HZ       LYS  51 -12.183 -10.668  -5.327
  410   3HZ   LYS  51          3HZ       LYS  51 -12.892  -9.216  -5.810
  411    H    ALA  52           H        ALA  52  -5.065 -12.246  -5.560
  412    HA   ALA  52           HA       ALA  52  -5.935 -14.680  -6.870
  413   1HB   ALA  52          1HB       ALA  52  -4.978 -12.307  -8.470
  414   2HB   ALA  52          2HB       ALA  52  -6.620 -12.954  -8.456
  415   3HB   ALA  52          3HB       ALA  52  -5.296 -13.921  -9.107
  416    H    LEU  53           H        LEU  53  -4.324 -15.510  -5.400
  417    HA   LEU  53           HA       LEU  53  -1.562 -14.731  -5.856
  418   1HB   LEU  53          2HB       LEU  53  -2.984 -16.469  -3.892
  419   2HB   LEU  53          1HB       LEU  53  -1.271 -16.732  -4.158
  420    HG   LEU  53           HG       LEU  53  -2.439 -14.066  -3.367
  421   1HD1  LEU  53          1HD1      LEU  53  -2.557 -16.190  -1.753
  422   2HD1  LEU  53          2HD1      LEU  53  -2.233 -14.559  -1.168
  423   3HD1  LEU  53          3HD1      LEU  53  -0.899 -15.683  -1.431
  424   1HD2  LEU  53          1HD2      LEU  53  -0.132 -14.351  -4.541
  425   2HD2  LEU  53          2HD2      LEU  53   0.386 -14.947  -2.965
  426   3HD2  LEU  53          3HD2      LEU  53  -0.272 -13.318  -3.119
  427    HA   PRO  54           HA       PRO  54  -0.484 -17.985  -8.621
  428   1HB   PRO  54          2HB       PRO  54   1.982 -18.724  -7.780
  429   2HB   PRO  54          1HB       PRO  54   1.671 -17.178  -8.578
  430   1HG   PRO  54          2HG       PRO  54   1.968 -17.777  -5.659
  431   2HG   PRO  54          1HG       PRO  54   2.637 -16.430  -6.599
  432   1HD   PRO  54          2HD       PRO  54   0.423 -16.183  -5.052
  433   2HD   PRO  54          1HD       PRO  54   0.663 -15.243  -6.540
  434    H    THR  55           H        THR  55  -2.177 -19.413  -7.792
  435    HA   THR  55           HA       THR  55  -1.083 -21.644  -6.207
  436    HB   THR  55           HB       THR  55  -3.401 -22.113  -5.497
  437    HG1  THR  55           1HG      THR  55  -4.846 -21.281  -6.774
  438   1HG2  THR  55          1HG2      THR  55  -3.694 -19.571  -4.504
  439   2HG2  THR  55          2HG2      THR  55  -1.957 -19.705  -4.774
  440   3HG2  THR  55          3HG2      THR  55  -2.784 -20.885  -3.758
  441    H    GLU  56           H        GLU  56  -3.148 -20.739  -8.923
  442    HA   GLU  56           HA       GLU  56  -3.083 -23.526  -9.857
  443   1HB   GLU  56          2HB       GLU  56  -4.939 -21.238 -10.508
  444   2HB   GLU  56          1HB       GLU  56  -4.926 -22.745 -11.414
  445   1HG   GLU  56          2HG       GLU  56  -5.927 -23.914  -9.757
  446   2HG   GLU  56          1HG       GLU  56  -5.178 -22.959  -8.478
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1  -9.589  11.118   8.723
    2   2H    MET   1          2HT       MET   1  -8.852  11.369  10.253
    3   3H    MET   1          3HT       MET   1  -9.416   9.815   9.828
    4    HA   MET   1           HA       MET   1  -6.979  10.187   9.682
    5   1HB   MET   1          2HB       MET   1  -8.791   9.122   7.561
    6   2HB   MET   1          1HB       MET   1  -7.063   9.147   7.245
    7   1HG   MET   1          2HG       MET   1  -8.384   7.814   9.602
    8   2HG   MET   1          1HG       MET   1  -7.825   7.000   8.139
    9   1HE   MET   1          1HE       MET   1  -6.910   8.221  11.663
   10   2HE   MET   1          2HE       MET   1  -5.523   7.136  11.797
   11   3HE   MET   1          3HE       MET   1  -7.094   6.503  11.304
   12    H    GLU   2           H        GLU   2  -5.808  11.991   9.441
   13    HA   GLU   2           HA       GLU   2  -5.222  13.021   6.891
   14   1HB   GLU   2          2HB       GLU   2  -7.519  14.005   7.242
   15   2HB   GLU   2          1HB       GLU   2  -6.842  14.929   8.579
   16   1HG   GLU   2          2HG       GLU   2  -5.216  15.273   6.255
   17   2HG   GLU   2          1HG       GLU   2  -6.897  15.609   5.855
   18    H    ALA   3           H        ALA   3  -3.324  14.100   6.936
   19    HA   ALA   3           HA       ALA   3  -2.420  15.569   9.215
   20   1HB   ALA   3          1HB       ALA   3  -1.958  13.455  10.180
   21   2HB   ALA   3          2HB       ALA   3  -0.416  14.101   9.625
   22   3HB   ALA   3          3HB       ALA   3  -1.237  12.857   8.685
   23    H    VAL   4           H        VAL   4  -0.468  13.621   6.999
   24    HA   VAL   4           HA       VAL   4   0.158  16.018   5.438
   25    HB   VAL   4           HB       VAL   4   2.340  14.247   6.535
   26   1HG1  VAL   4          1HG1      VAL   4   3.526  16.558   5.853
   27   2HG1  VAL   4          2HG1      VAL   4   2.217  16.533   4.674
   28   3HG1  VAL   4          3HG1      VAL   4   3.362  15.197   4.755
   29   1HG2  VAL   4          1HG2      VAL   4   1.467  15.374   8.428
   30   2HG2  VAL   4          2HG2      VAL   4   1.285  16.878   7.539
   31   3HG2  VAL   4          3HG2      VAL   4   2.896  16.279   7.936
   32    H    ASP   5           H        ASP   5  -1.005  13.061   5.282
   33    HA   ASP   5           HA       ASP   5  -1.302  11.561   3.630
   34   1HB   ASP   5          2HB       ASP   5  -0.225  13.889   2.230
   35   2HB   ASP   5          1HB       ASP   5   0.100  12.369   1.406
   36    H    ALA   6           H        ALA   6   2.060  12.761   3.297
   37    HA   ALA   6           HA       ALA   6   3.238  10.425   2.445
   38   1HB   ALA   6          1HB       ALA   6   5.210  11.481   3.988
   39   2HB   ALA   6          2HB       ALA   6   4.161  12.877   3.746
   40   3HB   ALA   6          3HB       ALA   6   4.813  12.017   2.354
   41    H    ASN   7           H        ASN   7   2.398  11.381   5.734
   42    HA   ASN   7           HA       ASN   7   3.767   9.256   7.028
   43   1HB   ASN   7          2HB       ASN   7   2.485  11.528   7.873
   44   2HB   ASN   7          1HB       ASN   7   1.361  10.269   8.381
   45   1HD2  ASN   7          1HD2      ASN   7   2.373  11.621  10.357
   46   2HD2  ASN   7          2HD2      ASN   7   3.620  10.756  11.184
   47    H    SER   8           H        SER   8   0.381   9.713   6.059
   48    HA   SER   8           HA       SER   8  -0.475   7.159   6.960
   49   1HB   SER   8          2HB       SER   8  -1.976   9.147   6.563
   50   2HB   SER   8          1HB       SER   8  -1.785   8.863   4.832
   51    HG   SER   8           HG       SER   8  -2.586   6.691   5.291
   52    H    LEU   9           H        LEU   9   0.871   8.389   3.990
   53    HA   LEU   9           HA       LEU   9   0.203   6.304   2.257
   54   1HB   LEU   9          2HB       LEU   9   1.212   8.547   1.674
   55   2HB   LEU   9          1HB       LEU   9   2.758   7.899   2.185
   56    HG   LEU   9           HG       LEU   9   1.087   6.766  -0.060
   57   1HD1  LEU   9          1HD1      LEU   9   3.631   8.338  -0.289
   58   2HD1  LEU   9          2HD1      LEU   9   2.029   9.064  -0.424
   59   3HD1  LEU   9          3HD1      LEU   9   2.535   7.833  -1.579
   60   1HD2  LEU   9          1HD2      LEU   9   3.612   5.963   1.249
   61   2HD2  LEU   9          2HD2      LEU   9   3.547   5.853  -0.510
   62   3HD2  LEU   9          3HD2      LEU   9   2.371   4.978   0.473
   63    H    ALA  10           H        ALA  10   3.019   6.768   4.351
   64    HA   ALA  10           HA       ALA  10   4.368   4.409   3.581
   65   1HB   ALA  10          1HB       ALA  10   5.691   4.797   5.671
   66   2HB   ALA  10          2HB       ALA  10   4.624   6.154   6.012
   67   3HB   ALA  10          3HB       ALA  10   5.629   6.162   4.561
   68    H    GLN  11           H        GLN  11   1.715   4.959   5.697
   69    HA   GLN  11           HA       GLN  11   2.116   2.572   7.262
   70   1HB   GLN  11          2HB       GLN  11   1.084   4.404   8.386
   71   2HB   GLN  11          1HB       GLN  11  -0.113   4.590   7.109
   72   1HG   GLN  11          2HG       GLN  11  -1.022   2.400   7.679
   73   2HG   GLN  11          1HG       GLN  11   0.124   2.272   9.007
   74   1HE2  GLN  11          1HE2      GLN  11  -2.897   3.429   7.999
   75   2HE2  GLN  11          2HE2      GLN  11  -3.315   4.297   9.425
   76    H    ALA  12           H        ALA  12  -0.003   3.606   4.616
   77    HA   ALA  12           HA       ALA  12  -1.709   1.440   4.494
   78   1HB   ALA  12          1HB       ALA  12  -2.278   2.168   2.410
   79   2HB   ALA  12          2HB       ALA  12  -0.598   2.432   1.931
   80   3HB   ALA  12          3HB       ALA  12  -1.412   3.595   2.982
   81    H    LYS  13           H        LYS  13   1.541   1.789   3.190
   82    HA   LYS  13           HA       LYS  13   1.619  -0.918   2.179
   83   1HB   LYS  13          2HB       LYS  13   4.196  -0.183   2.071
   84   2HB   LYS  13          1HB       LYS  13   3.021   0.276   0.855
   85   1HG   LYS  13          2HG       LYS  13   2.888   2.443   1.585
   86   2HG   LYS  13          1HG       LYS  13   3.482   2.041   3.203
   87   1HD   LYS  13          2HD       LYS  13   5.686   1.985   2.517
   88   2HD   LYS  13          1HD       LYS  13   5.262   1.603   0.846
   89   1HE   LYS  13          2HE       LYS  13   5.236   3.754   0.272
   90   2HE   LYS  13          1HE       LYS  13   4.221   4.178   1.649
   91   1HZ   LYS  13          1HZ       LYS  13   6.055   5.295   2.268
   92   2HZ   LYS  13          2HZ       LYS  13   7.105   4.328   1.360
   93   3HZ   LYS  13          3HZ       LYS  13   6.549   3.790   2.864
   94    H    GLU  14           H        GLU  14   3.439   0.890   4.678
   95    HA   GLU  14           HA       GLU  14   4.849  -1.150   5.837
   96   1HB   GLU  14          2HB       GLU  14   3.557   1.311   6.968
   97   2HB   GLU  14          1HB       GLU  14   4.311   0.155   8.059
   98   1HG   GLU  14          2HG       GLU  14   5.972   0.907   5.772
   99   2HG   GLU  14          1HG       GLU  14   5.579   2.237   6.861
  100    H    ALA  15           H        ALA  15   1.473  -0.339   6.160
  101    HA   ALA  15           HA       ALA  15   0.969  -2.440   8.103
  102   1HB   ALA  15          1HB       ALA  15  -1.167  -0.924   6.650
  103   2HB   ALA  15          2HB       ALA  15  -0.234  -0.165   7.940
  104   3HB   ALA  15          3HB       ALA  15  -1.195  -1.604   8.277
  105    H    ALA  16           H        ALA  16   0.361  -1.822   4.670
  106    HA   ALA  16           HA       ALA  16  -1.190  -4.130   4.179
  107   1HB   ALA  16          1HB       ALA  16  -0.508  -3.748   1.774
  108   2HB   ALA  16          2HB       ALA  16   0.446  -2.383   2.354
  109   3HB   ALA  16          3HB       ALA  16  -1.303  -2.394   2.577
  110    H    ILE  17           H        ILE  17   2.238  -3.629   4.470
  111    HA   ILE  17           HA       ILE  17   2.956  -6.088   3.163
  112    HB   ILE  17           HB       ILE  17   5.225  -5.661   3.975
  113   1HG1  ILE  17          2HG1      ILE  17   3.990  -3.278   5.363
  114   2HG1  ILE  17          1HG1      ILE  17   4.679  -4.688   6.156
  115   1HG2  ILE  17          1HG2      ILE  17   4.069  -3.093   2.919
  116   2HG2  ILE  17          2HG2      ILE  17   4.248  -4.542   1.932
  117   3HG2  ILE  17          3HG2      ILE  17   5.671  -3.770   2.629
  118   1HD1  ILE  17          1HD1      ILE  17   6.867  -4.113   5.455
  119   2HD1  ILE  17          2HD1      ILE  17   6.131  -2.651   6.113
  120   3HD1  ILE  17          3HD1      ILE  17   6.259  -2.866   4.366
  121    H    LYS  18           H        LYS  18   2.329  -5.009   6.438
  122    HA   LYS  18           HA       LYS  18   3.401  -7.112   7.902
  123   1HB   LYS  18          2HB       LYS  18   1.654  -4.948   8.387
  124   2HB   LYS  18          1HB       LYS  18   0.813  -6.386   8.953
  125   1HG   LYS  18          2HG       LYS  18   3.286  -6.788   9.992
  126   2HG   LYS  18          1HG       LYS  18   3.172  -5.028  10.038
  127   1HD   LYS  18          2HD       LYS  18   0.991  -5.250  11.201
  128   2HD   LYS  18          1HD       LYS  18   1.230  -6.998  11.242
  129   1HE   LYS  18          2HE       LYS  18   3.293  -6.671  12.532
  130   2HE   LYS  18          1HE       LYS  18   3.023  -4.929  12.511
  131   1HZ   LYS  18          1HZ       LYS  18   2.294  -6.040  14.574
  132   2HZ   LYS  18          2HZ       LYS  18   1.132  -6.887  13.683
  133   3HZ   LYS  18          3HZ       LYS  18   1.053  -5.201  13.788
  134    H    GLU  19           H        GLU  19   0.372  -6.897   6.117
  135    HA   GLU  19           HA       GLU  19  -0.640  -9.423   6.943
  136   1HB   GLU  19          2HB       GLU  19  -1.483  -7.285   5.246
  137   2HB   GLU  19          1HB       GLU  19  -1.587  -8.779   4.325
  138   1HG   GLU  19          2HG       GLU  19  -3.687  -8.277   5.434
  139   2HG   GLU  19          1HG       GLU  19  -2.979  -9.765   6.061
  140    H    LEU  20           H        LEU  20   1.410  -8.299   4.339
  141    HA   LEU  20           HA       LEU  20   1.491 -10.706   2.862
  142   1HB   LEU  20          2HB       LEU  20   2.648  -8.131   2.707
  143   2HB   LEU  20          1HB       LEU  20   3.977  -9.275   2.699
  144    HG   LEU  20           HG       LEU  20   2.265 -10.407   0.898
  145   1HD1  LEU  20          1HD1      LEU  20   0.697  -8.816   0.509
  146   2HD1  LEU  20          2HD1      LEU  20   1.937  -8.230  -0.601
  147   3HD1  LEU  20          3HD1      LEU  20   1.761  -7.494   0.991
  148   1HD2  LEU  20          1HD2      LEU  20   4.824  -9.407   0.935
  149   2HD2  LEU  20          2HD2      LEU  20   4.038  -8.476  -0.338
  150   3HD2  LEU  20          3HD2      LEU  20   4.053 -10.236  -0.416
  151    H    LYS  21           H        LYS  21   3.194  -9.522   5.666
  152    HA   LYS  21           HA       LYS  21   5.146 -11.640   5.680
  153   1HB   LYS  21          2HB       LYS  21   5.611  -9.406   6.660
  154   2HB   LYS  21          1HB       LYS  21   4.377  -9.705   7.877
  155   1HG   LYS  21          2HG       LYS  21   5.958 -11.904   8.152
  156   2HG   LYS  21          1HG       LYS  21   7.135 -10.666   7.712
  157   1HD   LYS  21          2HD       LYS  21   7.121 -10.089   9.870
  158   2HD   LYS  21          1HD       LYS  21   5.532  -9.389   9.559
  159   1HE   LYS  21          2HE       LYS  21   4.453 -11.446  10.232
  160   2HE   LYS  21          1HE       LYS  21   6.018 -12.234  10.433
  161   1HZ   LYS  21          1HZ       LYS  21   5.268  -9.820  11.970
  162   2HZ   LYS  21          2HZ       LYS  21   6.509 -10.923  12.292
  163   3HZ   LYS  21          3HZ       LYS  21   4.896 -11.379  12.511
  164    H    GLN  22           H        GLN  22   2.048 -10.937   7.157
  165    HA   GLN  22           HA       GLN  22   2.111 -13.203   8.929
  166   1HB   GLN  22          2HB       GLN  22   0.593 -10.885   8.746
  167   2HB   GLN  22          1HB       GLN  22  -0.541 -12.157   8.313
  168   1HG   GLN  22          2HG       GLN  22  -0.861 -12.392  10.497
  169   2HG   GLN  22          1HG       GLN  22   0.705 -13.203  10.514
  170   1HE2  GLN  22          1HE2      GLN  22   2.595 -11.848  10.917
  171   2HE2  GLN  22          2HE2      GLN  22   2.437 -10.492  11.976
  172    H    TYR  23           H        TYR  23   1.095 -12.554   5.677
  173    HA   TYR  23           HA       TYR  23  -0.475 -14.971   5.429
  174   1HB   TYR  23          2HB       TYR  23   0.210 -12.665   3.676
  175   2HB   TYR  23          1HB       TYR  23  -0.189 -14.189   2.884
  176    HD1  TYR  23           1HD      TYR  23  -1.517 -11.187   3.925
  177    HD2  TYR  23           2HD      TYR  23  -2.370 -15.351   4.009
  178    HE1  TYR  23           1HE      TYR  23  -3.905 -10.685   4.179
  179    HE2  TYR  23           2HE      TYR  23  -4.762 -14.863   4.263
  180    HH   TYR  23           HH       TYR  23  -5.933 -11.716   4.969
  181    H    GLY  24           H        GLY  24   2.662 -13.759   4.307
  182   1HA   GLY  24          2HA       GLY  24   4.567 -15.207   4.206
  183   2HA   GLY  24          1HA       GLY  24   3.482 -16.552   3.891
  184    H    ILE  25           H        ILE  25   2.431 -13.989   2.040
  185    HA   ILE  25           HA       ILE  25   2.957 -15.164  -0.402
  186    HB   ILE  25           HB       ILE  25   3.041 -12.245  -0.636
  187   1HG1  ILE  25          2HG1      ILE  25   0.730 -13.523   0.848
  188   2HG1  ILE  25          1HG1      ILE  25   1.802 -12.264   1.455
  189   1HG2  ILE  25          1HG2      ILE  25   0.731 -13.848  -1.546
  190   2HG2  ILE  25          2HG2      ILE  25   2.308 -14.285  -2.209
  191   3HG2  ILE  25          3HG2      ILE  25   1.691 -12.647  -2.406
  192   1HD1  ILE  25          1HD1      ILE  25  -0.303 -12.052  -0.667
  193   2HD1  ILE  25          2HD1      ILE  25   0.955 -10.834  -0.458
  194   3HD1  ILE  25          3HD1      ILE  25  -0.173 -11.169   0.855
  195    H    GLY  26           H        GLY  26   4.335 -14.018  -2.231
  196   1HA   GLY  26          2HA       GLY  26   7.049 -14.401  -1.498
  197   2HA   GLY  26          1HA       GLY  26   6.466 -13.816  -3.053
  198    H    ASP  27           H        ASP  27   8.730 -12.997  -1.260
  199    HA   ASP  27           HA       ASP  27   8.244 -10.508  -0.094
  200   1HB   ASP  27          2HB       ASP  27  10.683 -10.121  -0.348
  201   2HB   ASP  27          1HB       ASP  27  10.318 -11.714   0.309
  202    H    TYR  28           H        TYR  28   8.457 -11.434  -3.393
  203    HA   TYR  28           HA       TYR  28   9.304  -9.205  -4.751
  204   1HB   TYR  28          2HB       TYR  28   8.204 -11.515  -5.536
  205   2HB   TYR  28          1HB       TYR  28   6.781 -10.487  -5.692
  206    HD1  TYR  28           1HD      TYR  28   6.433 -10.039  -7.925
  207    HD2  TYR  28           2HD      TYR  28  10.388  -9.840  -6.378
  208    HE1  TYR  28           1HE      TYR  28   7.228  -9.187 -10.086
  209    HE2  TYR  28           2HE      TYR  28  11.196  -8.992  -8.531
  210    HH   TYR  28           HH       TYR  28   9.072  -7.949 -11.018
  211    H    TYR  29           H        TYR  29   6.108  -9.851  -3.452
  212    HA   TYR  29           HA       TYR  29   4.932  -7.443  -4.370
  213   1HB   TYR  29          2HB       TYR  29   3.885  -9.223  -2.175
  214   2HB   TYR  29          1HB       TYR  29   2.964  -8.215  -3.285
  215    HD1  TYR  29           1HD      TYR  29   2.881 -11.328  -2.729
  216    HD2  TYR  29           2HD      TYR  29   4.570  -8.891  -5.791
  217    HE1  TYR  29           1HE      TYR  29   2.743 -13.218  -4.299
  218    HE2  TYR  29           2HE      TYR  29   4.440 -10.782  -7.364
  219    HH   TYR  29           HH       TYR  29   3.073 -12.880  -7.617
  220    H    ILE  30           H        ILE  30   5.876  -8.441  -1.038
  221    HA   ILE  30           HA       ILE  30   5.159  -6.101   0.261
  222    HB   ILE  30           HB       ILE  30   6.015  -7.974   1.501
  223   1HG1  ILE  30          2HG1      ILE  30   6.335  -5.629   2.399
  224   2HG1  ILE  30          1HG1      ILE  30   7.361  -6.863   3.112
  225   1HG2  ILE  30          1HG2      ILE  30   7.582  -8.820  -0.097
  226   2HG2  ILE  30          2HG2      ILE  30   8.387  -8.593   1.455
  227   3HG2  ILE  30          3HG2      ILE  30   8.640  -7.433   0.150
  228   1HD1  ILE  30          1HD1      ILE  30   8.824  -5.840   0.977
  229   2HD1  ILE  30          2HD1      ILE  30   9.080  -5.540   2.696
  230   3HD1  ILE  30          3HD1      ILE  30   8.073  -4.444   1.749
  231    H    LYS  31           H        LYS  31   7.753  -6.740  -1.940
  232    HA   LYS  31           HA       LYS  31   9.088  -4.213  -1.517
  233   1HB   LYS  31          2HB       LYS  31   9.913  -6.654  -2.422
  234   2HB   LYS  31          1HB       LYS  31   9.721  -5.766  -3.928
  235   1HG   LYS  31          2HG       LYS  31  11.823  -5.101  -3.548
  236   2HG   LYS  31          1HG       LYS  31  11.082  -3.962  -2.422
  237   1HD   LYS  31          2HD       LYS  31  11.862  -6.723  -1.547
  238   2HD   LYS  31          1HD       LYS  31  13.045  -5.415  -1.593
  239   1HE   LYS  31          2HE       LYS  31  10.998  -4.207  -0.292
  240   2HE   LYS  31          1HE       LYS  31  10.795  -5.874   0.248
  241   1HZ   LYS  31          1HZ       LYS  31  12.965  -3.999   0.782
  242   2HZ   LYS  31          2HZ       LYS  31  13.390  -5.624   0.597
  243   3HZ   LYS  31          3HZ       LYS  31  12.277  -5.172   1.788
  244    H    LEU  32           H        LEU  32   7.266  -5.783  -4.150
  245    HA   LEU  32           HA       LEU  32   7.322  -3.714  -5.966
  246   1HB   LEU  32          2HB       LEU  32   6.045  -5.091  -7.195
  247   2HB   LEU  32          1HB       LEU  32   6.187  -6.200  -5.856
  248    HG   LEU  32           HG       LEU  32   3.915  -6.160  -6.413
  249   1HD1  LEU  32          1HD1      LEU  32   3.378  -4.318  -4.325
  250   2HD1  LEU  32          2HD1      LEU  32   4.885  -5.168  -3.976
  251   3HD1  LEU  32          3HD1      LEU  32   3.401  -6.084  -4.270
  252   1HD2  LEU  32          1HD2      LEU  32   2.759  -4.401  -7.218
  253   2HD2  LEU  32          2HD2      LEU  32   4.361  -3.720  -7.504
  254   3HD2  LEU  32          3HD2      LEU  32   3.462  -3.279  -6.054
  255    H    ILE  33           H        ILE  33   5.771  -3.807  -2.949
  256    HA   ILE  33           HA       ILE  33   3.737  -1.841  -3.491
  257    HB   ILE  33           HB       ILE  33   4.772  -3.189  -1.010
  258   1HG1  ILE  33          2HG1      ILE  33   2.175  -3.162  -2.533
  259   2HG1  ILE  33          1HG1      ILE  33   3.245  -4.526  -2.227
  260   1HG2  ILE  33          1HG2      ILE  33   3.642  -0.573  -1.074
  261   2HG2  ILE  33          2HG2      ILE  33   4.128  -1.537   0.316
  262   3HG2  ILE  33          3HG2      ILE  33   2.491  -1.669  -0.320
  263   1HD1  ILE  33          1HD1      ILE  33   2.168  -5.035  -0.364
  264   2HD1  ILE  33          2HD1      ILE  33   0.960  -3.835  -0.823
  265   3HD1  ILE  33          3HD1      ILE  33   2.287  -3.382   0.243
  266    H    ASN  34           H        ASN  34   6.681  -1.882  -1.474
  267    HA   ASN  34           HA       ASN  34   6.734   0.781  -0.770
  268   1HB   ASN  34          2HB       ASN  34   8.402  -1.389  -0.417
  269   2HB   ASN  34          1HB       ASN  34   9.403  -0.273  -1.342
  270   1HD2  ASN  34          1HD2      ASN  34   7.338  -0.491   1.512
  271   2HD2  ASN  34          2HD2      ASN  34   8.197   0.684   2.443
  272    H    ASN  35           H        ASN  35   7.408  -0.614  -3.864
  273    HA   ASN  35           HA       ASN  35   9.019   1.490  -4.896
  274   1HB   ASN  35          2HB       ASN  35   8.602  -0.961  -5.766
  275   2HB   ASN  35          1HB       ASN  35   7.305  -0.194  -6.676
  276   1HD2  ASN  35          1HD2      ASN  35   8.055   1.912  -7.777
  277   2HD2  ASN  35          2HD2      ASN  35   9.549   1.802  -8.637
  278    H    ALA  36           H        ALA  36   5.629   1.161  -4.386
  279    HA   ALA  36           HA       ALA  36   4.629   2.834  -6.397
  280   1HB   ALA  36          1HB       ALA  36   2.684   2.321  -5.467
  281   2HB   ALA  36          2HB       ALA  36   3.131   3.112  -3.955
  282   3HB   ALA  36          3HB       ALA  36   3.576   1.429  -4.236
  283    H    LYS  37           H        LYS  37   3.713   4.972  -6.157
  284    HA   LYS  37           HA       LYS  37   5.462   6.706  -4.560
  285   1HB   LYS  37          2HB       LYS  37   3.882   7.388  -7.048
  286   2HB   LYS  37          1HB       LYS  37   5.003   8.451  -6.202
  287   1HG   LYS  37          2HG       LYS  37   6.759   7.595  -7.259
  288   2HG   LYS  37          1HG       LYS  37   6.246   5.944  -6.947
  289   1HD   LYS  37          2HD       LYS  37   4.843   7.565  -9.029
  290   2HD   LYS  37          1HD       LYS  37   6.401   6.823  -9.400
  291   1HE   LYS  37          2HE       LYS  37   5.568   4.721  -9.364
  292   2HE   LYS  37          1HE       LYS  37   4.385   5.095  -8.111
  293   1HZ   LYS  37          1HZ       LYS  37   4.184   5.450 -11.019
  294   2HZ   LYS  37          2HZ       LYS  37   3.308   6.484 -10.007
  295   3HZ   LYS  37          3HZ       LYS  37   3.053   4.813  -9.933
  296    H    THR  38           H        THR  38   2.167   5.916  -5.361
  297    HA   THR  38           HA       THR  38   1.137   8.023  -3.613
  298    HB   THR  38           HB       THR  38  -1.003   7.619  -4.581
  299    HG1  THR  38           1HG      THR  38  -1.423   5.584  -4.875
  300   1HG2  THR  38          1HG2      THR  38  -0.057   7.142  -7.155
  301   2HG2  THR  38          2HG2      THR  38   1.241   8.006  -6.329
  302   3HG2  THR  38          3HG2      THR  38  -0.379   8.703  -6.400
  303    H    VAL  39           H        VAL  39  -1.310   6.399  -3.030
  304    HA   VAL  39           HA       VAL  39  -0.160   4.318  -1.337
  305    HB   VAL  39           HB       VAL  39  -0.552   6.601  -0.127
  306   1HG1  VAL  39          1HG1      VAL  39  -2.693   6.808   0.912
  307   2HG1  VAL  39          2HG1      VAL  39  -3.259   5.328   0.137
  308   3HG1  VAL  39          3HG1      VAL  39  -2.923   6.760  -0.837
  309   1HG2  VAL  39          1HG2      VAL  39  -1.259   5.151   1.902
  310   2HG2  VAL  39          2HG2      VAL  39   0.289   4.847   1.108
  311   3HG2  VAL  39          3HG2      VAL  39  -1.099   3.817   0.762
  312    H    GLU  40           H        GLU  40  -3.155   5.780  -2.549
  313    HA   GLU  40           HA       GLU  40  -5.004   3.920  -1.790
  314   1HB   GLU  40          2HB       GLU  40  -5.349   6.035  -3.166
  315   2HB   GLU  40          1HB       GLU  40  -4.961   5.058  -4.577
  316   1HG   GLU  40          2HG       GLU  40  -6.966   4.083  -4.604
  317   2HG   GLU  40          1HG       GLU  40  -6.996   3.874  -2.854
  318    H    GLY  41           H        GLY  41  -2.816   3.691  -4.564
  319   1HA   GLY  41          2HA       GLY  41  -3.847   1.121  -5.353
  320   2HA   GLY  41          1HA       GLY  41  -2.433   1.928  -6.018
  321    H    VAL  42           H        VAL  42  -1.361   2.281  -3.236
  322    HA   VAL  42           HA       VAL  42   0.307   0.022  -3.171
  323    HB   VAL  42           HB       VAL  42  -0.214   1.958  -0.925
  324   1HG1  VAL  42          1HG1      VAL  42   2.291   1.313  -0.568
  325   2HG1  VAL  42          2HG1      VAL  42   1.840  -0.126  -1.489
  326   3HG1  VAL  42          3HG1      VAL  42   1.005   0.252   0.025
  327   1HG2  VAL  42          1HG2      VAL  42   1.580   2.094  -3.326
  328   2HG2  VAL  42          2HG2      VAL  42   1.876   3.052  -1.877
  329   3HG2  VAL  42          3HG2      VAL  42   0.385   3.270  -2.794
  330    H    GLU  43           H        GLU  43  -2.258   0.978  -0.884
  331    HA   GLU  43           HA       GLU  43  -2.118  -1.364   0.671
  332   1HB   GLU  43          2HB       GLU  43  -4.636  -0.666   1.142
  333   2HB   GLU  43          1HB       GLU  43  -3.289   0.268   1.782
  334   1HG   GLU  43          2HG       GLU  43  -3.543   1.950   0.180
  335   2HG   GLU  43          1HG       GLU  43  -4.565   0.939  -0.844
  336    H    SER  44           H        SER  44  -4.228  -0.503  -2.043
  337    HA   SER  44           HA       SER  44  -5.605  -2.997  -2.052
  338   1HB   SER  44          2HB       SER  44  -6.002  -0.540  -3.237
  339   2HB   SER  44          1HB       SER  44  -5.542  -1.558  -4.603
  340    HG   SER  44           HG       SER  44  -7.860  -1.500  -3.221
  341    H    LEU  45           H        LEU  45  -2.603  -1.872  -3.306
  342    HA   LEU  45           HA       LEU  45  -2.185  -3.565  -5.480
  343   1HB   LEU  45          2HB       LEU  45  -0.554  -1.955  -3.687
  344   2HB   LEU  45          1HB       LEU  45   0.286  -3.394  -4.215
  345   1HD1  LEU  45          1HD1      LEU  45   1.185  -3.656  -6.043
  346   2HD1  LEU  45          2HD1      LEU  45   1.986  -2.084  -6.125
  347   3HD1  LEU  45          3HD1      LEU  45   0.997  -2.642  -7.475
  348   1HD2  LEU  45          1HD2      LEU  45  -1.324  -2.849  -7.322
  349   2HD2  LEU  45          2HD2      LEU  45  -1.109  -1.104  -7.456
  350   3HD2  LEU  45          3HD2      LEU  45  -2.200  -1.767  -6.241
  351    H    LYS  46           H        LYS  46  -1.150  -4.105  -2.103
  352    HA   LYS  46           HA       LYS  46  -0.427  -6.815  -2.592
  353   1HB   LYS  46          2HB       LYS  46   0.691  -6.248  -0.728
  354   2HB   LYS  46          1HB       LYS  46  -0.439  -4.973  -0.308
  355   1HG   LYS  46          2HG       LYS  46  -1.138  -7.852   0.160
  356   2HG   LYS  46          1HG       LYS  46  -0.108  -6.970   1.293
  357   1HD   LYS  46          2HD       LYS  46  -1.909  -5.214   1.409
  358   2HD   LYS  46          1HD       LYS  46  -2.942  -6.321   0.509
  359   1HE   LYS  46          2HE       LYS  46  -3.253  -7.686   2.270
  360   2HE   LYS  46          1HE       LYS  46  -1.607  -7.466   2.863
  361   1HZ   LYS  46          1HZ       LYS  46  -3.792  -6.425   4.019
  362   2HZ   LYS  46          2HZ       LYS  46  -3.284  -5.122   3.069
  363   3HZ   LYS  46          3HZ       LYS  46  -2.230  -5.802   4.203
  364    H    ASN  47           H        ASN  47  -3.290  -5.245  -1.229
  365    HA   ASN  47           HA       ASN  47  -4.644  -7.595  -0.477
  366   1HB   ASN  47          2HB       ASN  47  -5.347  -5.338   0.250
  367   2HB   ASN  47          1HB       ASN  47  -5.827  -4.955  -1.402
  368   1HD2  ASN  47          1HD2      ASN  47  -7.827  -4.519  -0.032
  369   2HD2  ASN  47          2HD2      ASN  47  -8.956  -5.821   0.095
  370    H    GLU  48           H        GLU  48  -4.192  -6.040  -3.548
  371    HA   GLU  48           HA       GLU  48  -6.251  -7.530  -4.905
  372   1HB   GLU  48          2HB       GLU  48  -4.109  -5.613  -5.717
  373   2HB   GLU  48          1HB       GLU  48  -4.768  -6.682  -6.946
  374   1HG   GLU  48          2HG       GLU  48  -6.728  -5.251  -5.271
  375   2HG   GLU  48          1HG       GLU  48  -5.777  -4.271  -6.386
  376    H    ILE  49           H        ILE  49  -2.813  -7.795  -4.336
  377    HA   ILE  49           HA       ILE  49  -2.325  -9.942  -6.136
  378    HB   ILE  49           HB       ILE  49  -0.203 -10.184  -5.112
  379   1HG1  ILE  49          2HG1      ILE  49  -0.748  -8.430  -2.784
  380   2HG1  ILE  49          1HG1      ILE  49  -1.364 -10.067  -2.701
  381   1HG2  ILE  49          1HG2      ILE  49   0.533  -8.232  -5.842
  382   2HG2  ILE  49          2HG2      ILE  49  -0.177  -7.386  -4.466
  383   3HG2  ILE  49          3HG2      ILE  49  -1.144  -7.691  -5.909
  384   1HD1  ILE  49          1HD1      ILE  49   0.733 -10.975  -2.662
  385   2HD1  ILE  49          2HD1      ILE  49   0.954  -9.479  -1.750
  386   3HD1  ILE  49          3HD1      ILE  49   1.466  -9.571  -3.434
  387    H    LEU  50           H        LEU  50  -3.579  -9.659  -2.940
  388    HA   LEU  50           HA       LEU  50  -3.364 -12.457  -2.301
  389   1HB   LEU  50          2HB       LEU  50  -4.714 -10.113  -0.964
  390   2HB   LEU  50          1HB       LEU  50  -4.770 -11.743  -0.314
  391    HG   LEU  50           HG       LEU  50  -2.072 -10.709  -0.911
  392   1HD1  LEU  50          1HD1      LEU  50  -3.720  -9.580   1.342
  393   2HD1  LEU  50          2HD1      LEU  50  -3.083  -8.692  -0.044
  394   3HD1  LEU  50          3HD1      LEU  50  -1.978  -9.384   1.145
  395   1HD2  LEU  50          1HD2      LEU  50  -3.423 -12.463   1.060
  396   2HD2  LEU  50          2HD2      LEU  50  -1.948 -11.644   1.571
  397   3HD2  LEU  50          3HD2      LEU  50  -1.924 -12.708   0.164
  398    H    LYS  51           H        LYS  51  -5.772 -10.235  -3.548
  399    HA   LYS  51           HA       LYS  51  -8.047 -11.857  -3.254
  400   1HB   LYS  51          2HB       LYS  51  -8.026  -9.428  -3.909
  401   2HB   LYS  51          1HB       LYS  51  -7.503  -9.923  -5.513
  402   1HG   LYS  51          2HG       LYS  51  -9.915 -11.270  -4.513
  403   2HG   LYS  51          1HG       LYS  51 -10.075  -9.536  -4.799
  404   1HD   LYS  51          2HD       LYS  51  -8.912 -10.078  -7.066
  405   2HD   LYS  51          1HD       LYS  51  -9.444 -11.727  -6.735
  406   1HE   LYS  51          2HE       LYS  51 -11.757 -10.733  -6.364
  407   2HE   LYS  51          1HE       LYS  51 -11.120  -9.262  -7.098
  408   1HZ   LYS  51          1HZ       LYS  51 -10.657 -10.449  -9.105
  409   2HZ   LYS  51          2HZ       LYS  51 -12.268 -10.745  -8.681
  410   3HZ   LYS  51          3HZ       LYS  51 -11.089 -11.928  -8.405
  411    H    ALA  52           H        ALA  52  -5.324 -12.071  -5.333
  412    HA   ALA  52           HA       ALA  52  -6.445 -14.456  -6.570
  413   1HB   ALA  52          1HB       ALA  52  -5.688 -13.772  -8.810
  414   2HB   ALA  52          2HB       ALA  52  -5.253 -12.188  -8.163
  415   3HB   ALA  52          3HB       ALA  52  -6.941 -12.703  -8.176
  416    H    LEU  53           H        LEU  53  -4.825 -15.031  -4.766
  417    HA   LEU  53           HA       LEU  53  -2.042 -14.751  -5.403
  418   1HB   LEU  53          2HB       LEU  53  -3.626 -15.653  -3.176
  419   2HB   LEU  53          1HB       LEU  53  -2.370 -16.826  -3.528
  420    HG   LEU  53           HG       LEU  53  -1.896 -13.887  -3.018
  421   1HD1  LEU  53          1HD1      LEU  53  -1.025 -14.556  -0.872
  422   2HD1  LEU  53          2HD1      LEU  53  -1.354 -16.251  -1.229
  423   3HD1  LEU  53          3HD1      LEU  53  -2.690 -15.117  -1.031
  424   1HD2  LEU  53          1HD2      LEU  53   0.339 -15.730  -2.741
  425   2HD2  LEU  53          2HD2      LEU  53   0.236 -14.194  -3.603
  426   3HD2  LEU  53          3HD2      LEU  53  -0.306 -15.681  -4.382
  427    HA   PRO  54           HA       PRO  54  -2.250 -18.251  -8.254
  428   1HB   PRO  54          2HB       PRO  54   0.327 -18.058  -9.107
  429   2HB   PRO  54          1HB       PRO  54  -0.972 -17.028  -9.720
  430   1HG   PRO  54          2HG       PRO  54   1.089 -16.436  -7.631
  431   2HG   PRO  54          1HG       PRO  54   0.507 -15.405  -8.953
  432   1HD   PRO  54          2HD       PRO  54  -0.357 -15.118  -6.410
  433   2HD   PRO  54          1HD       PRO  54  -1.405 -14.803  -7.808
  434    H    THR  55           H        THR  55  -1.147 -20.310  -8.441
  435    HA   THR  55           HA       THR  55   0.122 -21.097  -5.909
  436    HB   THR  55           HB       THR  55  -0.518 -23.443  -6.689
  437    HG1  THR  55           1HG      THR  55  -2.215 -21.995  -8.433
  438   1HG2  THR  55          1HG2      THR  55  -3.085 -22.049  -6.495
  439   2HG2  THR  55          2HG2      THR  55  -1.937 -21.683  -5.207
  440   3HG2  THR  55          3HG2      THR  55  -2.416 -23.352  -5.515
  441    H    GLU  56           H        GLU  56   1.823 -22.724  -6.000
  442    HA   GLU  56           HA       GLU  56   3.522 -22.339  -8.368
  443   1HB   GLU  56          2HB       GLU  56   4.228 -23.088  -5.526
  444   2HB   GLU  56          1HB       GLU  56   5.385 -23.039  -6.849
  445   1HG   GLU  56          2HG       GLU  56   4.905 -20.650  -7.156
  446   2HG   GLU  56          1HG       GLU  56   3.797 -20.714  -5.786
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1   0.984  18.231   9.395
    2   2H    MET   1          2HT       MET   1  -0.494  17.358   9.386
    3   3H    MET   1          3HT       MET   1   0.374  17.557  10.850
    4    HA   MET   1           HA       MET   1  -1.448  19.013  10.858
    5   1HB   MET   1          2HB       MET   1   1.180  19.692  11.269
    6   2HB   MET   1          1HB       MET   1   0.638  20.969  10.191
    7   1HG   MET   1          2HG       MET   1  -1.055  21.639  11.703
    8   2HG   MET   1          1HG       MET   1  -0.812  20.211  12.707
    9   1HE   MET   1          1HE       MET   1   1.231  23.366  11.287
   10   2HE   MET   1          2HE       MET   1   2.197  21.900  11.108
   11   3HE   MET   1          3HE       MET   1   2.692  23.151  12.254
   12    H    GLU   2           H        GLU   2   0.696  20.309   8.320
   13    HA   GLU   2           HA       GLU   2  -1.718  21.029   6.793
   14   1HB   GLU   2          2HB       GLU   2  -0.153  22.706   5.681
   15   2HB   GLU   2          1HB       GLU   2  -0.590  23.031   7.350
   16   1HG   GLU   2          2HG       GLU   2   1.509  22.527   8.147
   17   2HG   GLU   2          1HG       GLU   2   1.911  21.528   6.750
   18    H    ALA   3           H        ALA   3   1.342  19.380   6.709
   19    HA   ALA   3           HA       ALA   3   0.598  18.102   4.218
   20   1HB   ALA   3          1HB       ALA   3   2.343  18.803   2.879
   21   2HB   ALA   3          2HB       ALA   3   3.317  19.350   4.248
   22   3HB   ALA   3          3HB       ALA   3   1.914  20.286   3.733
   23    H    VAL   4           H        VAL   4   0.600  16.142   5.244
   24    HA   VAL   4           HA       VAL   4   3.201  14.980   5.769
   25    HB   VAL   4           HB       VAL   4   2.452  14.027   7.969
   26   1HG1  VAL   4          1HG1      VAL   4   4.003  16.005   7.664
   27   2HG1  VAL   4          2HG1      VAL   4   3.205  15.878   9.233
   28   3HG1  VAL   4          3HG1      VAL   4   2.617  17.032   8.035
   29   1HG2  VAL   4          1HG2      VAL   4   0.721  15.756   9.034
   30   2HG2  VAL   4          2HG2      VAL   4   0.215  14.256   8.248
   31   3HG2  VAL   4          3HG2      VAL   4   0.148  15.789   7.372
   32    H    ASP   5           H        ASP   5   1.074  14.622   3.823
   33    HA   ASP   5           HA       ASP   5  -0.540  12.411   4.329
   34   1HB   ASP   5          2HB       ASP   5  -0.287  14.089   2.246
   35   2HB   ASP   5          1HB       ASP   5   0.573  12.694   1.593
   36    H    ALA   6           H        ALA   6   2.848  12.620   3.592
   37    HA   ALA   6           HA       ALA   6   3.355  10.067   2.618
   38   1HB   ALA   6          1HB       ALA   6   4.889  12.204   3.104
   39   2HB   ALA   6          2HB       ALA   6   5.542  10.598   2.811
   40   3HB   ALA   6          3HB       ALA   6   5.365  11.189   4.462
   41    H    ASN   7           H        ASN   7   2.782  11.168   5.892
   42    HA   ASN   7           HA       ASN   7   3.732   8.893   7.256
   43   1HB   ASN   7          2HB       ASN   7   1.651  10.950   8.001
   44   2HB   ASN   7          1HB       ASN   7   2.189   9.684   9.099
   45   1HD2  ASN   7          1HD2      ASN   7   2.475  12.248   9.844
   46   2HD2  ASN   7          2HD2      ASN   7   4.136  12.715   9.823
   47    H    SER   8           H        SER   8   0.484   9.775   6.116
   48    HA   SER   8           HA       SER   8  -0.731   7.361   6.989
   49   1HB   SER   8          2HB       SER   8  -1.711   9.757   6.187
   50   2HB   SER   8          1HB       SER   8  -1.970   8.810   4.724
   51    HG   SER   8           HG       SER   8  -3.659   8.830   6.478
   52    H    LEU   9           H        LEU   9   0.874   8.405   4.078
   53    HA   LEU   9           HA       LEU   9   0.018   6.314   2.383
   54   1HB   LEU   9          2HB       LEU   9   1.059   8.489   1.675
   55   2HB   LEU   9          1HB       LEU   9   2.604   7.860   2.214
   56    HG   LEU   9           HG       LEU   9   0.922   6.620   0.036
   57   1HD1  LEU   9          1HD1      LEU   9   3.324   8.406  -0.133
   58   2HD1  LEU   9          2HD1      LEU   9   1.687   8.778  -0.673
   59   3HD1  LEU   9          3HD1      LEU   9   2.625   7.531  -1.489
   60   1HD2  LEU   9          1HD2      LEU   9   3.434   5.868   1.385
   61   2HD2  LEU   9          2HD2      LEU   9   3.417   5.728  -0.372
   62   3HD2  LEU   9          3HD2      LEU   9   2.222   4.861   0.593
   63    H    ALA  10           H        ALA  10   2.893   6.788   4.395
   64    HA   ALA  10           HA       ALA  10   4.219   4.413   3.686
   65   1HB   ALA  10          1HB       ALA  10   5.231   4.858   6.109
   66   2HB   ALA  10          2HB       ALA  10   4.470   6.425   5.836
   67   3HB   ALA  10          3HB       ALA  10   5.674   5.819   4.699
   68    H    GLN  11           H        GLN  11   1.494   4.927   5.711
   69    HA   GLN  11           HA       GLN  11   1.881   2.570   7.312
   70   1HB   GLN  11          2HB       GLN  11   0.709   4.350   8.363
   71   2HB   GLN  11          1HB       GLN  11  -0.400   4.510   7.005
   72   1HG   GLN  11          2HG       GLN  11  -1.267   2.272   7.509
   73   2HG   GLN  11          1HG       GLN  11  -0.239   2.212   8.935
   74   1HE2  GLN  11          1HE2      GLN  11  -1.678   2.262  10.548
   75   2HE2  GLN  11          2HE2      GLN  11  -2.852   3.508  10.798
   76    H    ALA  12           H        ALA  12  -0.162   3.506   4.567
   77    HA   ALA  12           HA       ALA  12  -1.718   1.225   4.353
   78   1HB   ALA  12          1HB       ALA  12  -1.483   3.456   2.894
   79   2HB   ALA  12          2HB       ALA  12  -2.315   2.012   2.312
   80   3HB   ALA  12          3HB       ALA  12  -0.645   2.324   1.829
   81    H    LYS  13           H        LYS  13   1.580   1.816   3.374
   82    HA   LYS  13           HA       LYS  13   1.886  -0.825   2.203
   83   1HB   LYS  13          2HB       LYS  13   4.394   0.136   2.200
   84   2HB   LYS  13          1HB       LYS  13   3.216   0.521   0.959
   85   1HG   LYS  13          2HG       LYS  13   2.814   2.634   1.797
   86   2HG   LYS  13          1HG       LYS  13   3.503   2.239   3.378
   87   1HD   LYS  13          2HD       LYS  13   5.056   2.427   0.793
   88   2HD   LYS  13          1HD       LYS  13   4.974   3.697   2.015
   89   1HE   LYS  13          2HE       LYS  13   5.702   1.200   3.234
   90   2HE   LYS  13          1HE       LYS  13   6.777   1.546   1.880
   91   1HZ   LYS  13          1HZ       LYS  13   7.430   2.460   4.133
   92   2HZ   LYS  13          2HZ       LYS  13   6.169   3.571   3.949
   93   3HZ   LYS  13          3HZ       LYS  13   7.448   3.554   2.843
   94    H    GLU  14           H        GLU  14   3.389   1.045   4.846
   95    HA   GLU  14           HA       GLU  14   4.943  -0.942   5.975
   96   1HB   GLU  14          2HB       GLU  14   5.058   1.346   6.768
   97   2HB   GLU  14          1HB       GLU  14   3.389   1.286   7.319
   98   1HG   GLU  14          2HG       GLU  14   4.672  -0.824   8.623
   99   2HG   GLU  14          1HG       GLU  14   5.808   0.523   8.680
  100    H    ALA  15           H        ALA  15   1.520  -0.309   6.230
  101    HA   ALA  15           HA       ALA  15   1.071  -2.430   8.156
  102   1HB   ALA  15          1HB       ALA  15  -1.066  -1.021   6.584
  103   2HB   ALA  15          2HB       ALA  15  -0.275  -0.265   7.968
  104   3HB   ALA  15          3HB       ALA  15  -1.179  -1.765   8.180
  105    H    ALA  16           H        ALA  16   0.902  -1.963   4.699
  106    HA   ALA  16           HA       ALA  16  -0.574  -4.347   4.139
  107   1HB   ALA  16          1HB       ALA  16   0.296  -3.934   1.780
  108   2HB   ALA  16          2HB       ALA  16   1.027  -2.469   2.429
  109   3HB   ALA  16          3HB       ALA  16  -0.722  -2.682   2.491
  110    H    ILE  17           H        ILE  17   2.772  -3.599   4.690
  111    HA   ILE  17           HA       ILE  17   3.805  -5.967   3.448
  112    HB   ILE  17           HB       ILE  17   5.261  -4.037   3.696
  113   1HG1  ILE  17          2HG1      ILE  17   6.261  -6.232   5.516
  114   2HG1  ILE  17          1HG1      ILE  17   6.196  -6.377   3.763
  115   1HG2  ILE  17          1HG2      ILE  17   4.585  -4.331   6.584
  116   2HG2  ILE  17          2HG2      ILE  17   4.656  -2.881   5.583
  117   3HG2  ILE  17          3HG2      ILE  17   6.147  -3.656   6.121
  118   1HD1  ILE  17          1HD1      ILE  17   7.539  -3.957   4.472
  119   2HD1  ILE  17          2HD1      ILE  17   8.140  -5.350   3.571
  120   3HD1  ILE  17          3HD1      ILE  17   8.259  -5.319   5.331
  121    H    LYS  18           H        LYS  18   2.706  -5.040   6.636
  122    HA   LYS  18           HA       LYS  18   3.690  -7.263   8.069
  123   1HB   LYS  18          2HB       LYS  18   2.083  -4.990   8.595
  124   2HB   LYS  18          1HB       LYS  18   1.156  -6.394   9.113
  125   1HG   LYS  18          2HG       LYS  18   3.350  -7.091  10.301
  126   2HG   LYS  18          1HG       LYS  18   3.789  -5.393  10.108
  127   1HD   LYS  18          2HD       LYS  18   2.217  -4.676  11.590
  128   2HD   LYS  18          1HD       LYS  18   1.093  -5.978  11.191
  129   1HE   LYS  18          2HE       LYS  18   1.882  -6.313  13.428
  130   2HE   LYS  18          1HE       LYS  18   2.585  -7.556  12.398
  131   1HZ   LYS  18          1HZ       LYS  18   4.412  -6.882  13.554
  132   2HZ   LYS  18          2HZ       LYS  18   3.880  -5.285  13.719
  133   3HZ   LYS  18          3HZ       LYS  18   4.514  -5.816  12.245
  134    H    GLU  19           H        GLU  19   0.872  -6.765   6.058
  135    HA   GLU  19           HA       GLU  19  -0.473  -9.166   6.801
  136   1HB   GLU  19          2HB       GLU  19  -0.868  -6.993   4.900
  137   2HB   GLU  19          1HB       GLU  19  -1.288  -8.552   4.203
  138   1HG   GLU  19          2HG       GLU  19  -3.287  -8.023   5.115
  139   2HG   GLU  19          1HG       GLU  19  -2.561  -8.821   6.509
  140    H    LEU  20           H        LEU  20   1.623  -8.247   4.097
  141    HA   LEU  20           HA       LEU  20   1.599 -10.751   2.816
  142   1HB   LEU  20          2HB       LEU  20   2.887  -8.247   2.470
  143   2HB   LEU  20          1HB       LEU  20   4.134  -9.480   2.467
  144    HG   LEU  20           HG       LEU  20   2.178 -10.535   0.824
  145   1HD1  LEU  20          1HD1      LEU  20   0.876  -8.776   0.286
  146   2HD1  LEU  20          2HD1      LEU  20   2.195  -8.416  -0.828
  147   3HD1  LEU  20          3HD1      LEU  20   2.104  -7.593   0.730
  148   1HD2  LEU  20          1HD2      LEU  20   4.424  -8.924  -0.288
  149   2HD2  LEU  20          2HD2      LEU  20   3.808 -10.495  -0.799
  150   3HD2  LEU  20          3HD2      LEU  20   4.758 -10.359   0.679
  151    H    LYS  21           H        LYS  21   3.171  -9.596   5.650
  152    HA   LYS  21           HA       LYS  21   5.182 -11.668   5.710
  153   1HB   LYS  21          2HB       LYS  21   5.492  -9.357   6.682
  154   2HB   LYS  21          1HB       LYS  21   4.364  -9.816   7.950
  155   1HG   LYS  21          2HG       LYS  21   6.334 -11.843   7.778
  156   2HG   LYS  21          1HG       LYS  21   7.160 -10.284   7.796
  157   1HD   LYS  21          2HD       LYS  21   6.961 -10.743  10.052
  158   2HD   LYS  21          1HD       LYS  21   5.532  -9.750   9.758
  159   1HE   LYS  21          2HE       LYS  21   4.985 -12.542   9.260
  160   2HE   LYS  21          1HE       LYS  21   5.616 -12.300  10.887
  161   1HZ   LYS  21          1HZ       LYS  21   3.866 -10.345  10.826
  162   2HZ   LYS  21          2HZ       LYS  21   3.430 -11.916  11.272
  163   3HZ   LYS  21          3HZ       LYS  21   3.115 -11.366   9.704
  164    H    GLN  22           H        GLN  22   2.090 -10.955   7.301
  165    HA   GLN  22           HA       GLN  22   2.245 -13.340   8.929
  166   1HB   GLN  22          2HB       GLN  22  -0.019 -12.729   9.672
  167   2HB   GLN  22          1HB       GLN  22   1.102 -11.383   9.812
  168   1HG   GLN  22          2HG       GLN  22  -0.072 -10.117   8.413
  169   2HG   GLN  22          1HG       GLN  22  -0.297 -11.435   7.264
  170   1HE2  GLN  22          1HE2      GLN  22  -1.807 -13.212   8.255
  171   2HE2  GLN  22          2HE2      GLN  22  -3.293 -12.606   8.896
  172    H    TYR  23           H        TYR  23   0.949 -12.433   5.844
  173    HA   TYR  23           HA       TYR  23  -0.827 -14.674   5.588
  174   1HB   TYR  23          2HB       TYR  23   0.139 -12.488   3.795
  175   2HB   TYR  23          1HB       TYR  23  -0.548 -13.933   3.054
  176    HD1  TYR  23           1HD      TYR  23  -2.818 -14.700   4.393
  177    HD2  TYR  23           2HD      TYR  23  -1.320 -10.740   4.006
  178    HE1  TYR  23           1HE      TYR  23  -5.081 -13.817   4.749
  179    HE2  TYR  23           2HE      TYR  23  -3.577  -9.844   4.363
  180    HH   TYR  23           HH       TYR  23  -6.162 -11.130   3.931
  181    H    GLY  24           H        GLY  24   2.439 -13.867   4.528
  182   1HA   GLY  24          2HA       GLY  24   4.121 -15.577   4.383
  183   2HA   GLY  24          1HA       GLY  24   2.861 -16.721   3.945
  184    H    ILE  25           H        ILE  25   2.111 -14.025   2.243
  185    HA   ILE  25           HA       ILE  25   2.660 -15.071  -0.253
  186    HB   ILE  25           HB       ILE  25   2.868 -12.126  -0.161
  187   1HG1  ILE  25          2HG1      ILE  25   0.403 -13.562   0.853
  188   2HG1  ILE  25          1HG1      ILE  25   1.368 -12.371   1.719
  189   1HG2  ILE  25          1HG2      ILE  25   0.638 -13.164  -1.617
  190   2HG2  ILE  25          2HG2      ILE  25   2.070 -14.140  -1.957
  191   3HG2  ILE  25          3HG2      ILE  25   2.107 -12.397  -2.223
  192   1HD1  ILE  25          1HD1      ILE  25  -0.576 -11.972  -0.502
  193   2HD1  ILE  25          2HD1      ILE  25   0.718 -10.804  -0.248
  194   3HD1  ILE  25          3HD1      ILE  25  -0.441 -11.130   1.041
  195    H    GLY  26           H        GLY  26   4.114 -13.856  -1.945
  196   1HA   GLY  26          2HA       GLY  26   6.822 -14.283  -1.072
  197   2HA   GLY  26          1HA       GLY  26   6.302 -13.841  -2.695
  198    H    ASP  27           H        ASP  27   8.541 -12.818  -1.153
  199    HA   ASP  27           HA       ASP  27   8.048 -10.278  -0.066
  200   1HB   ASP  27          2HB       ASP  27  10.504  -9.875  -0.673
  201   2HB   ASP  27          1HB       ASP  27  10.163 -11.245   0.380
  202    H    TYR  28           H        TYR  28   8.230 -11.364  -3.353
  203    HA   TYR  28           HA       TYR  28   8.912  -9.165  -4.832
  204   1HB   TYR  28          2HB       TYR  28   7.735 -11.551  -5.421
  205   2HB   TYR  28          1HB       TYR  28   6.387 -10.452  -5.691
  206    HD1  TYR  28           1HD      TYR  28   8.062 -12.176  -7.724
  207    HD2  TYR  28           2HD      TYR  28   8.104  -8.082  -6.579
  208    HE1  TYR  28           1HE      TYR  28   8.966 -11.571  -9.930
  209    HE2  TYR  28           2HE      TYR  28   9.003  -7.466  -8.766
  210    HH   TYR  28           HH       TYR  28  10.201  -8.441 -10.614
  211    H    TYR  29           H        TYR  29   5.795  -9.866  -3.399
  212    HA   TYR  29           HA       TYR  29   4.642  -7.395  -4.248
  213   1HB   TYR  29          2HB       TYR  29   3.500  -9.460  -2.369
  214   2HB   TYR  29          1HB       TYR  29   2.614  -8.195  -3.219
  215    HD1  TYR  29           1HD      TYR  29   3.764 -11.538  -3.407
  216    HD2  TYR  29           2HD      TYR  29   2.886  -8.134  -5.813
  217    HE1  TYR  29           1HE      TYR  29   3.630 -12.983  -5.388
  218    HE2  TYR  29           2HE      TYR  29   2.711  -9.583  -7.795
  219    HH   TYR  29           HH       TYR  29   3.453 -11.730  -8.577
  220    H    ILE  30           H        ILE  30   6.367  -8.325  -1.385
  221    HA   ILE  30           HA       ILE  30   5.229  -6.251   0.245
  222    HB   ILE  30           HB       ILE  30   6.699  -6.830   1.892
  223   1HG1  ILE  30          2HG1      ILE  30   8.980  -7.965   1.293
  224   2HG1  ILE  30          1HG1      ILE  30   8.701  -7.231  -0.283
  225   1HG2  ILE  30          1HG2      ILE  30   5.653  -8.854   1.649
  226   2HG2  ILE  30          2HG2      ILE  30   7.354  -9.306   1.632
  227   3HG2  ILE  30          3HG2      ILE  30   6.453  -9.208   0.122
  228   1HD1  ILE  30          1HD1      ILE  30   8.192  -5.165   1.424
  229   2HD1  ILE  30          2HD1      ILE  30   9.715  -5.447   0.574
  230   3HD1  ILE  30          3HD1      ILE  30   9.511  -6.017   2.232
  231    H    LYS  31           H        LYS  31   7.764  -6.617  -2.075
  232    HA   LYS  31           HA       LYS  31   8.923  -4.008  -1.660
  233   1HB   LYS  31          2HB       LYS  31   9.445  -6.352  -3.412
  234   2HB   LYS  31          1HB       LYS  31  10.023  -4.784  -3.956
  235   1HG   LYS  31          2HG       LYS  31  11.849  -5.228  -2.760
  236   2HG   LYS  31          1HG       LYS  31  10.862  -4.845  -1.348
  237   1HD   LYS  31          2HD       LYS  31  10.165  -7.394  -1.626
  238   2HD   LYS  31          1HD       LYS  31  11.752  -7.478  -2.395
  239   1HE   LYS  31          2HE       LYS  31  11.625  -6.021   0.167
  240   2HE   LYS  31          1HE       LYS  31  11.351  -7.759   0.254
  241   1HZ   LYS  31          1HZ       LYS  31  13.456  -8.211  -0.563
  242   2HZ   LYS  31          2HZ       LYS  31  13.734  -6.888   0.452
  243   3HZ   LYS  31          3HZ       LYS  31  13.660  -6.667  -1.223
  244    H    LEU  32           H        LEU  32   6.995  -5.631  -4.194
  245    HA   LEU  32           HA       LEU  32   6.859  -3.565  -6.004
  246   1HB   LEU  32          2HB       LEU  32   5.412  -4.885  -7.119
  247   2HB   LEU  32          1HB       LEU  32   5.782  -6.045  -5.864
  248    HG   LEU  32           HG       LEU  32   3.459  -6.082  -6.072
  249   1HD1  LEU  32          1HD1      LEU  32   4.726  -5.128  -3.773
  250   2HD1  LEU  32          2HD1      LEU  32   3.206  -6.032  -3.886
  251   3HD1  LEU  32          3HD1      LEU  32   3.189  -4.266  -3.895
  252   1HD2  LEU  32          1HD2      LEU  32   2.367  -4.396  -7.025
  253   2HD2  LEU  32          2HD2      LEU  32   3.776  -3.351  -6.855
  254   3HD2  LEU  32          3HD2      LEU  32   2.587  -3.446  -5.556
  255    H    ILE  33           H        ILE  33   5.558  -3.668  -2.865
  256    HA   ILE  33           HA       ILE  33   3.518  -1.666  -3.270
  257    HB   ILE  33           HB       ILE  33   4.633  -3.094  -0.871
  258   1HG1  ILE  33          2HG1      ILE  33   2.043  -3.030  -2.381
  259   2HG1  ILE  33          1HG1      ILE  33   3.039  -4.410  -1.939
  260   1HG2  ILE  33          1HG2      ILE  33   4.142  -1.408   0.483
  261   2HG2  ILE  33          2HG2      ILE  33   2.452  -1.568   0.014
  262   3HG2  ILE  33          3HG2      ILE  33   3.502  -0.454  -0.852
  263   1HD1  ILE  33          1HD1      ILE  33   0.756  -3.379  -0.634
  264   2HD1  ILE  33          2HD1      ILE  33   2.133  -3.202   0.455
  265   3HD1  ILE  33          3HD1      ILE  33   1.732  -4.784  -0.208
  266    H    ASN  34           H        ASN  34   6.557  -1.813  -1.402
  267    HA   ASN  34           HA       ASN  34   6.716   0.831  -0.641
  268   1HB   ASN  34          2HB       ASN  34   8.437  -1.432  -0.653
  269   2HB   ASN  34          1HB       ASN  34   9.358  -0.062  -1.268
  270   1HD2  ASN  34          1HD2      ASN  34   9.508   1.830   0.049
  271   2HD2  ASN  34          2HD2      ASN  34   9.371   1.705   1.766
  272    H    ASN  35           H        ASN  35   7.201  -0.504  -3.797
  273    HA   ASN  35           HA       ASN  35   8.755   1.662  -4.834
  274   1HB   ASN  35          2HB       ASN  35   7.587  -0.826  -5.857
  275   2HB   ASN  35          1HB       ASN  35   7.621   0.483  -7.034
  276   1HD2  ASN  35          1HD2      ASN  35   9.218  -0.191  -8.336
  277   2HD2  ASN  35          2HD2      ASN  35  10.850  -0.452  -7.833
  278    H    ALA  36           H        ALA  36   5.382   1.170  -4.289
  279    HA   ALA  36           HA       ALA  36   4.268   2.764  -6.293
  280   1HB   ALA  36          1HB       ALA  36   2.586   3.201  -4.203
  281   2HB   ALA  36          2HB       ALA  36   3.394   1.711  -3.711
  282   3HB   ALA  36          3HB       ALA  36   2.547   1.786  -5.255
  283    H    LYS  37           H        LYS  37   3.473   4.899  -6.264
  284    HA   LYS  37           HA       LYS  37   5.211   6.730  -4.778
  285   1HB   LYS  37          2HB       LYS  37   3.640   6.927  -7.326
  286   2HB   LYS  37          1HB       LYS  37   4.117   8.387  -6.470
  287   1HG   LYS  37          2HG       LYS  37   5.737   7.923  -8.165
  288   2HG   LYS  37          1HG       LYS  37   6.474   7.631  -6.588
  289   1HD   LYS  37          2HD       LYS  37   7.057   5.869  -8.176
  290   2HD   LYS  37          1HD       LYS  37   6.087   5.233  -6.847
  291   1HE   LYS  37          2HE       LYS  37   4.354   4.713  -8.191
  292   2HE   LYS  37          1HE       LYS  37   4.560   6.154  -9.185
  293   1HZ   LYS  37          1HZ       LYS  37   5.862   5.069 -10.636
  294   2HZ   LYS  37          2HZ       LYS  37   5.128   3.681 -10.007
  295   3HZ   LYS  37          3HZ       LYS  37   6.649   4.162  -9.443
  296    H    THR  38           H        THR  38   1.829   6.009  -5.421
  297    HA   THR  38           HA       THR  38   0.970   8.090  -3.549
  298    HB   THR  38           HB       THR  38  -1.031   6.340  -4.866
  299    HG1  THR  38           1HG      THR  38   0.681   8.075  -6.295
  300   1HG2  THR  38          1HG2      THR  38  -2.332   8.229  -5.000
  301   2HG2  THR  38          2HG2      THR  38  -0.947   9.319  -4.995
  302   3HG2  THR  38          3HG2      THR  38  -1.436   8.501  -3.511
  303    H    VAL  39           H        VAL  39  -1.511   6.544  -2.896
  304    HA   VAL  39           HA       VAL  39  -0.339   4.411  -1.275
  305    HB   VAL  39           HB       VAL  39  -0.799   6.684  -0.036
  306   1HG1  VAL  39          1HG1      VAL  39  -3.432   5.269   0.255
  307   2HG1  VAL  39          2HG1      VAL  39  -3.189   6.735  -0.697
  308   3HG1  VAL  39          3HG1      VAL  39  -2.926   6.760   1.049
  309   1HG2  VAL  39          1HG2      VAL  39  -1.403   5.157   1.979
  310   2HG2  VAL  39          2HG2      VAL  39   0.152   4.965   1.162
  311   3HG2  VAL  39          3HG2      VAL  39  -1.173   3.860   0.809
  312    H    GLU  40           H        GLU  40  -3.353   5.842  -2.481
  313    HA   GLU  40           HA       GLU  40  -5.147   3.890  -1.783
  314   1HB   GLU  40          2HB       GLU  40  -4.960   5.874  -3.940
  315   2HB   GLU  40          1HB       GLU  40  -5.978   4.494  -4.326
  316   1HG   GLU  40          2HG       GLU  40  -6.829   5.104  -1.819
  317   2HG   GLU  40          1HG       GLU  40  -6.414   6.697  -2.452
  318    H    GLY  41           H        GLY  41  -2.740   3.798  -4.324
  319   1HA   GLY  41          2HA       GLY  41  -3.711   1.270  -5.361
  320   2HA   GLY  41          1HA       GLY  41  -2.275   2.137  -5.892
  321    H    VAL  42           H        VAL  42  -1.105   2.448  -3.314
  322    HA   VAL  42           HA       VAL  42   0.540   0.269  -3.115
  323    HB   VAL  42           HB       VAL  42  -0.330   2.028  -0.823
  324   1HG1  VAL  42          1HG1      VAL  42   0.814   0.477   0.338
  325   2HG1  VAL  42          2HG1      VAL  42   2.225   1.321  -0.313
  326   3HG1  VAL  42          3HG1      VAL  42   1.629  -0.141  -1.103
  327   1HG2  VAL  42          1HG2      VAL  42   1.306   3.540  -1.413
  328   2HG2  VAL  42          2HG2      VAL  42   0.730   3.029  -2.999
  329   3HG2  VAL  42          3HG2      VAL  42   2.218   2.354  -2.337
  330    H    GLU  43           H        GLU  43  -2.360   0.866  -1.139
  331    HA   GLU  43           HA       GLU  43  -2.203  -1.601   0.258
  332   1HB   GLU  43          2HB       GLU  43  -4.733  -1.031   0.669
  333   2HB   GLU  43          1HB       GLU  43  -3.470  -0.058   1.409
  334   1HG   GLU  43          2HG       GLU  43  -3.778   1.701  -0.084
  335   2HG   GLU  43          1HG       GLU  43  -4.667   0.693  -1.228
  336    H    SER  44           H        SER  44  -4.232  -0.538  -2.459
  337    HA   SER  44           HA       SER  44  -5.609  -2.965  -2.783
  338   1HB   SER  44          2HB       SER  44  -6.562  -1.994  -4.650
  339   2HB   SER  44          1HB       SER  44  -6.004  -0.556  -3.794
  340    HG   SER  44           HG       SER  44  -5.447  -1.070  -6.206
  341    H    LEU  45           H        LEU  45  -2.429  -1.979  -3.661
  342    HA   LEU  45           HA       LEU  45  -1.943  -3.696  -5.835
  343   1HB   LEU  45          2HB       LEU  45  -0.169  -2.418  -3.783
  344   2HB   LEU  45          1HB       LEU  45   0.487  -3.523  -4.972
  345   1HD1  LEU  45          1HD1      LEU  45   1.042  -2.845  -7.072
  346   2HD1  LEU  45          2HD1      LEU  45   1.939  -1.704  -6.067
  347   3HD1  LEU  45          3HD1      LEU  45   1.034  -1.125  -7.465
  348   1HD2  LEU  45          1HD2      LEU  45  -2.307  -1.586  -6.047
  349   2HD2  LEU  45          2HD2      LEU  45  -1.432  -2.289  -7.406
  350   3HD2  LEU  45          3HD2      LEU  45  -1.405  -0.546  -7.148
  351    H    LYS  46           H        LYS  46  -0.995  -4.185  -2.411
  352    HA   LYS  46           HA       LYS  46  -0.318  -6.920  -2.856
  353   1HB   LYS  46          2HB       LYS  46   0.812  -6.352  -1.003
  354   2HB   LYS  46          1HB       LYS  46  -0.288  -5.045  -0.605
  355   1HG   LYS  46          2HG       LYS  46  -1.048  -7.897  -0.077
  356   2HG   LYS  46          1HG       LYS  46  -0.004  -7.009   1.037
  357   1HD   LYS  46          2HD       LYS  46  -1.793  -5.202   1.047
  358   2HD   LYS  46          1HD       LYS  46  -2.838  -6.374   0.251
  359   1HE   LYS  46          2HE       LYS  46  -3.085  -7.631   2.106
  360   2HE   LYS  46          1HE       LYS  46  -1.448  -7.307   2.676
  361   1HZ   LYS  46          1HZ       LYS  46  -3.040  -6.282   4.135
  362   2HZ   LYS  46          2HZ       LYS  46  -3.771  -5.465   2.849
  363   3HZ   LYS  46          3HZ       LYS  46  -2.194  -5.070   3.314
  364    H    ASN  47           H        ASN  47  -3.143  -5.290  -1.447
  365    HA   ASN  47           HA       ASN  47  -4.540  -7.582  -0.663
  366   1HB   ASN  47          2HB       ASN  47  -5.103  -4.784  -0.927
  367   2HB   ASN  47          1HB       ASN  47  -6.436  -5.685  -1.644
  368   1HD2  ASN  47          1HD2      ASN  47  -6.002  -4.104   0.919
  369   2HD2  ASN  47          2HD2      ASN  47  -6.624  -5.142   2.151
  370    H    GLU  48           H        GLU  48  -4.017  -6.193  -3.802
  371    HA   GLU  48           HA       GLU  48  -6.079  -7.714  -5.116
  372   1HB   GLU  48          2HB       GLU  48  -3.861  -5.914  -6.008
  373   2HB   GLU  48          1HB       GLU  48  -4.581  -7.009  -7.180
  374   1HG   GLU  48          2HG       GLU  48  -6.576  -5.562  -5.649
  375   2HG   GLU  48          1HG       GLU  48  -5.479  -4.491  -6.519
  376    H    ILE  49           H        ILE  49  -2.637  -7.998  -4.514
  377    HA   ILE  49           HA       ILE  49  -2.152 -10.237  -6.176
  378    HB   ILE  49           HB       ILE  49  -0.073 -10.489  -5.057
  379   1HG1  ILE  49          2HG1      ILE  49  -0.457  -8.582  -2.869
  380   2HG1  ILE  49          1HG1      ILE  49  -1.419 -10.038  -2.699
  381   1HG2  ILE  49          1HG2      ILE  49  -1.005  -7.891  -5.817
  382   2HG2  ILE  49          2HG2      ILE  49   0.572  -8.635  -6.069
  383   3HG2  ILE  49          3HG2      ILE  49   0.240  -7.757  -4.575
  384   1HD1  ILE  49          1HD1      ILE  49   1.119  -9.731  -1.858
  385   2HD1  ILE  49          2HD1      ILE  49   1.362 -10.496  -3.428
  386   3HD1  ILE  49          3HD1      ILE  49   0.353 -11.277  -2.214
  387    H    LEU  50           H        LEU  50  -3.526  -9.811  -3.049
  388    HA   LEU  50           HA       LEU  50  -3.379 -12.571  -2.261
  389   1HB   LEU  50          2HB       LEU  50  -4.778 -10.145  -1.146
  390   2HB   LEU  50          1HB       LEU  50  -4.916 -11.734  -0.415
  391    HG   LEU  50           HG       LEU  50  -2.158 -10.820  -0.886
  392   1HD1  LEU  50          1HD1      LEU  50  -3.997  -9.390   1.011
  393   2HD1  LEU  50          2HD1      LEU  50  -2.969  -8.702  -0.248
  394   3HD1  LEU  50          3HD1      LEU  50  -2.243  -9.408   1.197
  395   1HD2  LEU  50          1HD2      LEU  50  -2.296 -11.550   1.689
  396   2HD2  LEU  50          2HD2      LEU  50  -2.107 -12.700   0.364
  397   3HD2  LEU  50          3HD2      LEU  50  -3.702 -12.411   1.063
  398    H    LYS  51           H        LYS  51  -5.721 -10.421  -3.752
  399    HA   LYS  51           HA       LYS  51  -7.998 -12.045  -3.514
  400   1HB   LYS  51          2HB       LYS  51  -7.257  -9.651  -4.903
  401   2HB   LYS  51          1HB       LYS  51  -8.088 -10.716  -6.028
  402   1HG   LYS  51          2HG       LYS  51  -9.180  -9.969  -3.327
  403   2HG   LYS  51          1HG       LYS  51  -9.556  -9.101  -4.817
  404   1HD   LYS  51          2HD       LYS  51 -10.064 -11.664  -5.558
  405   2HD   LYS  51          1HD       LYS  51 -10.511 -11.709  -3.852
  406   1HE   LYS  51          2HE       LYS  51 -11.745  -9.460  -4.484
  407   2HE   LYS  51          1HE       LYS  51 -11.704 -10.172  -6.092
  408   1HZ   LYS  51          1HZ       LYS  51 -12.907 -11.369  -3.660
  409   2HZ   LYS  51          2HZ       LYS  51 -12.774 -12.164  -5.147
  410   3HZ   LYS  51          3HZ       LYS  51 -13.730 -10.784  -5.008
  411    H    ALA  52           H        ALA  52  -5.158 -12.338  -5.416
  412    HA   ALA  52           HA       ALA  52  -6.154 -14.816  -6.567
  413   1HB   ALA  52          1HB       ALA  52  -5.334 -14.242  -8.810
  414   2HB   ALA  52          2HB       ALA  52  -4.957 -12.613  -8.245
  415   3HB   ALA  52          3HB       ALA  52  -6.632 -13.166  -8.291
  416    H    LEU  53           H        LEU  53  -4.546 -15.011  -4.572
  417    HA   LEU  53           HA       LEU  53  -1.859 -14.619  -4.662
  418   1HB   LEU  53          2HB       LEU  53  -3.629 -16.586  -3.410
  419   2HB   LEU  53          1HB       LEU  53  -1.988 -17.163  -3.632
  420    HG   LEU  53           HG       LEU  53  -2.377 -14.478  -2.396
  421   1HD1  LEU  53          1HD1      LEU  53  -2.614 -17.029  -0.816
  422   2HD1  LEU  53          2HD1      LEU  53  -3.996 -16.042  -1.293
  423   3HD1  LEU  53          3HD1      LEU  53  -2.760 -15.373  -0.227
  424   1HD2  LEU  53          1HD2      LEU  53  -0.333 -16.613  -2.501
  425   2HD2  LEU  53          2HD2      LEU  53  -0.460 -15.706  -0.993
  426   3HD2  LEU  53          3HD2      LEU  53  -0.148 -14.860  -2.509
  427    HA   PRO  54           HA       PRO  54  -0.938 -17.131  -8.324
  428   1HB   PRO  54          2HB       PRO  54   1.142 -15.705  -9.195
  429   2HB   PRO  54          1HB       PRO  54  -0.511 -15.103  -9.370
  430   1HG   PRO  54          2HG       PRO  54   1.579 -14.349  -7.373
  431   2HG   PRO  54          1HG       PRO  54   0.410 -13.318  -8.216
  432   1HD   PRO  54          2HD       PRO  54   0.123 -14.280  -5.626
  433   2HD   PRO  54          1HD       PRO  54  -1.199 -13.688  -6.649
  434    H    THR  55           H        THR  55   1.553 -17.652  -9.141
  435    HA   THR  55           HA       THR  55   2.931 -18.730  -6.768
  436    HB   THR  55           HB       THR  55   3.691 -20.459  -8.702
  437    HG1  THR  55           1HG      THR  55   2.080 -20.839 -10.103
  438   1HG2  THR  55          1HG2      THR  55   1.050 -20.936  -7.400
  439   2HG2  THR  55          2HG2      THR  55   2.529 -20.873  -6.442
  440   3HG2  THR  55          3HG2      THR  55   2.360 -22.069  -7.726
  441    H    GLU  56           H        GLU  56   3.353 -16.223  -8.314
  442    HA   GLU  56           HA       GLU  56   5.058 -14.973  -9.149
  443   1HB   GLU  56          2HB       GLU  56   6.060 -16.375  -7.035
  444   2HB   GLU  56          1HB       GLU  56   7.183 -16.831  -8.308
  445   1HG   GLU  56          2HG       GLU  56   8.054 -14.746  -8.482
  446   2HG   GLU  56          1HG       GLU  56   6.542 -13.956  -8.039
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1  -4.993   8.216  13.860
    2   2H    MET   1          2HT       MET   1  -4.292   6.716  14.311
    3   3H    MET   1          3HT       MET   1  -4.693   7.023  12.671
    4    HA   MET   1           HA       MET   1  -2.767   8.645  14.172
    5   1HB   MET   1          2HB       MET   1  -2.525   5.956  12.963
    6   2HB   MET   1          1HB       MET   1  -1.254   7.091  12.546
    7   1HG   MET   1          2HG       MET   1  -1.772   7.189  15.363
    8   2HG   MET   1          1HG       MET   1  -1.461   5.530  14.848
    9   1HE   MET   1          1HE       MET   1   2.160   5.271  14.399
   10   2HE   MET   1          2HE       MET   1   0.572   4.595  14.045
   11   3HE   MET   1          3HE       MET   1   1.043   4.925  15.712
   12    H    GLU   2           H        GLU   2  -1.850  10.209  12.943
   13    HA   GLU   2           HA       GLU   2  -2.024  10.201  10.068
   14   1HB   GLU   2          2HB       GLU   2  -3.881  11.815  11.739
   15   2HB   GLU   2          1HB       GLU   2  -3.157  12.622  10.359
   16   1HG   GLU   2          2HG       GLU   2  -4.081  10.059   9.521
   17   2HG   GLU   2          1HG       GLU   2  -5.373  10.888  10.402
   18    H    ALA   3           H        ALA   3  -1.357  12.597   9.317
   19    HA   ALA   3           HA       ALA   3   0.432  13.980  11.064
   20   1HB   ALA   3          1HB       ALA   3   1.634  12.249   8.910
   21   2HB   ALA   3          2HB       ALA   3   1.845  12.065  10.652
   22   3HB   ALA   3          3HB       ALA   3   2.505  13.477   9.826
   23    H    VAL   4           H        VAL   4   0.691  13.350   7.576
   24    HA   VAL   4           HA       VAL   4  -0.530  15.889   6.939
   25    HB   VAL   4           HB       VAL   4   2.338  15.425   6.115
   26   1HG1  VAL   4          1HG1      VAL   4   0.970  18.059   5.992
   27   2HG1  VAL   4          2HG1      VAL   4   0.579  16.858   4.766
   28   3HG1  VAL   4          3HG1      VAL   4   2.244  17.398   4.968
   29   1HG2  VAL   4          1HG2      VAL   4   2.320  15.837   8.480
   30   2HG2  VAL   4          2HG2      VAL   4   1.207  17.189   8.279
   31   3HG2  VAL   4          3HG2      VAL   4   2.857  17.304   7.658
   32    H    ASP   5           H        ASP   5   1.170  13.000   5.804
   33    HA   ASP   5           HA       ASP   5  -0.709  12.210   3.973
   34   1HB   ASP   5          2HB       ASP   5   0.569  12.879   1.813
   35   2HB   ASP   5          1HB       ASP   5  -0.500  14.053   2.566
   36    H    ALA   6           H        ALA   6   2.833  12.662   3.921
   37    HA   ALA   6           HA       ALA   6   3.461  10.200   2.765
   38   1HB   ALA   6          1HB       ALA   6   5.646  10.696   4.301
   39   2HB   ALA   6          2HB       ALA   6   4.918  12.303   4.200
   40   3HB   ALA   6          3HB       ALA   6   5.336  11.426   2.725
   41    H    ASN   7           H        ASN   7   2.909  11.078   6.135
   42    HA   ASN   7           HA       ASN   7   3.846   8.684   7.297
   43   1HB   ASN   7          2HB       ASN   7   3.078  11.002   8.344
   44   2HB   ASN   7          1HB       ASN   7   1.555  10.138   8.539
   45   1HD2  ASN   7          1HD2      ASN   7   1.521   8.251   9.829
   46   2HD2  ASN   7          2HD2      ASN   7   2.712   7.990  11.052
   47    H    SER   8           H        SER   8   0.592   9.688   6.284
   48    HA   SER   8           HA       SER   8  -0.657   7.246   7.020
   49   1HB   SER   8          2HB       SER   8  -1.714   9.577   6.523
   50   2HB   SER   8          1HB       SER   8  -1.731   9.021   4.850
   51    HG   SER   8           HG       SER   8  -3.258   7.633   5.321
   52    H    LEU   9           H        LEU   9   0.966   8.389   4.153
   53    HA   LEU   9           HA       LEU   9   0.068   6.375   2.370
   54   1HB   LEU   9          2HB       LEU   9   1.136   8.575   1.763
   55   2HB   LEU   9          1HB       LEU   9   2.671   7.889   2.260
   56    HG   LEU   9           HG       LEU   9   0.965   6.750   0.055
   57   1HD1  LEU   9          1HD1      LEU   9   3.243   8.685  -0.014
   58   2HD1  LEU   9          2HD1      LEU   9   1.633   8.875  -0.703
   59   3HD1  LEU   9          3HD1      LEU   9   2.768   7.720  -1.411
   60   1HD2  LEU   9          1HD2      LEU   9   3.484   5.931  -0.421
   61   2HD2  LEU   9          2HD2      LEU   9   2.301   4.992   0.489
   62   3HD2  LEU   9          3HD2      LEU   9   3.493   5.976   1.342
   63    H    ALA  10           H        ALA  10   2.961   6.728   4.384
   64    HA   ALA  10           HA       ALA  10   4.235   4.352   3.573
   65   1HB   ALA  10          1HB       ALA  10   5.460   4.658   5.814
   66   2HB   ALA  10          2HB       ALA  10   4.535   6.151   5.940
   67   3HB   ALA  10          3HB       ALA  10   5.630   5.901   4.580
   68    H    GLN  11           H        GLN  11   1.563   4.876   5.654
   69    HA   GLN  11           HA       GLN  11   1.913   2.492   7.217
   70   1HB   GLN  11          2HB       GLN  11   0.774   4.298   8.276
   71   2HB   GLN  11          1HB       GLN  11  -0.346   4.463   6.928
   72   1HG   GLN  11          2HG       GLN  11  -1.231   2.239   7.444
   73   2HG   GLN  11          1HG       GLN  11  -0.185   2.164   8.856
   74   1HE2  GLN  11          1HE2      GLN  11  -3.234   2.799   7.868
   75   2HE2  GLN  11          2HE2      GLN  11  -3.757   3.834   9.149
   76    H    ALA  12           H        ALA  12  -0.047   3.491   4.447
   77    HA   ALA  12           HA       ALA  12  -1.697   1.284   4.206
   78   1HB   ALA  12          1HB       ALA  12  -0.505   2.325   1.707
   79   2HB   ALA  12          2HB       ALA  12  -1.337   3.488   2.744
   80   3HB   ALA  12          3HB       ALA  12  -2.199   2.073   2.138
   81    H    LYS  13           H        LYS  13   1.646   1.726   3.250
   82    HA   LYS  13           HA       LYS  13   1.837  -0.963   2.163
   83   1HB   LYS  13          2HB       LYS  13   4.379  -0.151   2.118
   84   2HB   LYS  13          1HB       LYS  13   3.219   0.300   0.884
   85   1HG   LYS  13          2HG       LYS  13   2.994   2.449   1.673
   86   2HG   LYS  13          1HG       LYS  13   3.611   2.027   3.277
   87   1HD   LYS  13          2HD       LYS  13   5.801   2.115   2.601
   88   2HD   LYS  13          1HD       LYS  13   5.414   1.661   0.939
   89   1HE   LYS  13          2HE       LYS  13   5.329   3.788   0.301
   90   2HE   LYS  13          1HE       LYS  13   4.224   4.196   1.611
   91   1HZ   LYS  13          1HZ       LYS  13   7.019   4.703   1.384
   92   2HZ   LYS  13          2HZ       LYS  13   6.659   3.893   2.825
   93   3HZ   LYS  13          3HZ       LYS  13   5.890   5.350   2.465
   94    H    GLU  14           H        GLU  14   3.394   0.917   4.772
   95    HA   GLU  14           HA       GLU  14   4.882  -1.079   5.956
   96   1HB   GLU  14          2HB       GLU  14   3.451   1.322   7.059
   97   2HB   GLU  14          1HB       GLU  14   4.238   0.196   8.158
   98   1HG   GLU  14          2HG       GLU  14   6.367   0.619   7.216
   99   2HG   GLU  14          1HG       GLU  14   5.664   1.492   5.856
  100    H    ALA  15           H        ALA  15   1.471  -0.395   6.133
  101    HA   ALA  15           HA       ALA  15   0.957  -2.501   8.068
  102   1HB   ALA  15          1HB       ALA  15  -1.174  -1.104   6.494
  103   2HB   ALA  15          2HB       ALA  15  -0.332  -0.273   7.801
  104   3HB   ALA  15          3HB       ALA  15  -1.239  -1.748   8.135
  105    H    ALA  16           H        ALA  16   0.691  -1.980   4.601
  106    HA   ALA  16           HA       ALA  16  -0.799  -4.329   4.025
  107   1HB   ALA  16          1HB       ALA  16  -0.851  -2.661   2.371
  108   2HB   ALA  16          2HB       ALA  16   0.121  -3.958   1.678
  109   3HB   ALA  16          3HB       ALA  16   0.906  -2.523   2.332
  110    H    ILE  17           H        ILE  17   2.577  -3.693   4.573
  111    HA   ILE  17           HA       ILE  17   3.519  -6.132   3.392
  112    HB   ILE  17           HB       ILE  17   5.031  -4.235   3.570
  113   1HG1  ILE  17          2HG1      ILE  17   6.060  -6.336   5.470
  114   2HG1  ILE  17          1HG1      ILE  17   5.836  -6.663   3.755
  115   1HG2  ILE  17          1HG2      ILE  17   5.958  -3.732   5.909
  116   2HG2  ILE  17          2HG2      ILE  17   4.480  -4.487   6.501
  117   3HG2  ILE  17          3HG2      ILE  17   4.389  -3.062   5.469
  118   1HD1  ILE  17          1HD1      ILE  17   7.335  -4.672   3.325
  119   2HD1  ILE  17          2HD1      ILE  17   8.098  -6.104   4.018
  120   3HD1  ILE  17          3HD1      ILE  17   7.719  -4.721   5.047
  121    H    LYS  18           H        LYS  18   2.506  -5.066   6.570
  122    HA   LYS  18           HA       LYS  18   3.452  -7.207   8.106
  123   1HB   LYS  18          2HB       LYS  18   1.759  -4.961   8.477
  124   2HB   LYS  18          1HB       LYS  18   0.880  -6.368   9.060
  125   1HG   LYS  18          2HG       LYS  18   2.974  -6.937  10.382
  126   2HG   LYS  18          1HG       LYS  18   3.526  -5.306   9.993
  127   1HD   LYS  18          2HD       LYS  18   1.012  -4.806  10.880
  128   2HD   LYS  18          1HD       LYS  18   1.441  -6.206  11.863
  129   1HE   LYS  18          2HE       LYS  18   3.293  -3.862  11.576
  130   2HE   LYS  18          1HE       LYS  18   2.000  -3.869  12.765
  131   1HZ   LYS  18          1HZ       LYS  18   3.997  -4.648  13.789
  132   2HZ   LYS  18          2HZ       LYS  18   4.240  -5.802  12.577
  133   3HZ   LYS  18          3HZ       LYS  18   2.940  -5.961  13.645
  134    H    GLU  19           H        GLU  19   0.689  -6.897   5.996
  135    HA   GLU  19           HA       GLU  19  -0.535  -9.360   6.836
  136   1HB   GLU  19          2HB       GLU  19  -1.145  -7.190   4.983
  137   2HB   GLU  19          1HB       GLU  19  -1.536  -8.768   4.311
  138   1HG   GLU  19          2HG       GLU  19  -3.500  -8.233   5.347
  139   2HG   GLU  19          1HG       GLU  19  -2.689  -9.145   6.620
  140    H    LEU  20           H        LEU  20   1.544  -8.289   4.194
  141    HA   LEU  20           HA       LEU  20   1.504 -10.626   2.672
  142   1HB   LEU  20          2HB       LEU  20   3.007  -8.201   2.739
  143   2HB   LEU  20          1HB       LEU  20   4.117  -9.547   2.551
  144    HG   LEU  20           HG       LEU  20   2.006 -10.053   0.778
  145   1HD1  LEU  20          1HD1      LEU  20   1.371  -8.163  -0.234
  146   2HD1  LEU  20          2HD1      LEU  20   2.970  -7.429  -0.085
  147   3HD1  LEU  20          3HD1      LEU  20   1.857  -7.402   1.282
  148   1HD2  LEU  20          1HD2      LEU  20   4.697 -10.195   0.761
  149   2HD2  LEU  20          2HD2      LEU  20   4.437  -8.821  -0.314
  150   3HD2  LEU  20          3HD2      LEU  20   3.688 -10.376  -0.673
  151    H    LYS  21           H        LYS  21   3.261  -9.770   5.568
  152    HA   LYS  21           HA       LYS  21   4.923 -12.136   5.489
  153   1HB   LYS  21          2HB       LYS  21   5.726 -11.356   7.697
  154   2HB   LYS  21          1HB       LYS  21   5.856 -10.117   6.457
  155   1HG   LYS  21          2HG       LYS  21   3.981  -8.942   7.314
  156   2HG   LYS  21          1HG       LYS  21   3.567 -10.271   8.398
  157   1HD   LYS  21          2HD       LYS  21   6.291  -9.285   8.762
  158   2HD   LYS  21          1HD       LYS  21   5.058  -8.059   9.063
  159   1HE   LYS  21          2HE       LYS  21   5.406  -9.111  11.137
  160   2HE   LYS  21          1HE       LYS  21   3.904  -9.793  10.515
  161   1HZ   LYS  21          1HZ       LYS  21   5.140 -11.729   9.761
  162   2HZ   LYS  21          2HZ       LYS  21   5.336 -11.507  11.426
  163   3HZ   LYS  21          3HZ       LYS  21   6.580 -11.075  10.365
  164    H    GLN  22           H        GLN  22   2.060 -10.973   7.195
  165    HA   GLN  22           HA       GLN  22   1.857 -13.206   8.954
  166   1HB   GLN  22          2HB       GLN  22   0.381 -10.784   8.416
  167   2HB   GLN  22          1HB       GLN  22  -0.723 -12.145   8.563
  168   1HG   GLN  22          2HG       GLN  22  -0.218 -12.501  10.759
  169   2HG   GLN  22          1HG       GLN  22   1.404 -11.826  10.610
  170   1HE2  GLN  22          1HE2      GLN  22  -1.731 -11.283  11.645
  171   2HE2  GLN  22          2HE2      GLN  22  -1.628  -9.580  11.918
  172    H    TYR  23           H        TYR  23   0.877 -12.569   5.686
  173    HA   TYR  23           HA       TYR  23  -0.914 -14.837   5.535
  174   1HB   TYR  23          2HB       TYR  23   0.079 -12.798   3.552
  175   2HB   TYR  23          1HB       TYR  23  -0.829 -14.218   3.029
  176    HD1  TYR  23           1HD      TYR  23  -2.978 -14.567   4.793
  177    HD2  TYR  23           2HD      TYR  23  -1.195 -10.907   3.570
  178    HE1  TYR  23           1HE      TYR  23  -5.080 -13.390   5.270
  179    HE2  TYR  23           2HE      TYR  23  -3.287  -9.719   4.042
  180    HH   TYR  23           HH       TYR  23  -6.009 -10.748   4.147
  181    H    GLY  24           H        GLY  24   2.357 -13.986   4.550
  182   1HA   GLY  24          2HA       GLY  24   4.045 -15.716   4.524
  183   2HA   GLY  24          1HA       GLY  24   2.819 -16.832   3.944
  184    H    ILE  25           H        ILE  25   2.183 -14.108   2.263
  185    HA   ILE  25           HA       ILE  25   3.000 -15.084  -0.199
  186    HB   ILE  25           HB       ILE  25   3.103 -12.157  -0.132
  187   1HG1  ILE  25          2HG1      ILE  25   0.652 -13.576   0.924
  188   2HG1  ILE  25          1HG1      ILE  25   1.583 -12.312   1.724
  189   1HG2  ILE  25          1HG2      ILE  25   2.028 -12.356  -2.097
  190   2HG2  ILE  25          2HG2      ILE  25   0.952 -13.624  -1.515
  191   3HG2  ILE  25          3HG2      ILE  25   2.608 -14.016  -1.991
  192   1HD1  ILE  25          1HD1      ILE  25   0.916 -10.947  -0.434
  193   2HD1  ILE  25          2HD1      ILE  25  -0.169 -11.082   0.951
  194   3HD1  ILE  25          3HD1      ILE  25  -0.408 -12.109  -0.462
  195    H    GLY  26           H        GLY  26   4.583 -13.843  -1.730
  196   1HA   GLY  26          2HA       GLY  26   7.195 -14.100  -0.534
  197   2HA   GLY  26          1HA       GLY  26   6.844 -13.752  -2.225
  198    H    ASP  27           H        ASP  27   8.883 -12.493  -0.758
  199    HA   ASP  27           HA       ASP  27   8.075  -9.963   0.243
  200   1HB   ASP  27          2HB       ASP  27  10.659 -11.252  -0.481
  201   2HB   ASP  27          1HB       ASP  27  10.633  -9.495  -0.388
  202    H    TYR  28           H        TYR  28   8.583 -11.181  -2.950
  203    HA   TYR  28           HA       TYR  28   9.311  -9.001  -4.449
  204   1HB   TYR  28          2HB       TYR  28   8.375 -11.441  -5.104
  205   2HB   TYR  28          1HB       TYR  28   6.930 -10.488  -5.434
  206    HD1  TYR  28           1HD      TYR  28   6.692  -9.980  -7.658
  207    HD2  TYR  28           2HD      TYR  28  10.591  -9.979  -5.968
  208    HE1  TYR  28           1HE      TYR  28   7.615  -9.252  -9.811
  209    HE2  TYR  28           2HE      TYR  28  11.529  -9.254  -8.112
  210    HH   TYR  28           HH       TYR  28   9.567  -8.161 -10.707
  211    H    TYR  29           H        TYR  29   6.097  -9.837  -3.315
  212    HA   TYR  29           HA       TYR  29   4.874  -7.483  -4.339
  213   1HB   TYR  29          2HB       TYR  29   3.718  -9.404  -2.321
  214   2HB   TYR  29          1HB       TYR  29   2.842  -8.357  -3.432
  215    HD1  TYR  29           1HD      TYR  29   4.776  -8.834  -5.804
  216    HD2  TYR  29           2HD      TYR  29   2.745 -11.468  -3.144
  217    HE1  TYR  29           1HE      TYR  29   4.870 -10.623  -7.493
  218    HE2  TYR  29           2HE      TYR  29   2.819 -13.251  -4.834
  219    HH   TYR  29           HH       TYR  29   3.021 -13.432  -7.313
  220    H    ILE  30           H        ILE  30   6.471  -8.173  -1.331
  221    HA   ILE  30           HA       ILE  30   5.175  -6.032   0.096
  222    HB   ILE  30           HB       ILE  30   6.500  -6.497   1.890
  223   1HG1  ILE  30          2HG1      ILE  30   8.821  -7.682   1.541
  224   2HG1  ILE  30          1HG1      ILE  30   8.677  -7.013  -0.081
  225   1HG2  ILE  30          1HG2      ILE  30   5.473  -8.531   1.702
  226   2HG2  ILE  30          2HG2      ILE  30   7.169  -8.991   1.828
  227   3HG2  ILE  30          3HG2      ILE  30   6.375  -8.979   0.257
  228   1HD1  ILE  30          1HD1      ILE  30   9.636  -5.204   0.793
  229   2HD1  ILE  30          2HD1      ILE  30   9.261  -5.691   2.448
  230   3HD1  ILE  30          3HD1      ILE  30   8.040  -4.872   1.467
  231    H    LYS  31           H        LYS  31   7.922  -6.498  -1.959
  232    HA   LYS  31           HA       LYS  31   9.028  -3.867  -1.573
  233   1HB   LYS  31          2HB       LYS  31   9.675  -6.256  -3.231
  234   2HB   LYS  31          1HB       LYS  31  10.325  -4.700  -3.724
  235   1HG   LYS  31          2HG       LYS  31  11.968  -4.919  -2.262
  236   2HG   LYS  31          1HG       LYS  31  10.794  -4.972  -0.947
  237   1HD   LYS  31          2HD       LYS  31  10.583  -7.493  -1.892
  238   2HD   LYS  31          1HD       LYS  31  12.275  -7.156  -2.262
  239   1HE   LYS  31          2HE       LYS  31  11.970  -6.188   0.305
  240   2HE   LYS  31          1HE       LYS  31  10.983  -7.648   0.300
  241   1HZ   LYS  31          1HZ       LYS  31  12.781  -8.975  -0.008
  242   2HZ   LYS  31          2HZ       LYS  31  13.549  -7.711   0.812
  243   3HZ   LYS  31          3HZ       LYS  31  13.655  -7.813  -0.873
  244    H    LEU  32           H        LEU  32   7.344  -5.593  -4.197
  245    HA   LEU  32           HA       LEU  32   7.301  -3.564  -6.061
  246   1HB   LEU  32          2HB       LEU  32   6.062  -5.003  -7.268
  247   2HB   LEU  32          1HB       LEU  32   6.313  -6.098  -5.931
  248    HG   LEU  32           HG       LEU  32   4.028  -6.215  -6.403
  249   1HD1  LEU  32          1HD1      LEU  32   3.500  -6.076  -4.263
  250   2HD1  LEU  32          2HD1      LEU  32   3.505  -4.312  -4.332
  251   3HD1  LEU  32          3HD1      LEU  32   5.008  -5.187  -4.011
  252   1HD2  LEU  32          1HD2      LEU  32   2.743  -4.555  -7.221
  253   2HD2  LEU  32          2HD2      LEU  32   4.286  -3.768  -7.555
  254   3HD2  LEU  32          3HD2      LEU  32   3.387  -3.365  -6.092
  255    H    ILE  33           H        ILE  33   5.758  -3.692  -3.049
  256    HA   ILE  33           HA       ILE  33   3.613  -1.862  -3.597
  257    HB   ILE  33           HB       ILE  33   4.734  -3.227  -1.189
  258   1HG1  ILE  33          2HG1      ILE  33   2.037  -2.979  -2.504
  259   2HG1  ILE  33          1HG1      ILE  33   3.049  -4.408  -2.354
  260   1HG2  ILE  33          1HG2      ILE  33   2.576  -1.558  -0.340
  261   2HG2  ILE  33          2HG2      ILE  33   3.858  -0.554  -1.007
  262   3HG2  ILE  33          3HG2      ILE  33   4.211  -1.677   0.302
  263   1HD1  ILE  33          1HD1      ILE  33   0.932  -3.624  -0.711
  264   2HD1  ILE  33          2HD1      ILE  33   2.397  -3.407   0.249
  265   3HD1  ILE  33          3HD1      ILE  33   2.042  -4.974  -0.474
  266    H    ASN  34           H        ASN  34   6.615  -1.681  -1.698
  267    HA   ASN  34           HA       ASN  34   6.542   0.987  -1.016
  268   1HB   ASN  34          2HB       ASN  34   8.245  -1.016  -0.518
  269   2HB   ASN  34          1HB       ASN  34   9.199  -0.136  -1.709
  270   1HD2  ASN  34          1HD2      ASN  34   9.369  -0.564   1.282
  271   2HD2  ASN  34          2HD2      ASN  34   9.598   1.025   1.919
  272    H    ASN  35           H        ASN  35   7.212  -0.366  -4.142
  273    HA   ASN  35           HA       ASN  35   8.675   1.866  -5.147
  274   1HB   ASN  35          2HB       ASN  35   8.477   0.833  -7.316
  275   2HB   ASN  35          1HB       ASN  35   8.823  -0.411  -6.120
  276   1HD2  ASN  35          1HD2      ASN  35   8.006  -2.002  -7.482
  277   2HD2  ASN  35          2HD2      ASN  35   6.308  -2.208  -7.732
  278    H    ALA  36           H        ALA  36   5.312   1.281  -4.683
  279    HA   ALA  36           HA       ALA  36   4.129   2.757  -6.692
  280   1HB   ALA  36          1HB       ALA  36   2.328   2.148  -5.566
  281   2HB   ALA  36          2HB       ALA  36   2.711   3.320  -4.305
  282   3HB   ALA  36          3HB       ALA  36   3.334   1.674  -4.197
  283    H    LYS  37           H        LYS  37   3.284   4.919  -6.753
  284    HA   LYS  37           HA       LYS  37   5.053   6.842  -5.405
  285   1HB   LYS  37          2HB       LYS  37   4.591   8.376  -7.214
  286   2HB   LYS  37          1HB       LYS  37   5.109   6.832  -7.881
  287   1HG   LYS  37          2HG       LYS  37   2.194   7.391  -7.573
  288   2HG   LYS  37          1HG       LYS  37   3.084   8.109  -8.911
  289   1HD   LYS  37          2HD       LYS  37   3.100   6.195 -10.036
  290   2HD   LYS  37          1HD       LYS  37   3.737   5.317  -8.644
  291   1HE   LYS  37          2HE       LYS  37   1.673   4.646  -7.950
  292   2HE   LYS  37          1HE       LYS  37   0.873   6.085  -8.581
  293   1HZ   LYS  37          1HZ       LYS  37   0.321   4.019  -9.792
  294   2HZ   LYS  37          2HZ       LYS  37   1.936   3.892 -10.276
  295   3HZ   LYS  37          3HZ       LYS  37   1.002   5.207 -10.785
  296    H    THR  38           H        THR  38   2.049   5.593  -5.062
  297    HA   THR  38           HA       THR  38   1.065   8.027  -3.753
  298    HB   THR  38           HB       THR  38  -1.170   7.662  -4.562
  299    HG1  THR  38           1HG      THR  38  -0.181   5.347  -5.866
  300   1HG2  THR  38          1HG2      THR  38  -0.804   8.611  -6.518
  301   2HG2  THR  38          2HG2      THR  38  -0.126   7.125  -7.176
  302   3HG2  THR  38          3HG2      THR  38   0.910   8.264  -6.317
  303    H    VAL  39           H        VAL  39  -1.445   6.327  -3.132
  304    HA   VAL  39           HA       VAL  39  -0.238   4.373  -1.344
  305    HB   VAL  39           HB       VAL  39  -0.720   6.714  -0.237
  306   1HG1  VAL  39          1HG1      VAL  39  -3.112   6.712  -0.830
  307   2HG1  VAL  39          2HG1      VAL  39  -2.830   6.771   0.912
  308   3HG1  VAL  39          3HG1      VAL  39  -3.321   5.260   0.148
  309   1HG2  VAL  39          1HG2      VAL  39  -1.299   5.231   1.859
  310   2HG2  VAL  39          2HG2      VAL  39   0.284   5.146   1.079
  311   3HG2  VAL  39          3HG2      VAL  39  -0.936   3.926   0.732
  312    H    GLU  40           H        GLU  40  -3.272   5.728  -2.589
  313    HA   GLU  40           HA       GLU  40  -5.041   3.783  -1.793
  314   1HB   GLU  40          2HB       GLU  40  -5.630   5.857  -3.047
  315   2HB   GLU  40          1HB       GLU  40  -5.020   5.097  -4.510
  316   1HG   GLU  40          2HG       GLU  40  -6.899   3.945  -4.815
  317   2HG   GLU  40          1HG       GLU  40  -6.967   3.446  -3.128
  318    H    GLY  41           H        GLY  41  -2.686   3.640  -4.386
  319   1HA   GLY  41          2HA       GLY  41  -3.667   1.072  -5.323
  320   2HA   GLY  41          1HA       GLY  41  -2.272   1.947  -5.941
  321    H    VAL  42           H        VAL  42  -1.129   2.321  -3.274
  322    HA   VAL  42           HA       VAL  42   0.569   0.118  -3.159
  323    HB   VAL  42           HB       VAL  42  -0.080   1.988  -0.883
  324   1HG1  VAL  42          1HG1      VAL  42   2.107   0.030  -1.438
  325   2HG1  VAL  42          2HG1      VAL  42   1.128   0.221   0.022
  326   3HG1  VAL  42          3HG1      VAL  42   2.376   1.412  -0.371
  327   1HG2  VAL  42          1HG2      VAL  42   1.389   3.528  -1.720
  328   2HG2  VAL  42          2HG2      VAL  42   0.741   2.890  -3.230
  329   3HG2  VAL  42          3HG2      VAL  42   2.299   2.328  -2.629
  330    H    GLU  43           H        GLU  43  -2.194   0.911  -1.068
  331    HA   GLU  43           HA       GLU  43  -1.994  -1.468   0.481
  332   1HB   GLU  43          2HB       GLU  43  -4.512  -0.792   0.965
  333   2HB   GLU  43          1HB       GLU  43  -3.168   0.114   1.650
  334   1HG   GLU  43          2HG       GLU  43  -3.403   1.848   0.078
  335   2HG   GLU  43          1HG       GLU  43  -4.484   0.888  -0.934
  336    H    SER  44           H        SER  44  -4.217  -0.491  -2.116
  337    HA   SER  44           HA       SER  44  -5.603  -2.936  -2.251
  338   1HB   SER  44          2HB       SER  44  -6.750  -1.988  -3.998
  339   2HB   SER  44          1HB       SER  44  -6.037  -0.524  -3.319
  340    HG   SER  44           HG       SER  44  -4.323  -0.793  -4.858
  341    H    LEU  45           H        LEU  45  -2.523  -1.935  -3.402
  342    HA   LEU  45           HA       LEU  45  -2.119  -3.644  -5.570
  343   1HB   LEU  45          2HB       LEU  45  -0.452  -2.114  -3.709
  344   2HB   LEU  45          1HB       LEU  45   0.345  -3.529  -4.357
  345   1HD1  LEU  45          1HD1      LEU  45   1.951  -2.082  -6.473
  346   2HD1  LEU  45          2HD1      LEU  45   0.796  -2.797  -7.598
  347   3HD1  LEU  45          3HD1      LEU  45   1.248  -3.663  -6.130
  348   1HD2  LEU  45          1HD2      LEU  45  -2.181  -1.733  -6.132
  349   2HD2  LEU  45          2HD2      LEU  45  -1.365  -2.632  -7.409
  350   3HD2  LEU  45          3HD2      LEU  45  -1.147  -0.887  -7.283
  351    H    LYS  46           H        LYS  46  -1.078  -4.189  -2.191
  352    HA   LYS  46           HA       LYS  46  -0.421  -6.910  -2.671
  353   1HB   LYS  46          2HB       LYS  46   0.729  -6.355  -0.827
  354   2HB   LYS  46          1HB       LYS  46  -0.381  -5.065  -0.393
  355   1HG   LYS  46          2HG       LYS  46  -1.123  -7.931   0.081
  356   2HG   LYS  46          1HG       LYS  46  -0.048  -7.080   1.198
  357   1HD   LYS  46          2HD       LYS  46  -1.816  -5.274   1.328
  358   2HD   LYS  46          1HD       LYS  46  -2.890  -6.387   0.485
  359   1HE   LYS  46          2HE       LYS  46  -3.079  -7.785   2.266
  360   2HE   LYS  46          1HE       LYS  46  -1.469  -7.400   2.878
  361   1HZ   LYS  46          1HZ       LYS  46  -3.989  -5.912   3.231
  362   2HZ   LYS  46          2HZ       LYS  46  -2.506  -5.109   3.360
  363   3HZ   LYS  46          3HZ       LYS  46  -2.865  -6.393   4.399
  364    H    ASN  47           H        ASN  47  -3.237  -5.329  -1.183
  365    HA   ASN  47           HA       ASN  47  -4.593  -7.670  -0.452
  366   1HB   ASN  47          2HB       ASN  47  -5.125  -5.099  -0.031
  367   2HB   ASN  47          1HB       ASN  47  -6.163  -5.320  -1.437
  368   1HD2  ASN  47          1HD2      ASN  47  -7.281  -4.641   0.920
  369   2HD2  ASN  47          2HD2      ASN  47  -8.164  -5.972   1.577
  370    H    GLU  48           H        GLU  48  -4.183  -6.112  -3.527
  371    HA   GLU  48           HA       GLU  48  -6.272  -7.589  -4.847
  372   1HB   GLU  48          2HB       GLU  48  -5.600  -5.390  -5.689
  373   2HB   GLU  48          1HB       GLU  48  -3.967  -5.980  -5.970
  374   1HG   GLU  48          2HG       GLU  48  -5.991  -7.593  -7.289
  375   2HG   GLU  48          1HG       GLU  48  -6.010  -5.907  -7.803
  376    H    ILE  49           H        ILE  49  -2.816  -7.860  -4.360
  377    HA   ILE  49           HA       ILE  49  -2.363  -9.993  -6.177
  378    HB   ILE  49           HB       ILE  49  -0.234 -10.273  -5.166
  379   1HG1  ILE  49          2HG1      ILE  49  -0.704  -8.504  -2.839
  380   2HG1  ILE  49          1HG1      ILE  49  -1.399 -10.109  -2.741
  381   1HG2  ILE  49          1HG2      ILE  49  -1.157  -7.769  -5.955
  382   2HG2  ILE  49          2HG2      ILE  49   0.513  -8.329  -5.909
  383   3HG2  ILE  49          3HG2      ILE  49  -0.169  -7.476  -4.526
  384   1HD1  ILE  49          1HD1      ILE  49   1.446  -9.768  -3.502
  385   2HD1  ILE  49          2HD1      ILE  49   0.650 -11.119  -2.697
  386   3HD1  ILE  49          3HD1      ILE  49   0.959  -9.620  -1.814
  387    H    LEU  50           H        LEU  50  -3.586  -9.752  -2.967
  388    HA   LEU  50           HA       LEU  50  -3.359 -12.543  -2.336
  389   1HB   LEU  50          2HB       LEU  50  -4.765 -10.215  -1.032
  390   2HB   LEU  50          1HB       LEU  50  -4.814 -11.844  -0.377
  391    HG   LEU  50           HG       LEU  50  -2.116 -10.790  -0.935
  392   1HD1  LEU  50          1HD1      LEU  50  -2.130  -9.510   1.216
  393   2HD1  LEU  50          2HD1      LEU  50  -3.892  -9.594   1.177
  394   3HD1  LEU  50          3HD1      LEU  50  -3.018  -8.761  -0.110
  395   1HD2  LEU  50          1HD2      LEU  50  -1.951 -11.715   1.511
  396   2HD2  LEU  50          2HD2      LEU  50  -2.041 -12.816   0.134
  397   3HD2  LEU  50          3HD2      LEU  50  -3.483 -12.485   1.098
  398    H    LYS  51           H        LYS  51  -5.764 -10.383  -3.676
  399    HA   LYS  51           HA       LYS  51  -7.993 -12.111  -3.431
  400   1HB   LYS  51          2HB       LYS  51  -7.925  -9.595  -4.038
  401   2HB   LYS  51          1HB       LYS  51  -7.633 -10.145  -5.682
  402   1HG   LYS  51          2HG       LYS  51  -9.731 -11.279  -5.754
  403   2HG   LYS  51          1HG       LYS  51 -10.000 -10.996  -4.033
  404   1HD   LYS  51          2HD       LYS  51  -9.727  -8.797  -6.077
  405   2HD   LYS  51          1HD       LYS  51 -11.269  -9.472  -5.554
  406   1HE   LYS  51          2HE       LYS  51  -9.565  -8.710  -3.325
  407   2HE   LYS  51          1HE       LYS  51  -9.936  -7.356  -4.391
  408   1HZ   LYS  51          1HZ       LYS  51 -11.609  -7.483  -2.720
  409   2HZ   LYS  51          2HZ       LYS  51 -11.878  -9.127  -3.015
  410   3HZ   LYS  51          3HZ       LYS  51 -12.311  -7.978  -4.177
  411    H    ALA  52           H        ALA  52  -5.216 -12.156  -5.418
  412    HA   ALA  52           HA       ALA  52  -6.141 -14.547  -6.753
  413   1HB   ALA  52          1HB       ALA  52  -6.919 -12.777  -8.258
  414   2HB   ALA  52          2HB       ALA  52  -5.645 -13.744  -9.003
  415   3HB   ALA  52          3HB       ALA  52  -5.275 -12.144  -8.358
  416    H    LEU  53           H        LEU  53  -4.430 -15.294  -5.293
  417    HA   LEU  53           HA       LEU  53  -1.715 -14.498  -5.849
  418   1HB   LEU  53          2HB       LEU  53  -2.888 -16.648  -4.090
  419   2HB   LEU  53          1HB       LEU  53  -1.166 -16.355  -4.238
  420    HG   LEU  53           HG       LEU  53  -3.120 -14.256  -3.307
  421   1HD1  LEU  53          1HD1      LEU  53  -3.329 -15.673  -1.544
  422   2HD1  LEU  53          2HD1      LEU  53  -1.828 -14.875  -1.072
  423   3HD1  LEU  53          3HD1      LEU  53  -1.780 -16.459  -1.846
  424   1HD2  LEU  53          1HD2      LEU  53  -1.161 -13.097  -2.535
  425   2HD2  LEU  53          2HD2      LEU  53  -0.951 -13.492  -4.241
  426   3HD2  LEU  53          3HD2      LEU  53  -0.126 -14.445  -3.008
  427    HA   PRO  54           HA       PRO  54  -0.961 -17.513  -9.004
  428   1HB   PRO  54          2HB       PRO  54   1.729 -17.546  -8.987
  429   2HB   PRO  54          1HB       PRO  54   0.815 -16.149  -9.568
  430   1HG   PRO  54          2HG       PRO  54   2.138 -16.578  -6.918
  431   2HG   PRO  54          1HG       PRO  54   2.123 -15.129  -7.938
  432   1HD   PRO  54          2HD       PRO  54   0.494 -15.465  -5.771
  433   2HD   PRO  54          1HD       PRO  54   0.067 -14.460  -7.169
  434    H    THR  55           H        THR  55  -1.400 -19.607  -8.683
  435    HA   THR  55           HA       THR  55   0.022 -21.054  -6.560
  436    HB   THR  55           HB       THR  55  -1.761 -22.795  -6.924
  437    HG1  THR  55           1HG      THR  55  -2.963 -22.565  -8.606
  438   1HG2  THR  55          1HG2      THR  55  -3.629 -20.841  -6.308
  439   2HG2  THR  55          2HG2      THR  55  -2.094 -20.200  -5.722
  440   3HG2  THR  55          3HG2      THR  55  -2.657 -21.780  -5.176
  441    H    GLU  56           H        GLU  56   0.222 -23.516  -7.169
  442    HA   GLU  56           HA       GLU  56   2.193 -23.715  -9.149
  443   1HB   GLU  56          2HB       GLU  56   1.270 -25.331  -7.122
  444   2HB   GLU  56          1HB       GLU  56   0.794 -26.224  -8.560
  445   1HG   GLU  56          2HG       GLU  56   2.917 -27.029  -7.955
  446   2HG   GLU  56          1HG       GLU  56   3.169 -25.987  -9.355
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1  -5.258  18.439   1.893
    2   2H    MET   1          2HT       MET   1  -4.216  18.847   3.199
    3   3H    MET   1          3HT       MET   1  -3.787  17.586   2.129
    4    HA   MET   1           HA       MET   1  -3.859  19.310   0.335
    5   1HB   MET   1          2HB       MET   1  -4.639  20.820   2.621
    6   2HB   MET   1          1HB       MET   1  -3.084  21.438   2.083
    7   1HG   MET   1          2HG       MET   1  -4.464  22.725   0.824
    8   2HG   MET   1          1HG       MET   1  -4.274  21.359  -0.273
    9   1HE   MET   1          1HE       MET   1  -6.742  23.007  -1.082
   10   2HE   MET   1          2HE       MET   1  -6.534  23.795   0.473
   11   3HE   MET   1          3HE       MET   1  -8.078  23.058   0.061
   12    H    GLU   2           H        GLU   2  -2.071  20.051   3.324
   13    HA   GLU   2           HA       GLU   2   0.279  18.668   2.396
   14   1HB   GLU   2          2HB       GLU   2   0.085  21.107   1.353
   15   2HB   GLU   2          1HB       GLU   2   0.760  21.558   2.915
   16   1HG   GLU   2          2HG       GLU   2   2.312  19.414   2.039
   17   2HG   GLU   2          1HG       GLU   2   2.056  20.421   0.612
   18    H    ALA   3           H        ALA   3   1.283  17.853   4.112
   19    HA   ALA   3           HA       ALA   3   1.857  19.263   6.473
   20   1HB   ALA   3          1HB       ALA   3  -0.694  17.785   6.425
   21   2HB   ALA   3          2HB       ALA   3  -0.207  19.186   7.381
   22   3HB   ALA   3          3HB       ALA   3   0.316  17.569   7.854
   23    H    VAL   4           H        VAL   4   0.731  15.905   6.235
   24    HA   VAL   4           HA       VAL   4   3.450  14.911   6.085
   25    HB   VAL   4           HB       VAL   4   1.749  14.085   8.434
   26   1HG1  VAL   4          1HG1      VAL   4   3.389  12.647   8.986
   27   2HG1  VAL   4          2HG1      VAL   4   4.669  13.742   8.451
   28   3HG1  VAL   4          3HG1      VAL   4   3.793  12.760   7.273
   29   1HG2  VAL   4          1HG2      VAL   4   2.319  16.395   8.777
   30   2HG2  VAL   4          2HG2      VAL   4   3.993  16.096   8.329
   31   3HG2  VAL   4          3HG2      VAL   4   3.348  15.409   9.816
   32    H    ASP   5           H        ASP   5   1.362  14.697   4.267
   33    HA   ASP   5           HA       ASP   5  -0.256  12.436   4.472
   34   1HB   ASP   5          2HB       ASP   5  -0.074  14.360   2.649
   35   2HB   ASP   5          1HB       ASP   5   0.907  13.156   1.817
   36    H    ALA   6           H        ALA   6   3.129  12.736   3.683
   37    HA   ALA   6           HA       ALA   6   3.577  10.274   2.447
   38   1HB   ALA   6          1HB       ALA   6   5.352  11.777   2.345
   39   2HB   ALA   6          2HB       ALA   6   5.924  10.541   3.467
   40   3HB   ALA   6          3HB       ALA   6   5.322  12.083   4.081
   41    H    ASN   7           H        ASN   7   3.157  11.096   5.823
   42    HA   ASN   7           HA       ASN   7   4.148   8.671   6.908
   43   1HB   ASN   7          2HB       ASN   7   3.779  10.839   8.166
   44   2HB   ASN   7          1HB       ASN   7   2.055  10.461   8.149
   45   1HD2  ASN   7          1HD2      ASN   7   1.529   9.884  10.124
   46   2HD2  ASN   7          2HD2      ASN   7   2.362   8.729  11.105
   47    H    SER   8           H        SER   8   0.872   9.797   6.121
   48    HA   SER   8           HA       SER   8  -0.452   7.445   6.939
   49   1HB   SER   8          2HB       SER   8  -1.164   9.941   5.732
   50   2HB   SER   8          1HB       SER   8  -1.919   8.641   4.815
   51    HG   SER   8           HG       SER   8  -2.762   7.858   6.798
   52    H    LEU   9           H        LEU   9   1.138   8.384   3.978
   53    HA   LEU   9           HA       LEU   9   0.113   6.313   2.330
   54   1HB   LEU   9          2HB       LEU   9   1.199   8.427   1.542
   55   2HB   LEU   9          1HB       LEU   9   2.739   7.772   2.063
   56    HG   LEU   9           HG       LEU   9   0.989   6.524  -0.051
   57   1HD1  LEU   9          1HD1      LEU   9   3.216   7.367  -1.328
   58   2HD1  LEU   9          2HD1      LEU   9   2.977   8.665  -0.157
   59   3HD1  LEU   9          3HD1      LEU   9   1.689   8.247  -1.288
   60   1HD2  LEU   9          1HD2      LEU   9   3.525   5.760   1.251
   61   2HD2  LEU   9          2HD2      LEU   9   3.445   5.562  -0.499
   62   3HD2  LEU   9          3HD2      LEU   9   2.266   4.755   0.534
   63    H    ALA  10           H        ALA  10   3.080   6.693   4.226
   64    HA   ALA  10           HA       ALA  10   4.294   4.271   3.493
   65   1HB   ALA  10          1HB       ALA  10   5.753   4.620   5.403
   66   2HB   ALA  10          2HB       ALA  10   4.651   5.840   6.040
   67   3HB   ALA  10          3HB       ALA  10   5.501   6.121   4.523
   68    H    GLN  11           H        GLN  11   1.642   4.865   5.583
   69    HA   GLN  11           HA       GLN  11   2.002   2.514   7.197
   70   1HB   GLN  11          2HB       GLN  11   0.893   4.333   8.251
   71   2HB   GLN  11          1HB       GLN  11  -0.236   4.507   6.912
   72   1HG   GLN  11          2HG       GLN  11  -1.145   2.291   7.455
   73   2HG   GLN  11          1HG       GLN  11  -0.100   2.232   8.869
   74   1HE2  GLN  11          1HE2      GLN  11  -1.199   2.625  10.642
   75   2HE2  GLN  11          2HE2      GLN  11  -2.462   3.787  10.827
   76    H    ALA  12           H        ALA  12  -0.031   3.477   4.459
   77    HA   ALA  12           HA       ALA  12  -1.665   1.245   4.294
   78   1HB   ALA  12          1HB       ALA  12  -0.585   2.276   1.745
   79   2HB   ALA  12          2HB       ALA  12  -1.373   3.449   2.807
   80   3HB   ALA  12          3HB       ALA  12  -2.259   2.028   2.251
   81    H    LYS  13           H        LYS  13   1.642   1.718   3.284
   82    HA   LYS  13           HA       LYS  13   1.852  -0.947   2.145
   83   1HB   LYS  13          2HB       LYS  13   4.388  -0.081   2.106
   84   2HB   LYS  13          1HB       LYS  13   3.214   0.347   0.875
   85   1HG   LYS  13          2HG       LYS  13   2.914   2.481   1.698
   86   2HG   LYS  13          1HG       LYS  13   3.586   2.066   3.281
   87   1HD   LYS  13          2HD       LYS  13   5.124   2.234   0.684
   88   2HD   LYS  13          1HD       LYS  13   5.144   3.440   1.970
   89   1HE   LYS  13          2HE       LYS  13   6.225   0.636   2.018
   90   2HE   LYS  13          1HE       LYS  13   7.099   2.148   2.254
   91   1HZ   LYS  13          1HZ       LYS  13   5.318   2.279   4.230
   92   2HZ   LYS  13          2HZ       LYS  13   6.860   1.610   4.407
   93   3HZ   LYS  13          3HZ       LYS  13   5.529   0.602   4.139
   94    H    GLU  14           H        GLU  14   3.404   0.900   4.783
   95    HA   GLU  14           HA       GLU  14   4.902  -1.124   5.920
   96   1HB   GLU  14          2HB       GLU  14   3.566   1.328   6.999
   97   2HB   GLU  14          1HB       GLU  14   4.199   0.156   8.147
   98   1HG   GLU  14          2HG       GLU  14   6.265   0.478   6.347
   99   2HG   GLU  14          1HG       GLU  14   5.596   2.099   6.516
  100    H    ALA  15           H        ALA  15   1.504  -0.375   6.161
  101    HA   ALA  15           HA       ALA  15   0.939  -2.453   8.092
  102   1HB   ALA  15          1HB       ALA  15  -0.352  -0.255   7.759
  103   2HB   ALA  15          2HB       ALA  15  -1.282  -1.728   8.032
  104   3HB   ALA  15          3HB       ALA  15  -1.124  -1.076   6.402
  105    H    ALA  16           H        ALA  16   0.308  -1.932   4.625
  106    HA   ALA  16           HA       ALA  16  -0.954  -4.373   4.094
  107   1HB   ALA  16          1HB       ALA  16   0.624  -2.484   2.371
  108   2HB   ALA  16          2HB       ALA  16  -1.117  -2.759   2.406
  109   3HB   ALA  16          3HB       ALA  16  -0.044  -3.982   1.724
  110    H    ILE  17           H        ILE  17   2.362  -3.581   4.630
  111    HA   ILE  17           HA       ILE  17   3.496  -5.917   3.443
  112    HB   ILE  17           HB       ILE  17   4.450  -3.555   4.862
  113   1HG1  ILE  17          2HG1      ILE  17   6.411  -5.029   3.313
  114   2HG1  ILE  17          1HG1      ILE  17   4.886  -4.879   2.446
  115   1HG2  ILE  17          1HG2      ILE  17   5.106  -5.095   6.595
  116   2HG2  ILE  17          2HG2      ILE  17   6.533  -4.545   5.718
  117   3HG2  ILE  17          3HG2      ILE  17   5.874  -6.151   5.410
  118   1HD1  ILE  17          1HD1      ILE  17   6.709  -2.720   3.423
  119   2HD1  ILE  17          2HD1      ILE  17   5.021  -2.394   3.033
  120   3HD1  ILE  17          3HD1      ILE  17   6.108  -3.017   1.791
  121    H    LYS  18           H        LYS  18   2.298  -5.007   6.597
  122    HA   LYS  18           HA       LYS  18   3.322  -7.179   8.078
  123   1HB   LYS  18          2HB       LYS  18   1.458  -4.992   8.474
  124   2HB   LYS  18          1HB       LYS  18   0.889  -6.463   9.254
  125   1HG   LYS  18          2HG       LYS  18   2.242  -6.035  10.951
  126   2HG   LYS  18          1HG       LYS  18   3.619  -6.264   9.872
  127   1HD   LYS  18          2HD       LYS  18   3.849  -3.989   9.474
  128   2HD   LYS  18          1HD       LYS  18   2.183  -3.639   9.942
  129   1HE   LYS  18          2HE       LYS  18   2.676  -3.921  12.243
  130   2HE   LYS  18          1HE       LYS  18   4.252  -4.628  11.889
  131   1HZ   LYS  18          1HZ       LYS  18   4.390  -2.308  12.634
  132   2HZ   LYS  18          2HZ       LYS  18   3.487  -1.822  11.289
  133   3HZ   LYS  18          3HZ       LYS  18   5.016  -2.515  11.075
  134    H    GLU  19           H        GLU  19   0.751  -6.926   5.805
  135    HA   GLU  19           HA       GLU  19  -0.584  -9.338   6.705
  136   1HB   GLU  19          2HB       GLU  19  -1.054  -7.326   4.541
  137   2HB   GLU  19          1HB       GLU  19  -1.817  -8.904   4.422
  138   1HG   GLU  19          2HG       GLU  19  -2.180  -7.787   7.050
  139   2HG   GLU  19          1HG       GLU  19  -2.743  -6.674   5.806
  140    H    LEU  20           H        LEU  20   1.475  -8.278   4.044
  141    HA   LEU  20           HA       LEU  20   1.415 -10.668   2.571
  142   1HB   LEU  20          2HB       LEU  20   2.661  -8.189   2.344
  143   2HB   LEU  20          1HB       LEU  20   3.987  -9.330   2.471
  144    HG   LEU  20           HG       LEU  20   2.206 -10.473   0.646
  145   1HD1  LEU  20          1HD1      LEU  20   2.311  -7.512   0.413
  146   2HD1  LEU  20          2HD1      LEU  20   0.988  -8.626   0.070
  147   3HD1  LEU  20          3HD1      LEU  20   2.334  -8.483  -1.060
  148   1HD2  LEU  20          1HD2      LEU  20   4.808 -10.269   0.821
  149   2HD2  LEU  20          2HD2      LEU  20   4.557  -8.912  -0.277
  150   3HD2  LEU  20          3HD2      LEU  20   4.024 -10.528  -0.736
  151    H    LYS  21           H        LYS  21   3.218  -9.670   5.385
  152    HA   LYS  21           HA       LYS  21   4.961 -11.982   5.309
  153   1HB   LYS  21          2HB       LYS  21   5.822 -11.111   7.462
  154   2HB   LYS  21          1HB       LYS  21   5.879  -9.913   6.177
  155   1HG   LYS  21          2HG       LYS  21   4.905  -8.536   7.620
  156   2HG   LYS  21          1HG       LYS  21   3.429  -9.457   7.328
  157   1HD   LYS  21          2HD       LYS  21   3.580 -10.592   9.309
  158   2HD   LYS  21          1HD       LYS  21   5.341 -10.491   9.355
  159   1HE   LYS  21          2HE       LYS  21   3.392  -8.261   9.922
  160   2HE   LYS  21          1HE       LYS  21   4.387  -9.114  11.103
  161   1HZ   LYS  21          1HZ       LYS  21   5.559  -7.176  10.696
  162   2HZ   LYS  21          2HZ       LYS  21   5.223  -7.180   9.039
  163   3HZ   LYS  21          3HZ       LYS  21   6.332  -8.285   9.678
  164    H    GLN  22           H        GLN  22   2.070 -10.886   6.972
  165    HA   GLN  22           HA       GLN  22   2.000 -13.032   8.858
  166   1HB   GLN  22          2HB       GLN  22   0.824 -10.821   9.124
  167   2HB   GLN  22          1HB       GLN  22  -0.321 -11.351   7.899
  168   1HG   GLN  22          2HG       GLN  22  -1.361 -11.775   9.950
  169   2HG   GLN  22          1HG       GLN  22  -0.781 -13.343   9.392
  170   1HE2  GLN  22          1HE2      GLN  22  -0.817 -14.146  11.505
  171   2HE2  GLN  22          2HE2      GLN  22   0.389 -13.711  12.663
  172    H    TYR  23           H        TYR  23   0.923 -12.571   5.585
  173    HA   TYR  23           HA       TYR  23  -0.753 -14.932   5.572
  174   1HB   TYR  23          2HB       TYR  23   0.085 -12.947   3.464
  175   2HB   TYR  23          1HB       TYR  23  -0.785 -14.425   3.049
  176    HD1  TYR  23           1HD      TYR  23  -1.262 -11.109   3.414
  177    HD2  TYR  23           2HD      TYR  23  -2.850 -14.752   4.924
  178    HE1  TYR  23           1HE      TYR  23  -3.381  -9.975   3.896
  179    HE2  TYR  23           2HE      TYR  23  -4.979 -13.628   5.412
  180    HH   TYR  23           HH       TYR  23  -5.374 -10.463   5.667
  181    H    GLY  24           H        GLY  24   2.436 -13.952   4.436
  182   1HA   GLY  24          2HA       GLY  24   4.205 -15.612   4.458
  183   2HA   GLY  24          1HA       GLY  24   3.021 -16.796   3.926
  184    H    ILE  25           H        ILE  25   2.308 -14.076   2.204
  185    HA   ILE  25           HA       ILE  25   3.100 -15.113  -0.249
  186    HB   ILE  25           HB       ILE  25   3.130 -12.171  -0.206
  187   1HG1  ILE  25          2HG1      ILE  25   0.686 -13.690   0.731
  188   2HG1  ILE  25          1HG1      ILE  25   1.546 -12.421   1.599
  189   1HG2  ILE  25          1HG2      ILE  25   1.190 -12.819  -1.890
  190   2HG2  ILE  25          2HG2      ILE  25   1.979 -14.392  -1.793
  191   3HG2  ILE  25          3HG2      ILE  25   2.896 -12.980  -2.315
  192   1HD1  ILE  25          1HD1      ILE  25  -0.351 -12.214  -0.671
  193   2HD1  ILE  25          2HD1      ILE  25   0.925 -11.009  -0.534
  194   3HD1  ILE  25          3HD1      ILE  25  -0.221 -11.236   0.790
  195    H    GLY  26           H        GLY  26   4.625 -13.846  -1.828
  196   1HA   GLY  26          2HA       GLY  26   7.265 -14.076  -0.702
  197   2HA   GLY  26          1HA       GLY  26   6.868 -13.698  -2.376
  198    H    ASP  27           H        ASP  27   8.865 -12.492  -0.598
  199    HA   ASP  27           HA       ASP  27   8.057  -9.976   0.337
  200   1HB   ASP  27          2HB       ASP  27  10.577 -11.361  -0.152
  201   2HB   ASP  27          1HB       ASP  27  10.696  -9.631  -0.462
  202    H    TYR  28           H        TYR  28   8.612 -11.112  -2.877
  203    HA   TYR  28           HA       TYR  28   9.346  -8.886  -4.307
  204   1HB   TYR  28          2HB       TYR  28   8.460 -11.323  -5.037
  205   2HB   TYR  28          1HB       TYR  28   7.008 -10.383  -5.375
  206    HD1  TYR  28           1HD      TYR  28   6.809  -9.855  -7.597
  207    HD2  TYR  28           2HD      TYR  28  10.668  -9.790  -5.817
  208    HE1  TYR  28           1HE      TYR  28   7.764  -9.071  -9.717
  209    HE2  TYR  28           2HE      TYR  28  11.638  -9.008  -7.927
  210    HH   TYR  28           HH       TYR  28   9.963  -9.086 -10.866
  211    H    TYR  29           H        TYR  29   6.120  -9.786  -3.248
  212    HA   TYR  29           HA       TYR  29   4.886  -7.433  -4.255
  213   1HB   TYR  29          2HB       TYR  29   3.715  -9.379  -2.269
  214   2HB   TYR  29          1HB       TYR  29   2.851  -8.325  -3.381
  215    HD1  TYR  29           1HD      TYR  29   2.693 -11.416  -3.141
  216    HD2  TYR  29           2HD      TYR  29   4.869  -8.802  -5.711
  217    HE1  TYR  29           1HE      TYR  29   2.790 -13.186  -4.845
  218    HE2  TYR  29           2HE      TYR  29   4.977 -10.576  -7.414
  219    HH   TYR  29           HH       TYR  29   3.315 -12.779  -7.891
  220    H    ILE  30           H        ILE  30   6.463  -8.129  -1.242
  221    HA   ILE  30           HA       ILE  30   5.115  -6.036   0.206
  222    HB   ILE  30           HB       ILE  30   6.427  -6.513   2.003
  223   1HG1  ILE  30          2HG1      ILE  30   8.799  -7.587   1.663
  224   2HG1  ILE  30          1HG1      ILE  30   8.652  -6.891   0.053
  225   1HG2  ILE  30          1HG2      ILE  30   6.447  -8.954   0.306
  226   2HG2  ILE  30          2HG2      ILE  30   5.489  -8.582   1.733
  227   3HG2  ILE  30          3HG2      ILE  30   7.199  -8.966   1.898
  228   1HD1  ILE  30          1HD1      ILE  30   7.905  -4.808   1.632
  229   2HD1  ILE  30          2HD1      ILE  30   9.527  -5.065   0.981
  230   3HD1  ILE  30          3HD1      ILE  30   9.138  -5.597   2.618
  231    H    LYS  31           H        LYS  31   7.901  -6.404  -1.823
  232    HA   LYS  31           HA       LYS  31   8.927  -3.748  -1.386
  233   1HB   LYS  31          2HB       LYS  31   9.695  -6.144  -2.942
  234   2HB   LYS  31          1HB       LYS  31  10.207  -4.598  -3.605
  235   1HG   LYS  31          2HG       LYS  31  11.997  -4.884  -2.294
  236   2HG   LYS  31          1HG       LYS  31  10.933  -4.308  -1.009
  237   1HD   LYS  31          2HD       LYS  31  10.309  -6.940  -1.031
  238   2HD   LYS  31          1HD       LYS  31  12.002  -7.005  -1.523
  239   1HE   LYS  31          2HE       LYS  31  11.494  -5.189   0.711
  240   2HE   LYS  31          1HE       LYS  31  11.093  -6.870   1.060
  241   1HZ   LYS  31          1HZ       LYS  31  13.459  -7.169  -0.106
  242   2HZ   LYS  31          2HZ       LYS  31  13.271  -6.959   1.562
  243   3HZ   LYS  31          3HZ       LYS  31  13.682  -5.641   0.586
  244    H    LEU  32           H        LEU  32   7.341  -5.487  -4.064
  245    HA   LEU  32           HA       LEU  32   7.269  -3.443  -5.905
  246   1HB   LEU  32          2HB       LEU  32   6.081  -4.903  -7.138
  247   2HB   LEU  32          1HB       LEU  32   6.331  -6.000  -5.802
  248    HG   LEU  32           HG       LEU  32   4.057  -6.153  -6.324
  249   1HD1  LEU  32          1HD1      LEU  32   4.981  -5.146  -3.903
  250   2HD1  LEU  32          2HD1      LEU  32   3.490  -6.059  -4.192
  251   3HD1  LEU  32          3HD1      LEU  32   3.470  -4.294  -4.230
  252   1HD2  LEU  32          1HD2      LEU  32   3.360  -3.318  -5.979
  253   2HD2  LEU  32          2HD2      LEU  32   2.752  -4.504  -7.134
  254   3HD2  LEU  32          3HD2      LEU  32   4.286  -3.686  -7.434
  255    H    ILE  33           H        ILE  33   5.649  -3.667  -2.925
  256    HA   ILE  33           HA       ILE  33   3.492  -1.861  -3.481
  257    HB   ILE  33           HB       ILE  33   4.598  -3.229  -1.064
  258   1HG1  ILE  33          2HG1      ILE  33   1.929  -3.030  -2.437
  259   2HG1  ILE  33          1HG1      ILE  33   2.963  -4.440  -2.262
  260   1HG2  ILE  33          1HG2      ILE  33   3.942  -1.759   0.461
  261   2HG2  ILE  33          2HG2      ILE  33   2.369  -1.566  -0.309
  262   3HG2  ILE  33          3HG2      ILE  33   3.733  -0.587  -0.835
  263   1HD1  ILE  33          1HD1      ILE  33   1.885  -5.033  -0.433
  264   2HD1  ILE  33          2HD1      ILE  33   0.797  -3.663  -0.659
  265   3HD1  ILE  33          3HD1      ILE  33   2.248  -3.485   0.328
  266    H    ASN  34           H        ASN  34   6.451  -1.638  -1.507
  267    HA   ASN  34           HA       ASN  34   6.317   1.051  -0.872
  268   1HB   ASN  34          2HB       ASN  34   8.019  -0.910  -0.246
  269   2HB   ASN  34          1HB       ASN  34   9.001  -0.086  -1.453
  270   1HD2  ASN  34          1HD2      ASN  34   9.316  -0.365   1.464
  271   2HD2  ASN  34          2HD2      ASN  34   9.450   1.248   2.069
  272    H    ASN  35           H        ASN  35   7.096  -0.415  -3.907
  273    HA   ASN  35           HA       ASN  35   8.596   1.706  -5.030
  274   1HB   ASN  35          2HB       ASN  35   7.620  -0.843  -5.865
  275   2HB   ASN  35          1HB       ASN  35   7.168   0.344  -7.083
  276   1HD2  ASN  35          1HD2      ASN  35   9.632  -1.587  -5.846
  277   2HD2  ASN  35          2HD2      ASN  35  10.939  -0.955  -6.782
  278    H    ALA  36           H        ALA  36   5.225   1.314  -4.436
  279    HA   ALA  36           HA       ALA  36   4.246   3.028  -6.473
  280   1HB   ALA  36          1HB       ALA  36   3.159   1.590  -4.208
  281   2HB   ALA  36          2HB       ALA  36   2.414   2.000  -5.753
  282   3HB   ALA  36          3HB       ALA  36   2.399   3.166  -4.431
  283    H    LYS  37           H        LYS  37   3.739   5.178  -6.463
  284    HA   LYS  37           HA       LYS  37   5.161   6.800  -4.515
  285   1HB   LYS  37          2HB       LYS  37   4.206   7.125  -7.265
  286   2HB   LYS  37          1HB       LYS  37   3.937   8.544  -6.261
  287   1HG   LYS  37          2HG       LYS  37   6.019   8.988  -7.108
  288   2HG   LYS  37          1HG       LYS  37   6.439   8.186  -5.592
  289   1HD   LYS  37          2HD       LYS  37   6.122   6.592  -8.109
  290   2HD   LYS  37          1HD       LYS  37   7.623   7.465  -7.790
  291   1HE   LYS  37          2HE       LYS  37   6.368   5.274  -6.161
  292   2HE   LYS  37          1HE       LYS  37   7.931   5.263  -6.976
  293   1HZ   LYS  37          1HZ       LYS  37   8.447   7.220  -5.410
  294   2HZ   LYS  37          2HZ       LYS  37   8.484   5.642  -4.786
  295   3HZ   LYS  37          3HZ       LYS  37   7.150   6.639  -4.491
  296    H    THR  38           H        THR  38   1.889   6.071  -5.508
  297    HA   THR  38           HA       THR  38   0.752   8.063  -3.722
  298    HB   THR  38           HB       THR  38  -1.362   7.492  -4.662
  299    HG1  THR  38           1HG      THR  38  -1.571   5.385  -4.797
  300   1HG2  THR  38          1HG2      THR  38  -0.340   6.978  -7.224
  301   2HG2  THR  38          2HG2      THR  38   0.824   8.027  -6.414
  302   3HG2  THR  38          3HG2      THR  38  -0.865   8.520  -6.548
  303    H    VAL  39           H        VAL  39  -1.574   6.359  -3.035
  304    HA   VAL  39           HA       VAL  39  -0.311   4.348  -1.341
  305    HB   VAL  39           HB       VAL  39  -0.748   6.650  -0.165
  306   1HG1  VAL  39          1HG1      VAL  39  -2.842   6.743   0.995
  307   2HG1  VAL  39          2HG1      VAL  39  -3.372   5.243   0.233
  308   3HG1  VAL  39          3HG1      VAL  39  -3.150   6.696  -0.743
  309   1HG2  VAL  39          1HG2      VAL  39   0.240   5.005   1.083
  310   2HG2  VAL  39          2HG2      VAL  39  -1.051   3.852   0.765
  311   3HG2  VAL  39          3HG2      VAL  39  -1.311   5.165   1.912
  312    H    GLU  40           H        GLU  40  -3.351   5.675  -2.577
  313    HA   GLU  40           HA       GLU  40  -5.120   3.751  -1.725
  314   1HB   GLU  40          2HB       GLU  40  -4.980   5.571  -4.049
  315   2HB   GLU  40          1HB       GLU  40  -6.080   4.209  -4.211
  316   1HG   GLU  40          2HG       GLU  40  -7.581   5.446  -3.149
  317   2HG   GLU  40          1HG       GLU  40  -6.627   5.193  -1.692
  318    H    GLY  41           H        GLY  41  -2.860   3.583  -4.424
  319   1HA   GLY  41          2HA       GLY  41  -3.825   0.987  -5.260
  320   2HA   GLY  41          1HA       GLY  41  -2.440   1.848  -5.916
  321    H    VAL  42           H        VAL  42  -1.287   2.260  -3.240
  322    HA   VAL  42           HA       VAL  42   0.443   0.086  -3.125
  323    HB   VAL  42           HB       VAL  42  -0.240   1.957  -0.861
  324   1HG1  VAL  42          1HG1      VAL  42   0.966   0.142   0.021
  325   2HG1  VAL  42          2HG1      VAL  42   2.165   1.413  -0.254
  326   3HG1  VAL  42          3HG1      VAL  42   2.027   0.069  -1.391
  327   1HG2  VAL  42          1HG2      VAL  42   1.317   3.466  -1.672
  328   2HG2  VAL  42          2HG2      VAL  42   0.547   2.909  -3.157
  329   3HG2  VAL  42          3HG2      VAL  42   2.113   2.259  -2.677
  330    H    GLU  43           H        GLU  43  -2.316   0.823  -1.000
  331    HA   GLU  43           HA       GLU  43  -2.059  -1.555   0.532
  332   1HB   GLU  43          2HB       GLU  43  -4.604  -0.947   1.009
  333   2HB   GLU  43          1HB       GLU  43  -3.282  -0.028   1.714
  334   1HG   GLU  43          2HG       GLU  43  -3.543   1.728   0.170
  335   2HG   GLU  43          1HG       GLU  43  -4.599   0.764  -0.864
  336    H    SER  44           H        SER  44  -4.395  -0.651  -2.002
  337    HA   SER  44           HA       SER  44  -5.654  -3.159  -2.134
  338   1HB   SER  44          2HB       SER  44  -6.079  -0.700  -3.268
  339   2HB   SER  44          1HB       SER  44  -5.554  -1.654  -4.657
  340    HG   SER  44           HG       SER  44  -7.319  -2.836  -4.533
  341    H    LEU  45           H        LEU  45  -2.649  -2.010  -3.365
  342    HA   LEU  45           HA       LEU  45  -2.208  -3.660  -5.559
  343   1HB   LEU  45          2HB       LEU  45  -0.579  -2.135  -3.674
  344   2HB   LEU  45          1HB       LEU  45   0.250  -3.545  -4.289
  345   1HD1  LEU  45          1HD1      LEU  45   1.883  -2.103  -6.412
  346   2HD1  LEU  45          2HD1      LEU  45   0.745  -2.860  -7.526
  347   3HD1  LEU  45          3HD1      LEU  45   1.199  -3.685  -6.035
  348   1HD2  LEU  45          1HD2      LEU  45  -2.248  -1.765  -6.128
  349   2HD2  LEU  45          2HD2      LEU  45  -1.408  -2.665  -7.388
  350   3HD2  LEU  45          3HD2      LEU  45  -1.192  -0.920  -7.259
  351    H    LYS  46           H        LYS  46  -1.163  -4.276  -2.201
  352    HA   LYS  46           HA       LYS  46  -0.474  -6.980  -2.736
  353   1HB   LYS  46          2HB       LYS  46   0.648  -6.461  -0.865
  354   2HB   LYS  46          1HB       LYS  46  -0.464  -5.174  -0.428
  355   1HG   LYS  46          2HG       LYS  46  -1.210  -8.045   0.004
  356   2HG   LYS  46          1HG       LYS  46  -0.155  -7.203   1.145
  357   1HD   LYS  46          2HD       LYS  46  -1.915  -5.416   1.307
  358   2HD   LYS  46          1HD       LYS  46  -2.976  -6.470   0.376
  359   1HE   LYS  46          2HE       LYS  46  -3.320  -7.877   2.103
  360   2HE   LYS  46          1HE       LYS  46  -1.674  -7.704   2.708
  361   1HZ   LYS  46          1HZ       LYS  46  -3.535  -5.443   2.950
  362   2HZ   LYS  46          2HZ       LYS  46  -2.224  -5.862   3.931
  363   3HZ   LYS  46          3HZ       LYS  46  -3.668  -6.734   4.036
  364    H    ASN  47           H        ASN  47  -3.335  -5.417  -1.361
  365    HA   ASN  47           HA       ASN  47  -4.701  -7.763  -0.627
  366   1HB   ASN  47          2HB       ASN  47  -5.441  -4.930  -1.117
  367   2HB   ASN  47          1HB       ASN  47  -6.752  -6.097  -1.262
  368   1HD2  ASN  47          1HD2      ASN  47  -5.408  -4.030   0.797
  369   2HD2  ASN  47          2HD2      ASN  47  -5.742  -4.810   2.303
  370    H    GLU  48           H        GLU  48  -4.235  -6.207  -3.694
  371    HA   GLU  48           HA       GLU  48  -6.285  -7.708  -5.053
  372   1HB   GLU  48          2HB       GLU  48  -5.444  -5.432  -5.777
  373   2HB   GLU  48          1HB       GLU  48  -3.962  -6.225  -6.296
  374   1HG   GLU  48          2HG       GLU  48  -6.632  -7.117  -7.307
  375   2HG   GLU  48          1HG       GLU  48  -5.783  -5.754  -8.035
  376    H    ILE  49           H        ILE  49  -2.848  -7.948  -4.482
  377    HA   ILE  49           HA       ILE  49  -2.329 -10.071  -6.300
  378    HB   ILE  49           HB       ILE  49  -0.214 -10.307  -5.265
  379   1HG1  ILE  49          2HG1      ILE  49  -0.809  -8.613  -2.899
  380   2HG1  ILE  49          1HG1      ILE  49  -1.391 -10.264  -2.862
  381   1HG2  ILE  49          1HG2      ILE  49  -0.094  -7.567  -4.561
  382   2HG2  ILE  49          2HG2      ILE  49  -1.223  -7.745  -5.903
  383   3HG2  ILE  49          3HG2      ILE  49   0.427  -8.349  -6.053
  384   1HD1  ILE  49          1HD1      ILE  49   0.722 -11.130  -2.815
  385   2HD1  ILE  49          2HD1      ILE  49   0.906  -9.646  -1.875
  386   3HD1  ILE  49          3HD1      ILE  49   1.434  -9.698  -3.557
  387    H    LEU  50           H        LEU  50  -3.586  -9.835  -3.095
  388    HA   LEU  50           HA       LEU  50  -3.352 -12.628  -2.475
  389   1HB   LEU  50          2HB       LEU  50  -4.777 -10.315  -1.163
  390   2HB   LEU  50          1HB       LEU  50  -4.802 -11.944  -0.511
  391    HG   LEU  50           HG       LEU  50  -2.126 -10.829  -1.076
  392   1HD1  LEU  50          1HD1      LEU  50  -3.887  -9.752   1.112
  393   2HD1  LEU  50          2HD1      LEU  50  -3.122  -8.848  -0.196
  394   3HD1  LEU  50          3HD1      LEU  50  -2.132  -9.578   1.069
  395   1HD2  LEU  50          1HD2      LEU  50  -2.004 -11.793   1.401
  396   2HD2  LEU  50          2HD2      LEU  50  -1.906 -12.829  -0.024
  397   3HD2  LEU  50          3HD2      LEU  50  -3.433 -12.666   0.846
  398    H    LYS  51           H        LYS  51  -5.766 -10.468  -3.806
  399    HA   LYS  51           HA       LYS  51  -8.014 -12.141  -3.553
  400   1HB   LYS  51          2HB       LYS  51  -7.735  -9.636  -4.390
  401   2HB   LYS  51          1HB       LYS  51  -7.697 -10.411  -5.967
  402   1HG   LYS  51          2HG       LYS  51  -9.889 -10.886  -5.930
  403   2HG   LYS  51          1HG       LYS  51  -9.878 -11.296  -4.214
  404   1HD   LYS  51          2HD       LYS  51 -10.772  -9.318  -3.731
  405   2HD   LYS  51          1HD       LYS  51  -9.383  -8.506  -4.454
  406   1HE   LYS  51          2HE       LYS  51 -10.899  -7.662  -5.874
  407   2HE   LYS  51          1HE       LYS  51 -10.773  -9.234  -6.663
  408   1HZ   LYS  51          1HZ       LYS  51 -12.692  -9.993  -5.488
  409   2HZ   LYS  51          2HZ       LYS  51 -13.078  -8.519  -6.211
  410   3HZ   LYS  51          3HZ       LYS  51 -12.756  -8.584  -4.553
  411    H    ALA  52           H        ALA  52  -5.239 -12.269  -5.572
  412    HA   ALA  52           HA       ALA  52  -6.229 -14.711  -6.809
  413   1HB   ALA  52          1HB       ALA  52  -6.798 -12.996  -8.434
  414   2HB   ALA  52          2HB       ALA  52  -5.489 -14.006  -9.047
  415   3HB   ALA  52          3HB       ALA  52  -5.137 -12.398  -8.410
  416    H    LEU  53           H        LEU  53  -4.534 -14.947  -4.872
  417    HA   LEU  53           HA       LEU  53  -1.785 -14.657  -5.650
  418   1HB   LEU  53          2HB       LEU  53  -3.081 -14.879  -3.256
  419   2HB   LEU  53          1HB       LEU  53  -2.404 -16.487  -3.436
  420    HG   LEU  53           HG       LEU  53  -0.591 -14.170  -3.882
  421   1HD1  LEU  53          1HD1      LEU  53  -1.806 -14.930  -1.262
  422   2HD1  LEU  53          2HD1      LEU  53  -1.451 -13.330  -1.913
  423   3HD1  LEU  53          3HD1      LEU  53  -0.140 -14.356  -1.331
  424   1HD2  LEU  53          1HD2      LEU  53   0.125 -16.504  -2.226
  425   2HD2  LEU  53          2HD2      LEU  53   1.043 -15.676  -3.483
  426   3HD2  LEU  53          3HD2      LEU  53  -0.216 -16.828  -3.925
  427    HA   PRO  54           HA       PRO  54  -1.929 -18.586  -7.873
  428   1HB   PRO  54          2HB       PRO  54   0.478 -18.353  -9.066
  429   2HB   PRO  54          1HB       PRO  54  -0.940 -17.461  -9.628
  430   1HG   PRO  54          2HG       PRO  54   1.323 -16.527  -7.904
  431   2HG   PRO  54          1HG       PRO  54   0.531 -15.697  -9.257
  432   1HD   PRO  54          2HD       PRO  54  -0.034 -15.165  -6.648
  433   2HD   PRO  54          1HD       PRO  54  -1.221 -14.982  -7.954
  434    H    THR  55           H        THR  55  -0.156 -20.368  -8.154
  435    HA   THR  55           HA       THR  55   1.066 -20.789  -5.511
  436    HB   THR  55           HB       THR  55   1.071 -23.258  -6.669
  437    HG1  THR  55           1HG      THR  55  -0.596 -23.508  -7.966
  438   1HG2  THR  55          1HG2      THR  55   0.178 -23.356  -4.603
  439   2HG2  THR  55          2HG2      THR  55  -1.325 -23.406  -5.524
  440   3HG2  THR  55          3HG2      THR  55  -0.773 -21.887  -4.820
  441    H    GLU  56           H        GLU  56   1.593 -21.385  -8.977
  442    HA   GLU  56           HA       GLU  56   3.487 -21.561 -10.223
  443   1HB   GLU  56          2HB       GLU  56   3.839 -19.333  -8.858
  444   2HB   GLU  56          1HB       GLU  56   5.102 -20.266  -8.066
  445   1HG   GLU  56          2HG       GLU  56   6.471 -20.106  -9.813
  446   2HG   GLU  56          1HG       GLU  56   5.188 -20.471 -10.966
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1  -4.771  19.155  -2.430
    2   2H    MET   1          2HT       MET   1  -4.402  18.478  -0.893
    3   3H    MET   1          3HT       MET   1  -4.188  17.549  -2.317
    4    HA   MET   1           HA       MET   1  -2.421  18.833  -3.035
    5   1HB   MET   1          2HB       MET   1  -3.563  20.718  -1.047
    6   2HB   MET   1          1HB       MET   1  -1.815  20.742  -1.233
    7   1HG   MET   1          2HG       MET   1  -1.910  21.682  -3.274
    8   2HG   MET   1          1HG       MET   1  -3.344  20.783  -3.736
    9   1HE   MET   1          1HE       MET   1  -5.199  23.989  -4.277
   10   2HE   MET   1          2HE       MET   1  -5.254  22.240  -4.518
   11   3HE   MET   1          3HE       MET   1  -3.833  23.162  -5.018
   12    H    GLU   2           H        GLU   2  -0.240  19.187  -1.836
   13    HA   GLU   2           HA       GLU   2   0.174  16.870  -0.197
   14   1HB   GLU   2          2HB       GLU   2   2.051  18.991  -1.236
   15   2HB   GLU   2          1HB       GLU   2   2.578  17.630  -0.258
   16   1HG   GLU   2          2HG       GLU   2   1.035  17.176  -2.776
   17   2HG   GLU   2          1HG       GLU   2   2.766  17.500  -2.829
   18    H    ALA   3           H        ALA   3   1.459  16.981   1.819
   19    HA   ALA   3           HA       ALA   3   1.743  19.316   3.344
   20   1HB   ALA   3          1HB       ALA   3  -0.899  18.750   3.152
   21   2HB   ALA   3          2HB       ALA   3  -0.156  19.584   4.521
   22   3HB   ALA   3          3HB       ALA   3  -0.473  17.844   4.600
   23    H    VAL   4           H        VAL   4   0.424  16.113   4.201
   24    HA   VAL   4           HA       VAL   4   2.994  15.211   5.151
   25    HB   VAL   4           HB       VAL   4   2.072  14.700   7.444
   26   1HG1  VAL   4          1HG1      VAL   4   2.402  17.625   6.820
   27   2HG1  VAL   4          2HG1      VAL   4   3.737  16.483   6.934
   28   3HG1  VAL   4          3HG1      VAL   4   2.745  16.816   8.344
   29   1HG2  VAL   4          1HG2      VAL   4   0.205  16.997   7.066
   30   2HG2  VAL   4          2HG2      VAL   4   0.152  15.680   8.245
   31   3HG2  VAL   4          3HG2      VAL   4  -0.310  15.374   6.569
   32    H    ASP   5           H        ASP   5   0.918  14.399   3.235
   33    HA   ASP   5           HA       ASP   5  -0.518  12.182   4.249
   34   1HB   ASP   5          2HB       ASP   5  -0.858  11.611   1.854
   35   2HB   ASP   5          1HB       ASP   5  -1.252  13.282   2.222
   36    H    ALA   6           H        ALA   6   2.747  12.610   3.219
   37    HA   ALA   6           HA       ALA   6   3.475  10.100   2.333
   38   1HB   ALA   6          1HB       ALA   6   4.873  12.361   3.598
   39   2HB   ALA   6          2HB       ALA   6   5.254  11.460   2.130
   40   3HB   ALA   6          3HB       ALA   6   5.691  10.806   3.706
   41    H    ASN   7           H        ASN   7   2.929  11.205   5.627
   42    HA   ASN   7           HA       ASN   7   4.036   8.966   6.946
   43   1HB   ASN   7          2HB       ASN   7   2.881  11.386   7.715
   44   2HB   ASN   7          1HB       ASN   7   1.802  10.162   8.373
   45   1HD2  ASN   7          1HD2      ASN   7   5.246  10.929   8.104
   46   2HD2  ASN   7          2HD2      ASN   7   5.677  10.367   9.678
   47    H    SER   8           H        SER   8   0.711   9.762   5.985
   48    HA   SER   8           HA       SER   8  -0.414   7.341   6.939
   49   1HB   SER   8          2HB       SER   8  -2.292   8.041   5.263
   50   2HB   SER   8          1HB       SER   8  -1.988   9.043   6.679
   51    HG   SER   8           HG       SER   8  -0.948   9.492   4.081
   52    H    LEU   9           H        LEU   9   1.057   8.340   3.942
   53    HA   LEU   9           HA       LEU   9   0.173   6.217   2.314
   54   1HB   LEU   9          2HB       LEU   9   1.222   8.378   1.557
   55   2HB   LEU   9          1HB       LEU   9   2.766   7.726   2.065
   56    HG   LEU   9           HG       LEU   9   1.014   6.531  -0.077
   57   1HD1  LEU   9          1HD1      LEU   9   3.655   7.728  -0.650
   58   2HD1  LEU   9          2HD1      LEU   9   2.297   8.816  -0.370
   59   3HD1  LEU   9          3HD1      LEU   9   2.216   7.623  -1.661
   60   1HD2  LEU   9          1HD2      LEU   9   3.546   5.689   1.216
   61   2HD2  LEU   9          2HD2      LEU   9   3.397   5.460  -0.527
   62   3HD2  LEU   9          3HD2      LEU   9   2.227   4.717   0.563
   63    H    ALA  10           H        ALA  10   3.094   6.697   4.261
   64    HA   ALA  10           HA       ALA  10   4.378   4.294   3.561
   65   1HB   ALA  10          1HB       ALA  10   6.027   5.044   4.866
   66   2HB   ALA  10          2HB       ALA  10   4.960   5.267   6.252
   67   3HB   ALA  10          3HB       ALA  10   5.057   6.507   5.005
   68    H    GLN  11           H        GLN  11   1.718   4.881   5.656
   69    HA   GLN  11           HA       GLN  11   2.114   2.538   7.278
   70   1HB   GLN  11          2HB       GLN  11   1.021   4.359   8.343
   71   2HB   GLN  11          1HB       GLN  11  -0.134   4.524   7.025
   72   1HG   GLN  11          2HG       GLN  11  -1.022   2.305   7.597
   73   2HG   GLN  11          1HG       GLN  11   0.043   2.263   8.996
   74   1HE2  GLN  11          1HE2      GLN  11  -1.565   2.220  10.511
   75   2HE2  GLN  11          2HE2      GLN  11  -2.623   3.553  10.808
   76    H    ALA  12           H        ALA  12   0.005   3.486   4.587
   77    HA   ALA  12           HA       ALA  12  -1.611   1.240   4.459
   78   1HB   ALA  12          1HB       ALA  12  -1.407   3.440   2.971
   79   2HB   ALA  12          2HB       ALA  12  -2.244   1.991   2.406
   80   3HB   ALA  12          3HB       ALA  12  -0.583   2.308   1.894
   81    H    LYS  13           H        LYS  13   1.670   1.734   3.382
   82    HA   LYS  13           HA       LYS  13   1.874  -0.920   2.218
   83   1HB   LYS  13          2HB       LYS  13   4.407  -0.033   2.151
   84   2HB   LYS  13          1HB       LYS  13   3.212   0.390   0.939
   85   1HG   LYS  13          2HG       LYS  13   2.893   2.516   1.793
   86   2HG   LYS  13          1HG       LYS  13   3.614   2.095   3.352
   87   1HD   LYS  13          2HD       LYS  13   5.118   2.211   0.735
   88   2HD   LYS  13          1HD       LYS  13   5.077   3.518   1.919
   89   1HE   LYS  13          2HE       LYS  13   5.793   0.966   3.107
   90   2HE   LYS  13          1HE       LYS  13   6.900   1.440   1.818
   91   1HZ   LYS  13          1HZ       LYS  13   6.138   3.208   4.077
   92   2HZ   LYS  13          2HZ       LYS  13   7.341   3.489   2.921
   93   3HZ   LYS  13          3HZ       LYS  13   7.533   2.251   4.057
   94    H    GLU  14           H        GLU  14   3.469   0.920   4.829
   95    HA   GLU  14           HA       GLU  14   5.000  -1.101   5.932
   96   1HB   GLU  14          2HB       GLU  14   3.637   1.316   7.076
   97   2HB   GLU  14          1HB       GLU  14   4.387   0.161   8.171
   98   1HG   GLU  14          2HG       GLU  14   6.190   0.791   6.033
   99   2HG   GLU  14          1HG       GLU  14   5.610   2.270   6.797
  100    H    ALA  15           H        ALA  15   1.608  -0.354   6.278
  101    HA   ALA  15           HA       ALA  15   1.097  -2.442   8.209
  102   1HB   ALA  15          1HB       ALA  15  -0.203  -0.231   7.873
  103   2HB   ALA  15          2HB       ALA  15  -1.106  -1.700   8.239
  104   3HB   ALA  15          3HB       ALA  15  -1.032  -1.101   6.582
  105    H    ALA  16           H        ALA  16   0.476  -1.937   4.745
  106    HA   ALA  16           HA       ALA  16  -0.853  -4.354   4.244
  107   1HB   ALA  16          1HB       ALA  16   0.101  -3.985   1.864
  108   2HB   ALA  16          2HB       ALA  16   0.708  -2.466   2.519
  109   3HB   ALA  16          3HB       ALA  16  -1.023  -2.799   2.527
  110    H    ILE  17           H        ILE  17   2.494  -3.632   4.743
  111    HA   ILE  17           HA       ILE  17   3.581  -5.964   3.530
  112    HB   ILE  17           HB       ILE  17   4.596  -3.645   4.818
  113   1HG1  ILE  17          2HG1      ILE  17   6.535  -5.632   3.836
  114   2HG1  ILE  17          1HG1      ILE  17   5.241  -5.239   2.708
  115   1HG2  ILE  17          1HG2      ILE  17   4.806  -4.971   6.864
  116   2HG2  ILE  17          2HG2      ILE  17   6.383  -4.525   6.209
  117   3HG2  ILE  17          3HG2      ILE  17   5.766  -6.163   5.989
  118   1HD1  ILE  17          1HD1      ILE  17   6.287  -3.379   2.145
  119   2HD1  ILE  17          2HD1      ILE  17   7.594  -3.788   3.257
  120   3HD1  ILE  17          3HD1      ILE  17   6.230  -2.819   3.817
  121    H    LYS  18           H        LYS  18   2.506  -5.113   6.768
  122    HA   LYS  18           HA       LYS  18   3.384  -7.350   8.175
  123   1HB   LYS  18          2HB       LYS  18   1.755  -5.112   8.659
  124   2HB   LYS  18          1HB       LYS  18   0.769  -6.510   9.068
  125   1HG   LYS  18          2HG       LYS  18   2.046  -7.067  10.849
  126   2HG   LYS  18          1HG       LYS  18   3.538  -6.500  10.097
  127   1HD   LYS  18          2HD       LYS  18   2.782  -4.168  10.466
  128   2HD   LYS  18          1HD       LYS  18   1.372  -4.795  11.323
  129   1HE   LYS  18          2HE       LYS  18   2.817  -4.347  13.063
  130   2HE   LYS  18          1HE       LYS  18   3.140  -6.053  12.757
  131   1HZ   LYS  18          1HZ       LYS  18   5.117  -5.524  11.615
  132   2HZ   LYS  18          2HZ       LYS  18   5.143  -4.593  13.027
  133   3HZ   LYS  18          3HZ       LYS  18   4.744  -3.875  11.548
  134    H    GLU  19           H        GLU  19   0.685  -6.946   5.998
  135    HA   GLU  19           HA       GLU  19  -0.580  -9.425   6.720
  136   1HB   GLU  19          2HB       GLU  19  -0.986  -7.496   4.435
  137   2HB   GLU  19          1HB       GLU  19  -1.905  -8.986   4.592
  138   1HG   GLU  19          2HG       GLU  19  -2.069  -7.696   7.080
  139   2HG   GLU  19          1HG       GLU  19  -2.321  -6.453   5.856
  140    H    LEU  20           H        LEU  20   1.584  -8.307   4.169
  141    HA   LEU  20           HA       LEU  20   1.525 -10.641   2.609
  142   1HB   LEU  20          2HB       LEU  20   3.010  -8.200   2.674
  143   2HB   LEU  20          1HB       LEU  20   4.123  -9.540   2.469
  144    HG   LEU  20           HG       LEU  20   1.989 -10.041   0.719
  145   1HD1  LEU  20          1HD1      LEU  20   1.769  -7.435   1.215
  146   2HD1  LEU  20          2HD1      LEU  20   1.423  -8.148  -0.361
  147   3HD1  LEU  20          3HD1      LEU  20   2.984  -7.380  -0.062
  148   1HD2  LEU  20          1HD2      LEU  20   3.652 -10.365  -0.757
  149   2HD2  LEU  20          2HD2      LEU  20   4.672 -10.214   0.673
  150   3HD2  LEU  20          3HD2      LEU  20   4.425  -8.825  -0.386
  151    H    LYS  21           H        LYS  21   3.233  -9.789   5.525
  152    HA   LYS  21           HA       LYS  21   4.967 -12.101   5.429
  153   1HB   LYS  21          2HB       LYS  21   5.710 -11.335   7.664
  154   2HB   LYS  21          1HB       LYS  21   5.828 -10.076   6.442
  155   1HG   LYS  21          2HG       LYS  21   3.878  -8.986   7.272
  156   2HG   LYS  21          1HG       LYS  21   3.532 -10.325   8.369
  157   1HD   LYS  21          2HD       LYS  21   6.123  -9.586   9.014
  158   2HD   LYS  21          1HD       LYS  21   5.309  -8.051   8.708
  159   1HE   LYS  21          2HE       LYS  21   3.651  -8.507  10.348
  160   2HE   LYS  21          1HE       LYS  21   4.169 -10.185  10.498
  161   1HZ   LYS  21          1HZ       LYS  21   5.233  -9.342  12.283
  162   2HZ   LYS  21          2HZ       LYS  21   5.324  -7.776  11.653
  163   3HZ   LYS  21          3HZ       LYS  21   6.419  -8.957  11.138
  164    H    GLN  22           H        GLN  22   2.040 -11.071   7.129
  165    HA   GLN  22           HA       GLN  22   1.935 -13.396   8.795
  166   1HB   GLN  22          2HB       GLN  22  -0.052 -12.540   9.654
  167   2HB   GLN  22          1HB       GLN  22   0.815 -11.091   9.171
  168   1HG   GLN  22          2HG       GLN  22  -1.142 -10.550   8.227
  169   2HG   GLN  22          1HG       GLN  22  -0.572 -11.585   6.918
  170   1HE2  GLN  22          1HE2      GLN  22  -2.650 -11.391   9.719
  171   2HE2  GLN  22          2HE2      GLN  22  -3.661 -12.729   9.305
  172    H    TYR  23           H        TYR  23   0.890 -12.597   5.594
  173    HA   TYR  23           HA       TYR  23  -0.930 -14.821   5.341
  174   1HB   TYR  23          2HB       TYR  23   0.109 -12.689   3.511
  175   2HB   TYR  23          1HB       TYR  23  -0.644 -14.125   2.817
  176    HD1  TYR  23           1HD      TYR  23  -2.899 -14.735   4.377
  177    HD2  TYR  23           2HD      TYR  23  -1.307 -10.892   3.499
  178    HE1  TYR  23           1HE      TYR  23  -5.117 -13.742   4.729
  179    HE2  TYR  23           2HE      TYR  23  -3.516  -9.888   3.850
  180    HH   TYR  23           HH       TYR  23  -5.951 -10.696   3.729
  181    H    GLY  24           H        GLY  24   2.370 -14.027   4.387
  182   1HA   GLY  24          2HA       GLY  24   4.014 -15.813   4.375
  183   2HA   GLY  24          1HA       GLY  24   2.769 -16.877   3.744
  184    H    ILE  25           H        ILE  25   2.158 -14.191   2.073
  185    HA   ILE  25           HA       ILE  25   3.058 -15.114  -0.369
  186    HB   ILE  25           HB       ILE  25   3.134 -12.181  -0.245
  187   1HG1  ILE  25          2HG1      ILE  25   0.627 -13.649   0.608
  188   2HG1  ILE  25          1HG1      ILE  25   1.530 -12.470   1.555
  189   1HG2  ILE  25          1HG2      ILE  25   2.057 -14.346  -1.919
  190   2HG2  ILE  25          2HG2      ILE  25   2.837 -12.833  -2.375
  191   3HG2  ILE  25          3HG2      ILE  25   1.130 -12.846  -1.923
  192   1HD1  ILE  25          1HD1      ILE  25  -0.145 -11.145   0.788
  193   2HD1  ILE  25          2HD1      ILE  25  -0.330 -12.056  -0.712
  194   3HD1  ILE  25          3HD1      ILE  25   1.014 -10.934  -0.524
  195    H    GLY  26           H        GLY  26   4.656 -13.788  -1.849
  196   1HA   GLY  26          2HA       GLY  26   7.249 -14.082  -0.613
  197   2HA   GLY  26          1HA       GLY  26   6.928 -13.688  -2.299
  198    H    ASP  27           H        ASP  27   8.958 -12.435  -0.955
  199    HA   ASP  27           HA       ASP  27   8.133  -9.948   0.179
  200   1HB   ASP  27          2HB       ASP  27  10.579 -11.379  -0.143
  201   2HB   ASP  27          1HB       ASP  27  10.805  -9.766  -0.811
  202    H    TYR  28           H        TYR  28   8.632 -11.081  -3.041
  203    HA   TYR  28           HA       TYR  28   9.330  -8.859  -4.494
  204   1HB   TYR  28          2HB       TYR  28   8.389 -11.309  -5.170
  205   2HB   TYR  28          1HB       TYR  28   6.970 -10.333  -5.531
  206    HD1  TYR  28           1HD      TYR  28   8.644  -7.826  -6.269
  207    HD2  TYR  28           2HD      TYR  28   8.805 -11.896  -7.486
  208    HE1  TYR  28           1HE      TYR  28   9.636  -7.138  -8.396
  209    HE2  TYR  28           2HE      TYR  28   9.803 -11.219  -9.630
  210    HH   TYR  28           HH       TYR  28  11.053  -8.130 -10.181
  211    H    TYR  29           H        TYR  29   6.133  -9.750  -3.351
  212    HA   TYR  29           HA       TYR  29   4.905  -7.363  -4.307
  213   1HB   TYR  29          2HB       TYR  29   3.734  -9.378  -2.390
  214   2HB   TYR  29          1HB       TYR  29   2.866  -8.266  -3.440
  215    HD1  TYR  29           1HD      TYR  29   2.628 -11.342  -3.369
  216    HD2  TYR  29           2HD      TYR  29   4.905  -8.676  -5.795
  217    HE1  TYR  29           1HE      TYR  29   2.689 -13.031  -5.155
  218    HE2  TYR  29           2HE      TYR  29   4.978 -10.368  -7.578
  219    HH   TYR  29           HH       TYR  29   3.992 -13.615  -7.095
  220    H    ILE  30           H        ILE  30   6.492  -8.153  -1.323
  221    HA   ILE  30           HA       ILE  30   5.161  -6.092   0.185
  222    HB   ILE  30           HB       ILE  30   6.483  -6.620   1.965
  223   1HG1  ILE  30          2HG1      ILE  30   8.818  -7.758   1.579
  224   2HG1  ILE  30          1HG1      ILE  30   8.676  -7.024  -0.014
  225   1HG2  ILE  30          1HG2      ILE  30   5.484  -8.655   1.677
  226   2HG2  ILE  30          2HG2      ILE  30   7.183  -9.100   1.794
  227   3HG2  ILE  30          3HG2      ILE  30   6.398  -9.026   0.219
  228   1HD1  ILE  30          1HD1      ILE  30   8.006  -4.957   1.619
  229   2HD1  ILE  30          2HD1      ILE  30   9.611  -5.244   0.941
  230   3HD1  ILE  30          3HD1      ILE  30   9.228  -5.801   2.571
  231    H    LYS  31           H        LYS  31   7.940  -6.435  -1.855
  232    HA   LYS  31           HA       LYS  31   8.994  -3.803  -1.349
  233   1HB   LYS  31          2HB       LYS  31   9.726  -6.151  -3.001
  234   2HB   LYS  31          1HB       LYS  31  10.282  -4.584  -3.569
  235   1HG   LYS  31          2HG       LYS  31  11.866  -4.458  -2.007
  236   2HG   LYS  31          1HG       LYS  31  10.763  -4.971  -0.729
  237   1HD   LYS  31          2HD       LYS  31  11.237  -7.235  -2.343
  238   2HD   LYS  31          1HD       LYS  31  12.804  -6.471  -2.070
  239   1HE   LYS  31          2HE       LYS  31  10.843  -7.089   0.131
  240   2HE   LYS  31          1HE       LYS  31  12.133  -8.186  -0.361
  241   1HZ   LYS  31          1HZ       LYS  31  13.179  -7.066   1.295
  242   2HZ   LYS  31          2HZ       LYS  31  12.301  -5.639   1.065
  243   3HZ   LYS  31          3HZ       LYS  31  13.567  -6.031   0.014
  244    H    LEU  32           H        LEU  32   7.381  -5.454  -4.066
  245    HA   LEU  32           HA       LEU  32   7.332  -3.360  -5.852
  246   1HB   LEU  32          2HB       LEU  32   6.119  -4.762  -7.124
  247   2HB   LEU  32          1HB       LEU  32   6.364  -5.902  -5.825
  248    HG   LEU  32           HG       LEU  32   4.089  -6.024  -6.329
  249   1HD1  LEU  32          1HD1      LEU  32   5.028  -5.082  -3.890
  250   2HD1  LEU  32          2HD1      LEU  32   3.525  -5.968  -4.195
  251   3HD1  LEU  32          3HD1      LEU  32   3.527  -4.202  -4.194
  252   1HD2  LEU  32          1HD2      LEU  32   4.325  -3.559  -7.409
  253   2HD2  LEU  32          2HD2      LEU  32   3.446  -3.178  -5.928
  254   3HD2  LEU  32          3HD2      LEU  32   2.780  -4.342  -7.075
  255    H    ILE  33           H        ILE  33   5.709  -3.634  -2.873
  256    HA   ILE  33           HA       ILE  33   3.583  -1.775  -3.386
  257    HB   ILE  33           HB       ILE  33   4.671  -3.193  -0.987
  258   1HG1  ILE  33          2HG1      ILE  33   2.018  -2.971  -2.387
  259   2HG1  ILE  33          1HG1      ILE  33   3.037  -4.391  -2.190
  260   1HG2  ILE  33          1HG2      ILE  33   2.460  -1.564  -0.176
  261   2HG2  ILE  33          2HG2      ILE  33   3.758  -0.538  -0.773
  262   3HG2  ILE  33          3HG2      ILE  33   4.071  -1.686   0.525
  263   1HD1  ILE  33          1HD1      ILE  33   2.323  -3.466   0.393
  264   2HD1  ILE  33          2HD1      ILE  33   1.873  -4.968  -0.408
  265   3HD1  ILE  33          3HD1      ILE  33   0.866  -3.533  -0.599
  266    H    ASN  34           H        ASN  34   6.548  -1.650  -1.412
  267    HA   ASN  34           HA       ASN  34   6.467   1.019  -0.706
  268   1HB   ASN  34          2HB       ASN  34   8.057  -0.630   0.212
  269   2HB   ASN  34          1HB       ASN  34   8.935  -0.616  -1.314
  270   1HD2  ASN  34          1HD2      ASN  34  10.776   0.403  -1.024
  271   2HD2  ASN  34          2HD2      ASN  34  10.990   1.901  -0.191
  272    H    ASN  35           H        ASN  35   7.183  -0.362  -3.794
  273    HA   ASN  35           HA       ASN  35   8.655   1.836  -4.847
  274   1HB   ASN  35          2HB       ASN  35   7.692  -0.733  -5.784
  275   2HB   ASN  35          1HB       ASN  35   7.476   0.514  -7.007
  276   1HD2  ASN  35          1HD2      ASN  35   9.087   0.541  -8.378
  277   2HD2  ASN  35          2HD2      ASN  35  10.755   0.293  -8.004
  278    H    ALA  36           H        ALA  36   5.288   1.263  -4.352
  279    HA   ALA  36           HA       ALA  36   4.191   2.816  -6.407
  280   1HB   ALA  36          1HB       ALA  36   2.424   1.851  -5.469
  281   2HB   ALA  36          2HB       ALA  36   2.459   3.168  -4.297
  282   3HB   ALA  36          3HB       ALA  36   3.256   1.637  -3.930
  283    H    LYS  37           H        LYS  37   3.492   4.943  -6.512
  284    HA   LYS  37           HA       LYS  37   5.082   6.805  -4.936
  285   1HB   LYS  37          2HB       LYS  37   3.790   6.812  -7.567
  286   2HB   LYS  37          1HB       LYS  37   3.587   8.318  -6.685
  287   1HG   LYS  37          2HG       LYS  37   5.583   8.897  -7.473
  288   2HG   LYS  37          1HG       LYS  37   6.261   7.719  -6.346
  289   1HD   LYS  37          2HD       LYS  37   5.452   7.166  -9.202
  290   2HD   LYS  37          1HD       LYS  37   7.108   7.375  -8.615
  291   1HE   LYS  37          2HE       LYS  37   6.827   5.413  -7.171
  292   2HE   LYS  37          1HE       LYS  37   5.181   5.219  -7.762
  293   1HZ   LYS  37          1HZ       LYS  37   7.254   5.331  -9.792
  294   2HZ   LYS  37          2HZ       LYS  37   5.888   4.346  -9.697
  295   3HZ   LYS  37          3HZ       LYS  37   7.272   3.961  -8.804
  296    H    THR  38           H        THR  38   1.717   5.986  -5.559
  297    HA   THR  38           HA       THR  38   0.811   8.013  -3.654
  298    HB   THR  38           HB       THR  38  -1.390   7.638  -4.488
  299    HG1  THR  38           1HG      THR  38  -1.854   5.901  -5.874
  300   1HG2  THR  38          1HG2      THR  38  -1.210   7.865  -6.911
  301   2HG2  THR  38          2HG2      THR  38   0.489   7.396  -6.825
  302   3HG2  THR  38          3HG2      THR  38  -0.055   8.890  -6.068
  303    H    VAL  39           H        VAL  39  -1.564   6.527  -2.845
  304    HA   VAL  39           HA       VAL  39  -0.334   4.346  -1.325
  305    HB   VAL  39           HB       VAL  39  -0.729   6.590  -0.036
  306   1HG1  VAL  39          1HG1      VAL  39  -3.129   6.711  -0.638
  307   2HG1  VAL  39          2HG1      VAL  39  -2.826   6.698   1.101
  308   3HG1  VAL  39          3HG1      VAL  39  -3.388   5.235   0.292
  309   1HG2  VAL  39          1HG2      VAL  39   0.208   4.808   1.099
  310   2HG2  VAL  39          2HG2      VAL  39  -1.183   3.769   0.802
  311   3HG2  VAL  39          3HG2      VAL  39  -1.298   5.076   1.980
  312    H    GLU  40           H        GLU  40  -3.350   5.752  -2.517
  313    HA   GLU  40           HA       GLU  40  -5.150   3.820  -1.741
  314   1HB   GLU  40          2HB       GLU  40  -5.610   5.958  -3.042
  315   2HB   GLU  40          1HB       GLU  40  -5.166   5.063  -4.487
  316   1HG   GLU  40          2HG       GLU  40  -7.403   4.743  -4.556
  317   2HG   GLU  40          1HG       GLU  40  -6.970   3.371  -3.533
  318    H    GLY  41           H        GLY  41  -2.738   3.663  -4.262
  319   1HA   GLY  41          2HA       GLY  41  -3.747   1.120  -5.257
  320   2HA   GLY  41          1HA       GLY  41  -2.340   1.991  -5.854
  321    H    VAL  42           H        VAL  42  -1.258   2.329  -3.139
  322    HA   VAL  42           HA       VAL  42   0.456   0.138  -3.031
  323    HB   VAL  42           HB       VAL  42  -0.278   1.965  -0.747
  324   1HG1  VAL  42          1HG1      VAL  42   2.098   1.378  -0.075
  325   2HG1  VAL  42          2HG1      VAL  42   1.982   0.058  -1.242
  326   3HG1  VAL  42          3HG1      VAL  42   0.874   0.121   0.138
  327   1HG2  VAL  42          1HG2      VAL  42   1.347   3.458  -1.461
  328   2HG2  VAL  42          2HG2      VAL  42   0.585   2.975  -2.976
  329   3HG2  VAL  42          3HG2      VAL  42   2.127   2.268  -2.495
  330    H    GLU  43           H        GLU  43  -2.397   0.841  -1.030
  331    HA   GLU  43           HA       GLU  43  -2.204  -1.572   0.475
  332   1HB   GLU  43          2HB       GLU  43  -4.750  -0.945   0.887
  333   2HB   GLU  43          1HB       GLU  43  -3.445  -0.046   1.648
  334   1HG   GLU  43          2HG       GLU  43  -3.643   1.732   0.114
  335   2HG   GLU  43          1HG       GLU  43  -4.689   0.792  -0.953
  336    H    SER  44           H        SER  44  -4.385  -0.557  -2.145
  337    HA   SER  44           HA       SER  44  -5.715  -3.019  -2.400
  338   1HB   SER  44          2HB       SER  44  -6.817  -2.039  -4.158
  339   2HB   SER  44          1HB       SER  44  -6.142  -0.582  -3.424
  340    HG   SER  44           HG       SER  44  -5.438  -0.354  -5.423
  341    H    LEU  45           H        LEU  45  -2.613  -1.941  -3.415
  342    HA   LEU  45           HA       LEU  45  -2.100  -3.592  -5.607
  343   1HB   LEU  45          2HB       LEU  45  -0.535  -2.070  -3.652
  344   2HB   LEU  45          1HB       LEU  45   0.315  -3.455  -4.296
  345   1HD1  LEU  45          1HD1      LEU  45   1.975  -1.953  -6.310
  346   2HD1  LEU  45          2HD1      LEU  45   0.874  -2.632  -7.509
  347   3HD1  LEU  45          3HD1      LEU  45   1.267  -3.549  -6.054
  348   1HD2  LEU  45          1HD2      LEU  45  -2.176  -1.668  -6.127
  349   2HD2  LEU  45          2HD2      LEU  45  -1.296  -2.515  -7.397
  350   3HD2  LEU  45          3HD2      LEU  45  -1.118  -0.770  -7.214
  351    H    LYS  46           H        LYS  46  -1.167  -4.183  -2.209
  352    HA   LYS  46           HA       LYS  46  -0.464  -6.893  -2.731
  353   1HB   LYS  46          2HB       LYS  46   0.672  -6.404  -0.874
  354   2HB   LYS  46          1HB       LYS  46  -0.377  -5.058  -0.469
  355   1HG   LYS  46          2HG       LYS  46  -1.258  -7.870   0.061
  356   2HG   LYS  46          1HG       LYS  46  -0.133  -7.059   1.158
  357   1HD   LYS  46          2HD       LYS  46  -1.685  -5.362   1.673
  358   2HD   LYS  46          1HD       LYS  46  -2.734  -5.800   0.327
  359   1HE   LYS  46          2HE       LYS  46  -3.707  -7.498   1.460
  360   2HE   LYS  46          1HE       LYS  46  -2.226  -7.912   2.323
  361   1HZ   LYS  46          1HZ       LYS  46  -4.146  -6.919   3.648
  362   2HZ   LYS  46          2HZ       LYS  46  -3.718  -5.441   2.946
  363   3HZ   LYS  46          3HZ       LYS  46  -2.604  -6.273   3.907
  364    H    ASN  47           H        ASN  47  -3.329  -5.309  -1.398
  365    HA   ASN  47           HA       ASN  47  -4.671  -7.677  -0.628
  366   1HB   ASN  47          2HB       ASN  47  -5.495  -4.857  -1.176
  367   2HB   ASN  47          1HB       ASN  47  -6.755  -6.085  -1.131
  368   1HD2  ASN  47          1HD2      ASN  47  -5.547  -3.798   0.666
  369   2HD2  ASN  47          2HD2      ASN  47  -5.631  -4.503   2.241
  370    H    GLU  48           H        GLU  48  -4.145  -6.156  -3.681
  371    HA   GLU  48           HA       GLU  48  -6.227  -7.610  -5.059
  372   1HB   GLU  48          2HB       GLU  48  -4.030  -5.746  -5.883
  373   2HB   GLU  48          1HB       GLU  48  -4.785  -6.768  -7.098
  374   1HG   GLU  48          2HG       GLU  48  -6.915  -5.791  -6.722
  375   2HG   GLU  48          1HG       GLU  48  -6.338  -4.940  -5.288
  376    H    ILE  49           H        ILE  49  -2.784  -7.865  -4.497
  377    HA   ILE  49           HA       ILE  49  -2.264 -10.010  -6.276
  378    HB   ILE  49           HB       ILE  49  -0.169 -10.269  -5.191
  379   1HG1  ILE  49          2HG1      ILE  49  -0.788  -8.512  -2.880
  380   2HG1  ILE  49          1HG1      ILE  49  -1.396 -10.151  -2.816
  381   1HG2  ILE  49          1HG2      ILE  49  -1.138  -7.702  -5.895
  382   2HG2  ILE  49          2HG2      ILE  49   0.503  -8.336  -6.021
  383   3HG2  ILE  49          3HG2      ILE  49  -0.015  -7.518  -4.548
  384   1HD1  ILE  49          1HD1      ILE  49   0.893  -9.528  -1.798
  385   2HD1  ILE  49          2HD1      ILE  49   1.452  -9.663  -3.465
  386   3HD1  ILE  49          3HD1      ILE  49   0.694 -11.046  -2.675
  387    H    LEU  50           H        LEU  50  -3.584  -9.753  -3.102
  388    HA   LEU  50           HA       LEU  50  -3.385 -12.559  -2.489
  389   1HB   LEU  50          2HB       LEU  50  -4.752 -10.230  -1.140
  390   2HB   LEU  50          1HB       LEU  50  -4.781 -11.864  -0.499
  391    HG   LEU  50           HG       LEU  50  -2.107 -10.765  -1.101
  392   1HD1  LEU  50          1HD1      LEU  50  -2.035  -9.492   0.993
  393   2HD1  LEU  50          2HD1      LEU  50  -3.773  -9.729   1.181
  394   3HD1  LEU  50          3HD1      LEU  50  -3.151  -8.797  -0.183
  395   1HD2  LEU  50          1HD2      LEU  50  -3.391 -12.599   0.844
  396   2HD2  LEU  50          2HD2      LEU  50  -1.926 -11.759   1.349
  397   3HD2  LEU  50          3HD2      LEU  50  -1.901 -12.789  -0.084
  398    H    LYS  51           H        LYS  51  -5.751 -10.327  -3.782
  399    HA   LYS  51           HA       LYS  51  -8.068 -11.860  -3.499
  400   1HB   LYS  51          2HB       LYS  51  -7.298  -9.497  -4.871
  401   2HB   LYS  51          1HB       LYS  51  -8.086 -10.539  -6.048
  402   1HG   LYS  51          2HG       LYS  51  -9.686 -10.645  -3.754
  403   2HG   LYS  51          1HG       LYS  51  -9.237  -8.951  -3.953
  404   1HD   LYS  51          2HD       LYS  51 -10.435  -8.722  -5.854
  405   2HD   LYS  51          1HD       LYS  51 -10.043 -10.348  -6.418
  406   1HE   LYS  51          2HE       LYS  51 -11.613 -11.105  -4.487
  407   2HE   LYS  51          1HE       LYS  51 -12.223  -9.453  -4.576
  408   1HZ   LYS  51          1HZ       LYS  51 -13.171 -11.455  -6.042
  409   2HZ   LYS  51          2HZ       LYS  51 -11.996 -10.861  -7.105
  410   3HZ   LYS  51          3HZ       LYS  51 -13.217  -9.838  -6.537
  411    H    ALA  52           H        ALA  52  -5.314 -12.226  -5.542
  412    HA   ALA  52           HA       ALA  52  -6.500 -14.644  -6.692
  413   1HB   ALA  52          1HB       ALA  52  -6.691 -13.018  -8.443
  414   2HB   ALA  52          2HB       ALA  52  -5.379 -14.122  -8.858
  415   3HB   ALA  52          3HB       ALA  52  -5.015 -12.516  -8.224
  416    H    LEU  53           H        LEU  53  -4.873 -14.635  -4.487
  417    HA   LEU  53           HA       LEU  53  -2.117 -14.914  -5.076
  418   1HB   LEU  53          2HB       LEU  53  -2.900 -14.451  -2.826
  419   2HB   LEU  53          1HB       LEU  53  -3.761 -15.977  -2.781
  420    HG   LEU  53           HG       LEU  53  -1.226 -16.832  -3.289
  421   1HD1  LEU  53          1HD1      LEU  53  -1.062 -14.174  -2.022
  422   2HD1  LEU  53          2HD1      LEU  53   0.110 -15.033  -3.020
  423   3HD1  LEU  53          3HD1      LEU  53  -0.063 -15.443  -1.314
  424   1HD2  LEU  53          1HD2      LEU  53  -2.943 -17.520  -1.534
  425   2HD2  LEU  53          2HD2      LEU  53  -2.189 -16.312  -0.494
  426   3HD2  LEU  53          3HD2      LEU  53  -1.241 -17.670  -1.099
  427    HA   PRO  54           HA       PRO  54  -2.546 -18.843  -7.265
  428   1HB   PRO  54          2HB       PRO  54   0.413 -18.731  -7.039
  429   2HB   PRO  54          1HB       PRO  54  -0.599 -18.970  -8.467
  430   1HG   PRO  54          2HG       PRO  54   0.642 -16.649  -8.046
  431   2HG   PRO  54          1HG       PRO  54  -0.993 -16.701  -8.731
  432   1HD   PRO  54          2HD       PRO  54  -0.122 -16.041  -5.947
  433   2HD   PRO  54          1HD       PRO  54  -1.407 -15.310  -6.931
  434    H    THR  55           H        THR  55  -0.656 -20.835  -6.940
  435    HA   THR  55           HA       THR  55  -1.091 -21.585  -4.131
  436    HB   THR  55           HB       THR  55  -0.244 -23.804  -5.736
  437    HG1  THR  55           1HG      THR  55  -1.344 -23.586  -7.494
  438   1HG2  THR  55          1HG2      THR  55  -2.914 -24.181  -5.271
  439   2HG2  THR  55          2HG2      THR  55  -2.430 -23.117  -3.951
  440   3HG2  THR  55          3HG2      THR  55  -1.599 -24.653  -4.196
  441    H    GLU  56           H        GLU  56   1.288 -22.264  -6.706
  442    HA   GLU  56           HA       GLU  56   3.369 -22.455  -4.658
  443   1HB   GLU  56          2HB       GLU  56   2.842 -23.878  -7.038
  444   2HB   GLU  56          1HB       GLU  56   4.325 -22.978  -7.323
  445   1HG   GLU  56          2HG       GLU  56   5.397 -23.996  -5.463
  446   2HG   GLU  56          1HG       GLU  56   3.885 -24.716  -4.911
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1   5.345  21.965   9.111
    2   2H    MET   1          2HT       MET   1   5.343  22.879   7.658
    3   3H    MET   1          3HT       MET   1   5.275  21.159   7.593
    4    HA   MET   1           HA       MET   1   3.145  21.085   8.404
    5   1HB   MET   1          2HB       MET   1   3.975  23.590   9.605
    6   2HB   MET   1          1HB       MET   1   2.392  23.753   8.856
    7   1HG   MET   1          2HG       MET   1   1.775  23.067  10.936
    8   2HG   MET   1          1HG       MET   1   1.917  21.506  10.130
    9   1HE   MET   1          1HE       MET   1   3.217  20.499  13.600
   10   2HE   MET   1          2HE       MET   1   1.921  20.408  12.403
   11   3HE   MET   1          3HE       MET   1   2.065  21.819  13.450
   12    H    GLU   2           H        GLU   2   2.845  20.611   6.216
   13    HA   GLU   2           HA       GLU   2   1.195  22.351   4.771
   14   1HB   GLU   2          2HB       GLU   2   3.668  23.300   4.537
   15   2HB   GLU   2          1HB       GLU   2   3.745  22.078   3.271
   16   1HG   GLU   2          2HG       GLU   2   2.770  23.503   1.893
   17   2HG   GLU   2          1HG       GLU   2   1.325  23.449   2.898
   18    H    ALA   3           H        ALA   3   3.536  19.719   4.585
   19    HA   ALA   3           HA       ALA   3   1.565  18.026   3.325
   20   1HB   ALA   3          1HB       ALA   3   2.833  19.377   1.502
   21   2HB   ALA   3          2HB       ALA   3   2.592  17.641   1.290
   22   3HB   ALA   3          3HB       ALA   3   4.153  18.258   1.841
   23    H    VAL   4           H        VAL   4   1.721  16.111   4.262
   24    HA   VAL   4           HA       VAL   4   4.295  14.882   4.750
   25    HB   VAL   4           HB       VAL   4   3.673  14.377   7.159
   26   1HG1  VAL   4          1HG1      VAL   4   4.881  16.200   7.948
   27   2HG1  VAL   4          2HG1      VAL   4   4.163  17.309   6.781
   28   3HG1  VAL   4          3HG1      VAL   4   5.357  16.124   6.251
   29   1HG2  VAL   4          1HG2      VAL   4   1.331  15.074   7.016
   30   2HG2  VAL   4          2HG2      VAL   4   1.842  16.737   6.741
   31   3HG2  VAL   4          3HG2      VAL   4   2.191  15.951   8.283
   32    H    ASP   5           H        ASP   5   1.899  14.364   3.148
   33    HA   ASP   5           HA       ASP   5   0.276  12.364   4.231
   34   1HB   ASP   5          2HB       ASP   5  -0.228  11.752   1.902
   35   2HB   ASP   5          1HB       ASP   5  -0.254  13.498   2.128
   36    H    ALA   6           H        ALA   6   3.566  12.259   3.235
   37    HA   ALA   6           HA       ALA   6   3.928   9.640   2.441
   38   1HB   ALA   6          1HB       ALA   6   5.892  10.743   2.233
   39   2HB   ALA   6          2HB       ALA   6   6.204  10.045   3.823
   40   3HB   ALA   6          3HB       ALA   6   5.632  11.709   3.685
   41    H    ASN   7           H        ASN   7   3.495  10.924   5.690
   42    HA   ASN   7           HA       ASN   7   4.250   8.604   7.107
   43   1HB   ASN   7          2HB       ASN   7   3.284  11.192   7.741
   44   2HB   ASN   7          1HB       ASN   7   2.184  10.039   8.503
   45   1HD2  ASN   7          1HD2      ASN   7   5.675   9.932   7.887
   46   2HD2  ASN   7          2HD2      ASN   7   6.134   9.711   9.537
   47    H    SER   8           H        SER   8   1.081   9.782   6.017
   48    HA   SER   8           HA       SER   8  -0.330   7.498   6.989
   49   1HB   SER   8          2HB       SER   8  -1.327   9.795   6.543
   50   2HB   SER   8          1HB       SER   8  -1.261   9.395   4.826
   51    HG   SER   8           HG       SER   8  -3.226   8.710   5.385
   52    H    LEU   9           H        LEU   9   1.223   8.397   4.001
   53    HA   LEU   9           HA       LEU   9   0.126   6.349   2.370
   54   1HB   LEU   9          2HB       LEU   9   1.241   8.453   1.575
   55   2HB   LEU   9          1HB       LEU   9   2.777   7.764   2.060
   56    HG   LEU   9           HG       LEU   9   0.965   6.516  -0.001
   57   1HD1  LEU   9          1HD1      LEU   9   3.360   8.284  -0.371
   58   2HD1  LEU   9          2HD1      LEU   9   1.693   8.682  -0.783
   59   3HD1  LEU   9          3HD1      LEU   9   2.538   7.403  -1.655
   60   1HD2  LEU   9          1HD2      LEU   9   3.465   5.647  -0.520
   61   2HD2  LEU   9          2HD2      LEU   9   2.300   4.774   0.476
   62   3HD2  LEU   9          3HD2      LEU   9   3.525   5.789   1.237
   63    H    ALA  10           H        ALA  10   3.129   6.672   4.222
   64    HA   ALA  10           HA       ALA  10   4.289   4.223   3.478
   65   1HB   ALA  10          1HB       ALA  10   5.923   4.661   5.061
   66   2HB   ALA  10          2HB       ALA  10   4.800   5.494   6.136
   67   3HB   ALA  10          3HB       ALA  10   5.333   6.271   4.646
   68    H    GLN  11           H        GLN  11   1.699   4.893   5.632
   69    HA   GLN  11           HA       GLN  11   2.037   2.531   7.239
   70   1HB   GLN  11          2HB       GLN  11   1.000   4.380   8.315
   71   2HB   GLN  11          1HB       GLN  11  -0.160   4.576   7.006
   72   1HG   GLN  11          2HG       GLN  11  -1.102   2.383   7.581
   73   2HG   GLN  11          1HG       GLN  11  -0.024   2.305   8.967
   74   1HE2  GLN  11          1HE2      GLN  11  -1.409   2.434  10.621
   75   2HE2  GLN  11          2HE2      GLN  11  -2.514   3.742  10.896
   76    H    ALA  12           H        ALA  12  -0.007   3.536   4.532
   77    HA   ALA  12           HA       ALA  12  -1.722   1.365   4.416
   78   1HB   ALA  12          1HB       ALA  12  -2.317   2.141   2.371
   79   2HB   ALA  12          2HB       ALA  12  -0.644   2.335   1.841
   80   3HB   ALA  12          3HB       ALA  12  -1.381   3.539   2.901
   81    H    LYS  13           H        LYS  13   1.589   1.704   3.326
   82    HA   LYS  13           HA       LYS  13   1.657  -0.995   2.248
   83   1HB   LYS  13          2HB       LYS  13   4.211  -0.287   2.085
   84   2HB   LYS  13          1HB       LYS  13   3.019   0.245   0.918
   85   1HG   LYS  13          2HG       LYS  13   2.967   2.389   1.719
   86   2HG   LYS  13          1HG       LYS  13   3.585   1.916   3.308
   87   1HD   LYS  13          2HD       LYS  13   5.756   1.945   2.613
   88   2HD   LYS  13          1HD       LYS  13   5.345   1.411   0.982
   89   1HE   LYS  13          2HE       LYS  13   5.306   3.499   0.215
   90   2HE   LYS  13          1HE       LYS  13   4.281   4.040   1.541
   91   1HZ   LYS  13          1HZ       LYS  13   6.032   4.802   2.699
   92   2HZ   LYS  13          2HZ       LYS  13   6.792   4.847   1.189
   93   3HZ   LYS  13          3HZ       LYS  13   7.054   3.538   2.228
   94    H    GLU  14           H        GLU  14   3.316   0.846   4.823
   95    HA   GLU  14           HA       GLU  14   4.779  -1.202   5.962
   96   1HB   GLU  14          2HB       GLU  14   3.523   1.296   7.021
   97   2HB   GLU  14          1HB       GLU  14   4.120   0.120   8.185
   98   1HG   GLU  14          2HG       GLU  14   6.205   0.329   6.414
   99   2HG   GLU  14          1HG       GLU  14   5.579   1.975   6.487
  100    H    ALA  15           H        ALA  15   1.407  -0.371   6.226
  101    HA   ALA  15           HA       ALA  15   0.805  -2.427   8.173
  102   1HB   ALA  15          1HB       ALA  15  -1.394  -1.633   8.139
  103   2HB   ALA  15          2HB       ALA  15  -1.231  -0.982   6.508
  104   3HB   ALA  15          3HB       ALA  15  -0.419  -0.190   7.858
  105    H    ALA  16           H        ALA  16   0.191  -1.895   4.707
  106    HA   ALA  16           HA       ALA  16  -1.167  -4.299   4.196
  107   1HB   ALA  16          1HB       ALA  16  -0.306  -3.915   1.810
  108   2HB   ALA  16          2HB       ALA  16   0.418  -2.438   2.447
  109   3HB   ALA  16          3HB       ALA  16  -1.329  -2.668   2.523
  110    H    ILE  17           H        ILE  17   2.183  -3.601   4.665
  111    HA   ILE  17           HA       ILE  17   3.225  -5.945   3.416
  112    HB   ILE  17           HB       ILE  17   4.280  -3.633   4.820
  113   1HG1  ILE  17          2HG1      ILE  17   6.285  -5.039   3.376
  114   2HG1  ILE  17          1HG1      ILE  17   4.776  -5.201   2.482
  115   1HG2  ILE  17          1HG2      ILE  17   6.349  -4.748   5.658
  116   2HG2  ILE  17          2HG2      ILE  17   5.519  -6.294   5.481
  117   3HG2  ILE  17          3HG2      ILE  17   4.899  -5.082   6.603
  118   1HD1  ILE  17          1HD1      ILE  17   5.236  -3.217   1.611
  119   2HD1  ILE  17          2HD1      ILE  17   6.516  -2.914   2.787
  120   3HD1  ILE  17          3HD1      ILE  17   4.841  -2.534   3.188
  121    H    LYS  18           H        LYS  18   2.187  -5.062   6.648
  122    HA   LYS  18           HA       LYS  18   3.175  -7.229   8.095
  123   1HB   LYS  18          2HB       LYS  18   1.255  -5.116   8.473
  124   2HB   LYS  18          1HB       LYS  18   0.628  -6.617   9.145
  125   1HG   LYS  18          2HG       LYS  18   2.132  -6.653  10.818
  126   2HG   LYS  18          1HG       LYS  18   3.428  -6.002   9.812
  127   1HD   LYS  18          2HD       LYS  18   2.369  -3.772   9.962
  128   2HD   LYS  18          1HD       LYS  18   1.155  -4.449  11.049
  129   1HE   LYS  18          2HE       LYS  18   2.577  -4.524  12.801
  130   2HE   LYS  18          1HE       LYS  18   3.956  -4.962  11.795
  131   1HZ   LYS  18          1HZ       LYS  18   4.547  -2.863  12.371
  132   2HZ   LYS  18          2HZ       LYS  18   2.955  -2.316  12.527
  133   3HZ   LYS  18          3HZ       LYS  18   3.642  -2.490  10.992
  134    H    GLU  19           H        GLU  19   0.360  -6.939   6.027
  135    HA   GLU  19           HA       GLU  19  -0.765  -9.467   6.756
  136   1HB   GLU  19          2HB       GLU  19  -1.375  -7.305   4.869
  137   2HB   GLU  19          1HB       GLU  19  -1.772  -8.903   4.255
  138   1HG   GLU  19          2HG       GLU  19  -3.682  -8.736   5.359
  139   2HG   GLU  19          1HG       GLU  19  -2.747  -8.922   6.843
  140    H    LEU  20           H        LEU  20   1.341  -8.298   4.172
  141    HA   LEU  20           HA       LEU  20   1.403 -10.678   2.672
  142   1HB   LEU  20          2HB       LEU  20   2.612  -8.147   2.535
  143   2HB   LEU  20          1HB       LEU  20   3.937  -9.297   2.601
  144    HG   LEU  20           HG       LEU  20   2.153 -10.381   0.758
  145   1HD1  LEU  20          1HD1      LEU  20   0.905  -8.662   0.064
  146   2HD1  LEU  20          2HD1      LEU  20   2.361  -8.160  -0.795
  147   3HD1  LEU  20          3HD1      LEU  20   1.981  -7.462   0.781
  148   1HD2  LEU  20          1HD2      LEU  20   3.937 -10.317  -0.675
  149   2HD2  LEU  20          2HD2      LEU  20   4.747 -10.141   0.880
  150   3HD2  LEU  20          3HD2      LEU  20   4.459  -8.724  -0.129
  151    H    LYS  21           H        LYS  21   3.062  -9.638   5.552
  152    HA   LYS  21           HA       LYS  21   4.937 -11.836   5.534
  153   1HB   LYS  21          2HB       LYS  21   5.570  -9.687   6.536
  154   2HB   LYS  21          1HB       LYS  21   4.258  -9.832   7.698
  155   1HG   LYS  21          2HG       LYS  21   5.622 -12.172   8.072
  156   2HG   LYS  21          1HG       LYS  21   6.917 -11.031   7.707
  157   1HD   LYS  21          2HD       LYS  21   6.814 -10.466   9.869
  158   2HD   LYS  21          1HD       LYS  21   5.327  -9.615   9.447
  159   1HE   LYS  21          2HE       LYS  21   5.089 -11.132  11.399
  160   2HE   LYS  21          1HE       LYS  21   3.994 -11.511  10.070
  161   1HZ   LYS  21          1HZ       LYS  21   6.548 -12.897  10.052
  162   2HZ   LYS  21          2HZ       LYS  21   5.001 -13.472   9.682
  163   3HZ   LYS  21          3HZ       LYS  21   5.485 -13.329  11.296
  164    H    GLN  22           H        GLN  22   1.893 -10.981   7.068
  165    HA   GLN  22           HA       GLN  22   1.834 -13.232   8.833
  166   1HB   GLN  22          2HB       GLN  22   0.560 -11.192   9.312
  167   2HB   GLN  22          1HB       GLN  22  -0.404 -11.444   7.863
  168   1HG   GLN  22          2HG       GLN  22  -1.727 -12.950   8.853
  169   2HG   GLN  22          1HG       GLN  22  -0.387 -13.715   9.707
  170   1HE2  GLN  22          1HE2      GLN  22  -1.995 -10.545   9.711
  171   2HE2  GLN  22          2HE2      GLN  22  -2.161 -10.443  11.427
  172    H    TYR  23           H        TYR  23   0.772 -12.575   5.575
  173    HA   TYR  23           HA       TYR  23  -0.810 -14.959   5.313
  174   1HB   TYR  23          2HB       TYR  23   0.026 -12.716   3.552
  175   2HB   TYR  23          1HB       TYR  23  -0.348 -14.246   2.757
  176    HD1  TYR  23           1HD      TYR  23  -1.683 -11.219   3.897
  177    HD2  TYR  23           2HD      TYR  23  -2.617 -15.351   3.535
  178    HE1  TYR  23           1HE      TYR  23  -4.076 -10.679   3.994
  179    HE2  TYR  23           2HE      TYR  23  -5.013 -14.824   3.630
  180    HH   TYR  23           HH       TYR  23  -6.213 -11.643   3.339
  181    H    GLY  24           H        GLY  24   2.418 -13.907   4.327
  182   1HA   GLY  24          2HA       GLY  24   4.229 -15.530   4.424
  183   2HA   GLY  24          1HA       GLY  24   3.092 -16.739   3.851
  184    H    ILE  25           H        ILE  25   2.323 -14.097   2.096
  185    HA   ILE  25           HA       ILE  25   3.200 -15.063  -0.334
  186    HB   ILE  25           HB       ILE  25   3.203 -12.123  -0.270
  187   1HG1  ILE  25          2HG1      ILE  25   0.760 -13.659   0.645
  188   2HG1  ILE  25          1HG1      ILE  25   1.617 -12.406   1.537
  189   1HG2  ILE  25          1HG2      ILE  25   2.948 -12.875  -2.385
  190   2HG2  ILE  25          2HG2      ILE  25   1.239 -12.825  -1.942
  191   3HG2  ILE  25          3HG2      ILE  25   2.122 -14.349  -1.883
  192   1HD1  ILE  25          1HD1      ILE  25   1.007 -10.948  -0.554
  193   2HD1  ILE  25          2HD1      ILE  25  -0.160 -11.220   0.740
  194   3HD1  ILE  25          3HD1      ILE  25  -0.260 -12.157  -0.750
  195    H    GLY  26           H        GLY  26   4.740 -13.757  -1.872
  196   1HA   GLY  26          2HA       GLY  26   7.361 -13.981  -0.701
  197   2HA   GLY  26          1HA       GLY  26   6.991 -13.595  -2.379
  198    H    ASP  27           H        ASP  27   8.984 -12.382  -0.699
  199    HA   ASP  27           HA       ASP  27   8.173  -9.876   0.301
  200   1HB   ASP  27          2HB       ASP  27  10.645  -9.292  -0.029
  201   2HB   ASP  27          1HB       ASP  27  10.293 -10.673   1.007
  202    H    TYR  28           H        TYR  28   8.729 -11.004  -2.917
  203    HA   TYR  28           HA       TYR  28   9.424  -8.758  -4.344
  204   1HB   TYR  28          2HB       TYR  28   8.562 -11.236  -5.048
  205   2HB   TYR  28          1HB       TYR  28   7.140 -10.284  -5.464
  206    HD1  TYR  28           1HD      TYR  28   9.117 -11.815  -7.330
  207    HD2  TYR  28           2HD      TYR  28   8.754  -7.746  -6.153
  208    HE1  TYR  28           1HE      TYR  28  10.181 -11.114  -9.434
  209    HE2  TYR  28           2HE      TYR  28   9.811  -7.035  -8.240
  210    HH   TYR  28           HH       TYR  28  11.383  -8.035  -9.951
  211    H    TYR  29           H        TYR  29   6.227  -9.724  -3.260
  212    HA   TYR  29           HA       TYR  29   4.960  -7.383  -4.279
  213   1HB   TYR  29          2HB       TYR  29   3.805  -9.400  -2.352
  214   2HB   TYR  29          1HB       TYR  29   2.926  -8.309  -3.417
  215    HD1  TYR  29           1HD      TYR  29   5.035  -8.714  -5.735
  216    HD2  TYR  29           2HD      TYR  29   2.701 -11.370  -3.350
  217    HE1  TYR  29           1HE      TYR  29   5.157 -10.417  -7.504
  218    HE2  TYR  29           2HE      TYR  29   2.804 -13.066  -5.129
  219    HH   TYR  29           HH       TYR  29   3.471 -12.532  -8.146
  220    H    ILE  30           H        ILE  30   6.503  -8.082  -1.249
  221    HA   ILE  30           HA       ILE  30   5.095  -6.017   0.184
  222    HB   ILE  30           HB       ILE  30   6.365  -6.498   2.005
  223   1HG1  ILE  30          2HG1      ILE  30   8.786  -7.441   1.744
  224   2HG1  ILE  30          1HG1      ILE  30   8.663  -6.768   0.121
  225   1HG2  ILE  30          1HG2      ILE  30   6.434  -8.900   0.282
  226   2HG2  ILE  30          2HG2      ILE  30   5.584  -8.606   1.796
  227   3HG2  ILE  30          3HG2      ILE  30   7.316  -8.926   1.806
  228   1HD1  ILE  30          1HD1      ILE  30   7.762  -4.719   1.687
  229   2HD1  ILE  30          2HD1      ILE  30   9.397  -4.881   1.042
  230   3HD1  ILE  30          3HD1      ILE  30   9.034  -5.436   2.678
  231    H    LYS  31           H        LYS  31   7.920  -6.352  -1.794
  232    HA   LYS  31           HA       LYS  31   8.922  -3.693  -1.356
  233   1HB   LYS  31          2HB       LYS  31   9.951  -6.081  -2.351
  234   2HB   LYS  31          1HB       LYS  31   9.881  -5.025  -3.752
  235   1HG   LYS  31          2HG       LYS  31  11.726  -3.998  -3.092
  236   2HG   LYS  31          1HG       LYS  31  10.952  -3.545  -1.572
  237   1HD   LYS  31          2HD       LYS  31  12.285  -6.203  -2.088
  238   2HD   LYS  31          1HD       LYS  31  13.059  -4.837  -1.280
  239   1HE   LYS  31          2HE       LYS  31  10.442  -5.908  -0.294
  240   2HE   LYS  31          1HE       LYS  31  11.955  -6.700   0.145
  241   1HZ   LYS  31          1HZ       LYS  31  11.133  -3.916   0.742
  242   2HZ   LYS  31          2HZ       LYS  31  12.719  -4.467   0.942
  243   3HZ   LYS  31          3HZ       LYS  31  11.465  -5.157   1.844
  244    H    LEU  32           H        LEU  32   7.390  -5.418  -4.083
  245    HA   LEU  32           HA       LEU  32   7.313  -3.353  -5.892
  246   1HB   LEU  32          2HB       LEU  32   6.141  -4.794  -7.160
  247   2HB   LEU  32          1HB       LEU  32   6.395  -5.913  -5.844
  248    HG   LEU  32           HG       LEU  32   4.126  -6.083  -6.376
  249   1HD1  LEU  32          1HD1      LEU  32   3.548  -6.026  -4.245
  250   2HD1  LEU  32          2HD1      LEU  32   3.499  -4.261  -4.261
  251   3HD1  LEU  32          3HD1      LEU  32   5.021  -5.099  -3.934
  252   1HD2  LEU  32          1HD2      LEU  32   4.326  -3.619  -7.470
  253   2HD2  LEU  32          2HD2      LEU  32   3.420  -3.247  -6.002
  254   3HD2  LEU  32          3HD2      LEU  32   2.794  -4.431  -7.149
  255    H    ILE  33           H        ILE  33   5.649  -3.631  -2.939
  256    HA   ILE  33           HA       ILE  33   3.482  -1.844  -3.483
  257    HB   ILE  33           HB       ILE  33   4.619  -3.200  -1.079
  258   1HG1  ILE  33          2HG1      ILE  33   1.925  -2.994  -2.403
  259   2HG1  ILE  33          1HG1      ILE  33   2.965  -4.405  -2.262
  260   1HG2  ILE  33          1HG2      ILE  33   2.406  -1.551  -0.273
  261   2HG2  ILE  33          2HG2      ILE  33   3.739  -0.556  -0.844
  262   3HG2  ILE  33          3HG2      ILE  33   4.003  -1.718   0.450
  263   1HD1  ILE  33          1HD1      ILE  33   0.830  -3.662  -0.613
  264   2HD1  ILE  33          2HD1      ILE  33   2.293  -3.454   0.349
  265   3HD1  ILE  33          3HD1      ILE  33   1.945  -5.010  -0.401
  266    H    ASN  34           H        ASN  34   6.446  -1.574  -1.527
  267    HA   ASN  34           HA       ASN  34   6.284   1.109  -0.886
  268   1HB   ASN  34          2HB       ASN  34   8.027  -0.828  -0.296
  269   2HB   ASN  34          1HB       ASN  34   8.978   0.017  -1.514
  270   1HD2  ASN  34          1HD2      ASN  34  10.497   0.891  -0.216
  271   2HD2  ASN  34          2HD2      ASN  34  10.168   2.053   1.019
  272    H    ASN  35           H        ASN  35   7.045  -0.328  -3.941
  273    HA   ASN  35           HA       ASN  35   8.493   1.822  -5.075
  274   1HB   ASN  35          2HB       ASN  35   7.091  -0.590  -6.118
  275   2HB   ASN  35          1HB       ASN  35   7.480   0.691  -7.262
  276   1HD2  ASN  35          1HD2      ASN  35   9.655   1.224  -7.624
  277   2HD2  ASN  35          2HD2      ASN  35  10.928   0.123  -7.237
  278    H    ALA  36           H        ALA  36   5.085   1.230  -4.636
  279    HA   ALA  36           HA       ALA  36   4.015   2.920  -6.574
  280   1HB   ALA  36          1HB       ALA  36   3.071   1.623  -4.162
  281   2HB   ALA  36          2HB       ALA  36   2.235   1.931  -5.682
  282   3HB   ALA  36          3HB       ALA  36   2.290   3.181  -4.438
  283    H    LYS  37           H        LYS  37   3.427   5.058  -6.627
  284    HA   LYS  37           HA       LYS  37   4.986   6.809  -4.921
  285   1HB   LYS  37          2HB       LYS  37   3.682   7.001  -7.562
  286   2HB   LYS  37          1HB       LYS  37   3.660   8.477  -6.607
  287   1HG   LYS  37          2HG       LYS  37   5.579   8.347  -8.136
  288   2HG   LYS  37          1HG       LYS  37   6.063   8.454  -6.442
  289   1HD   LYS  37          2HD       LYS  37   7.411   6.806  -7.639
  290   2HD   LYS  37          1HD       LYS  37   6.430   6.037  -6.393
  291   1HE   LYS  37          2HE       LYS  37   5.509   4.713  -7.912
  292   2HE   LYS  37          1HE       LYS  37   4.941   6.112  -8.822
  293   1HZ   LYS  37          1HZ       LYS  37   6.978   6.168 -10.033
  294   2HZ   LYS  37          2HZ       LYS  37   6.386   4.592 -10.107
  295   3HZ   LYS  37          3HZ       LYS  37   7.668   4.964  -9.068
  296    H    THR  38           H        THR  38   1.643   6.036  -5.620
  297    HA   THR  38           HA       THR  38   0.677   8.065  -3.760
  298    HB   THR  38           HB       THR  38  -1.511   7.573  -4.574
  299    HG1  THR  38           1HG      THR  38  -0.443   5.324  -5.924
  300   1HG2  THR  38          1HG2      THR  38  -0.598   8.839  -6.254
  301   2HG2  THR  38          2HG2      THR  38  -1.143   7.407  -7.130
  302   3HG2  THR  38          3HG2      THR  38   0.558   7.596  -6.718
  303    H    VAL  39           H        VAL  39  -1.650   6.485  -2.918
  304    HA   VAL  39           HA       VAL  39  -0.346   4.417  -1.308
  305    HB   VAL  39           HB       VAL  39  -0.764   6.702  -0.106
  306   1HG1  VAL  39          1HG1      VAL  39  -3.393   5.321   0.331
  307   2HG1  VAL  39          2HG1      VAL  39  -3.178   6.744  -0.687
  308   3HG1  VAL  39          3HG1      VAL  39  -2.845   6.838   1.045
  309   1HG2  VAL  39          1HG2      VAL  39   0.213   5.026   1.119
  310   2HG2  VAL  39          2HG2      VAL  39  -1.108   3.902   0.819
  311   3HG2  VAL  39          3HG2      VAL  39  -1.322   5.221   1.968
  312    H    GLU  40           H        GLU  40  -3.429   5.745  -2.436
  313    HA   GLU  40           HA       GLU  40  -5.166   3.799  -1.577
  314   1HB   GLU  40          2HB       GLU  40  -5.488   5.956  -3.088
  315   2HB   GLU  40          1HB       GLU  40  -5.461   4.765  -4.381
  316   1HG   GLU  40          2HG       GLU  40  -7.710   4.963  -3.913
  317   2HG   GLU  40          1HG       GLU  40  -7.244   3.537  -2.983
  318    H    GLY  41           H        GLY  41  -2.897   3.647  -4.252
  319   1HA   GLY  41          2HA       GLY  41  -3.899   1.077  -5.147
  320   2HA   GLY  41          1HA       GLY  41  -2.512   1.944  -5.796
  321    H    VAL  42           H        VAL  42  -1.302   2.315  -3.167
  322    HA   VAL  42           HA       VAL  42   0.401   0.126  -3.079
  323    HB   VAL  42           HB       VAL  42  -0.239   1.972  -0.779
  324   1HG1  VAL  42          1HG1      VAL  42   0.990   0.186   0.085
  325   2HG1  VAL  42          2HG1      VAL  42   2.211   1.418  -0.270
  326   3HG1  VAL  42          3HG1      VAL  42   1.983   0.057  -1.372
  327   1HG2  VAL  42          1HG2      VAL  42   0.512   2.955  -3.082
  328   2HG2  VAL  42          2HG2      VAL  42   2.088   2.318  -2.616
  329   3HG2  VAL  42          3HG2      VAL  42   1.284   3.504  -1.594
  330    H    GLU  43           H        GLU  43  -2.370   0.851  -0.972
  331    HA   GLU  43           HA       GLU  43  -2.107  -1.510   0.585
  332   1HB   GLU  43          2HB       GLU  43  -4.688  -0.916   0.980
  333   2HB   GLU  43          1HB       GLU  43  -3.383  -0.036   1.760
  334   1HG   GLU  43          2HG       GLU  43  -3.547   1.751   0.214
  335   2HG   GLU  43          1HG       GLU  43  -4.633   0.833  -0.831
  336    H    SER  44           H        SER  44  -4.495  -0.650  -1.916
  337    HA   SER  44           HA       SER  44  -5.679  -3.182  -2.083
  338   1HB   SER  44          2HB       SER  44  -6.084  -0.702  -3.249
  339   2HB   SER  44          1HB       SER  44  -5.641  -1.728  -4.615
  340    HG   SER  44           HG       SER  44  -7.526  -2.631  -4.482
  341    H    LEU  45           H        LEU  45  -2.695  -1.967  -3.291
  342    HA   LEU  45           HA       LEU  45  -2.194  -3.581  -5.493
  343   1HB   LEU  45          2HB       LEU  45  -0.648  -2.005  -3.605
  344   2HB   LEU  45          1HB       LEU  45   0.234  -3.425  -4.118
  345   1HD1  LEU  45          1HD1      LEU  45   0.658  -3.222  -7.244
  346   2HD1  LEU  45          2HD1      LEU  45   1.439  -3.466  -5.681
  347   3HD1  LEU  45          3HD1      LEU  45   1.792  -2.020  -6.627
  348   1HD2  LEU  45          1HD2      LEU  45  -1.103  -0.873  -7.204
  349   2HD2  LEU  45          2HD2      LEU  45  -2.199  -1.679  -6.081
  350   3HD2  LEU  45          3HD2      LEU  45  -1.352  -2.616  -7.312
  351    H    LYS  46           H        LYS  46  -1.194  -4.216  -2.128
  352    HA   LYS  46           HA       LYS  46  -0.442  -6.902  -2.681
  353   1HB   LYS  46          2HB       LYS  46   0.663  -6.379  -0.804
  354   2HB   LYS  46          1HB       LYS  46  -0.468  -5.107  -0.370
  355   1HG   LYS  46          2HG       LYS  46  -1.181  -7.986   0.057
  356   2HG   LYS  46          1HG       LYS  46  -0.135  -7.135   1.201
  357   1HD   LYS  46          2HD       LYS  46  -1.917  -5.364   1.355
  358   2HD   LYS  46          1HD       LYS  46  -2.966  -6.438   0.435
  359   1HE   LYS  46          2HE       LYS  46  -3.213  -7.906   2.153
  360   2HE   LYS  46          1HE       LYS  46  -1.617  -7.560   2.819
  361   1HZ   LYS  46          1HZ       LYS  46  -3.833  -6.726   3.961
  362   2HZ   LYS  46          2HZ       LYS  46  -3.595  -5.418   2.917
  363   3HZ   LYS  46          3HZ       LYS  46  -2.398  -5.834   4.036
  364    H    ASN  47           H        ASN  47  -3.330  -5.410  -1.278
  365    HA   ASN  47           HA       ASN  47  -4.650  -7.785  -0.573
  366   1HB   ASN  47          2HB       ASN  47  -5.334  -5.443   0.086
  367   2HB   ASN  47          1HB       ASN  47  -5.982  -5.238  -1.540
  368   1HD2  ASN  47          1HD2      ASN  47  -6.503  -6.495   1.582
  369   2HD2  ASN  47          2HD2      ASN  47  -8.057  -7.194   1.295
  370    H    GLU  48           H        GLU  48  -4.183  -6.219  -3.630
  371    HA   GLU  48           HA       GLU  48  -6.211  -7.735  -5.011
  372   1HB   GLU  48          2HB       GLU  48  -4.120  -5.751  -5.783
  373   2HB   GLU  48          1HB       GLU  48  -4.724  -6.831  -7.031
  374   1HG   GLU  48          2HG       GLU  48  -7.039  -5.971  -5.895
  375   2HG   GLU  48          1HG       GLU  48  -6.007  -4.550  -5.728
  376    H    ILE  49           H        ILE  49  -2.760  -7.907  -4.459
  377    HA   ILE  49           HA       ILE  49  -2.198 -10.018  -6.268
  378    HB   ILE  49           HB       ILE  49  -0.089 -10.231  -5.207
  379   1HG1  ILE  49          2HG1      ILE  49  -0.719  -8.528  -2.860
  380   2HG1  ILE  49          1HG1      ILE  49  -1.302 -10.179  -2.817
  381   1HG2  ILE  49          1HG2      ILE  49  -1.060  -7.768  -6.013
  382   2HG2  ILE  49          2HG2      ILE  49   0.632  -8.240  -5.856
  383   3HG2  ILE  49          3HG2      ILE  49  -0.186  -7.432  -4.520
  384   1HD1  ILE  49          1HD1      ILE  49   0.793 -11.042  -2.684
  385   2HD1  ILE  49          2HD1      ILE  49   1.010  -9.508  -1.837
  386   3HD1  ILE  49          3HD1      ILE  49   1.524  -9.670  -3.515
  387    H    LEU  50           H        LEU  50  -3.501  -9.830  -3.085
  388    HA   LEU  50           HA       LEU  50  -3.212 -12.620  -2.473
  389   1HB   LEU  50          2HB       LEU  50  -4.692 -10.338  -1.172
  390   2HB   LEU  50          1HB       LEU  50  -4.707 -11.971  -0.528
  391    HG   LEU  50           HG       LEU  50  -2.040 -10.812  -1.057
  392   1HD1  LEU  50          1HD1      LEU  50  -3.045  -8.855  -0.167
  393   2HD1  LEU  50          2HD1      LEU  50  -2.098  -9.601   1.123
  394   3HD1  LEU  50          3HD1      LEU  50  -3.854  -9.775   1.104
  395   1HD2  LEU  50          1HD2      LEU  50  -1.799 -12.823  -0.032
  396   2HD2  LEU  50          2HD2      LEU  50  -3.337 -12.696   0.825
  397   3HD2  LEU  50          3HD2      LEU  50  -1.928 -11.810   1.408
  398    H    LYS  51           H        LYS  51  -5.636 -10.517  -3.862
  399    HA   LYS  51           HA       LYS  51  -7.855 -12.243  -3.637
  400   1HB   LYS  51          2HB       LYS  51  -7.532  -9.716  -4.537
  401   2HB   LYS  51          1HB       LYS  51  -7.634 -10.565  -6.074
  402   1HG   LYS  51          2HG       LYS  51  -9.824  -9.907  -5.593
  403   2HG   LYS  51          1HG       LYS  51  -9.761 -11.621  -5.178
  404   1HD   LYS  51          2HD       LYS  51 -10.494 -11.114  -3.140
  405   2HD   LYS  51          1HD       LYS  51  -9.003 -10.212  -2.861
  406   1HE   LYS  51          2HE       LYS  51 -10.679  -8.650  -2.438
  407   2HE   LYS  51          1HE       LYS  51 -10.178  -8.286  -4.088
  408   1HZ   LYS  51          1HZ       LYS  51 -12.516  -9.976  -3.388
  409   2HZ   LYS  51          2HZ       LYS  51 -12.070  -9.449  -4.929
  410   3HZ   LYS  51          3HZ       LYS  51 -12.605  -8.336  -3.774
  411    H    ALA  52           H        ALA  52  -5.028 -12.324  -5.578
  412    HA   ALA  52           HA       ALA  52  -5.940 -14.776  -6.845
  413   1HB   ALA  52          1HB       ALA  52  -4.901 -12.430  -8.430
  414   2HB   ALA  52          2HB       ALA  52  -6.538 -13.085  -8.477
  415   3HB   ALA  52          3HB       ALA  52  -5.186 -14.047  -9.073
  416    H    LEU  53           H        LEU  53  -4.221 -14.843  -4.844
  417    HA   LEU  53           HA       LEU  53  -1.488 -14.608  -5.754
  418   1HB   LEU  53          2HB       LEU  53  -0.849 -15.217  -3.555
  419   2HB   LEU  53          1HB       LEU  53  -2.220 -14.137  -3.403
  420    HG   LEU  53           HG       LEU  53  -2.884 -17.014  -3.435
  421   1HD1  LEU  53          1HD1      LEU  53  -0.697 -16.647  -2.062
  422   2HD1  LEU  53          2HD1      LEU  53  -2.019 -17.601  -1.388
  423   3HD1  LEU  53          3HD1      LEU  53  -1.793 -15.927  -0.881
  424   1HD2  LEU  53          1HD2      LEU  53  -3.773 -14.517  -2.069
  425   2HD2  LEU  53          2HD2      LEU  53  -4.177 -16.082  -1.364
  426   3HD2  LEU  53          3HD2      LEU  53  -4.709 -15.688  -2.999
  427    HA   PRO  54           HA       PRO  54  -0.802 -18.650  -7.350
  428   1HB   PRO  54          2HB       PRO  54   1.590 -19.310  -6.131
  429   2HB   PRO  54          1HB       PRO  54   1.439 -18.302  -7.574
  430   1HG   PRO  54          2HG       PRO  54   1.783 -17.489  -4.718
  431   2HG   PRO  54          1HG       PRO  54   2.519 -16.800  -6.178
  432   1HD   PRO  54          2HD       PRO  54   0.458 -15.601  -4.954
  433   2HD   PRO  54          1HD       PRO  54   0.610 -15.598  -6.724
  434    H    THR  55           H        THR  55   0.347 -20.860  -6.294
  435    HA   THR  55           HA       THR  55  -1.527 -21.554  -4.156
  436    HB   THR  55           HB       THR  55  -0.478 -23.927  -4.814
  437    HG1  THR  55           1HG      THR  55  -0.316 -22.475  -7.237
  438   1HG2  THR  55          1HG2      THR  55  -2.822 -22.508  -5.563
  439   2HG2  THR  55          2HG2      THR  55  -2.570 -24.248  -5.431
  440   3HG2  THR  55          3HG2      THR  55  -2.239 -23.422  -6.954
  441    H    GLU  56           H        GLU  56  -0.798 -22.948  -2.400
  442    HA   GLU  56           HA       GLU  56   2.058 -22.683  -1.771
  443   1HB   GLU  56          2HB       GLU  56  -0.111 -21.342  -0.454
  444   2HB   GLU  56          1HB       GLU  56   0.632 -22.474   0.667
  445   1HG   GLU  56          2HG       GLU  56   2.802 -21.262  -0.491
  446   2HG   GLU  56          1HG       GLU  56   1.627 -19.950  -0.388
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1   1.676  20.822  11.157
    2   2H    MET   1          2HT       MET   1   2.154  21.301   9.581
    3   3H    MET   1          3HT       MET   1   0.980  20.067   9.788
    4    HA   MET   1           HA       MET   1  -0.617  21.518  10.507
    5   1HB   MET   1          2HB       MET   1   1.494  22.773  11.736
    6   2HB   MET   1          1HB       MET   1   1.034  23.945  10.514
    7   1HG   MET   1          2HG       MET   1  -1.151  24.143  11.378
    8   2HG   MET   1          1HG       MET   1  -0.943  22.725  12.408
    9   1HE   MET   1          1HE       MET   1   0.414  23.983  15.592
   10   2HE   MET   1          2HE       MET   1   0.356  22.592  14.499
   11   3HE   MET   1          3HE       MET   1  -1.132  23.434  14.947
   12    H    GLU   2           H        GLU   2   0.632  20.759   7.949
   13    HA   GLU   2           HA       GLU   2  -0.701  22.730   6.304
   14   1HB   GLU   2          2HB       GLU   2   2.179  22.702   6.586
   15   2HB   GLU   2          1HB       GLU   2   1.715  22.339   4.928
   16   1HG   GLU   2          2HG       GLU   2   0.758  24.399   4.601
   17   2HG   GLU   2          1HG       GLU   2   0.457  24.651   6.317
   18    H    ALA   3           H        ALA   3   1.620  20.037   5.991
   19    HA   ALA   3           HA       ALA   3  -0.323  18.281   4.861
   20   1HB   ALA   3          1HB       ALA   3   0.607  18.131   2.601
   21   2HB   ALA   3          2HB       ALA   3   1.707  19.462   2.959
   22   3HB   ALA   3          3HB       ALA   3  -0.037  19.735   2.926
   23    H    VAL   4           H        VAL   4   0.300  16.274   5.310
   24    HA   VAL   4           HA       VAL   4   3.072  15.472   5.120
   25    HB   VAL   4           HB       VAL   4   3.121  14.557   7.447
   26   1HG1  VAL   4          1HG1      VAL   4   2.871  17.561   7.251
   27   2HG1  VAL   4          2HG1      VAL   4   4.306  16.623   6.836
   28   3HG1  VAL   4          3HG1      VAL   4   3.730  16.661   8.501
   29   1HG2  VAL   4          1HG2      VAL   4   0.482  15.869   7.497
   30   2HG2  VAL   4          2HG2      VAL   4   1.489  16.091   8.925
   31   3HG2  VAL   4          3HG2      VAL   4   1.078  14.471   8.386
   32    H    ASP   5           H        ASP   5   0.634  14.738   3.800
   33    HA   ASP   5           HA       ASP   5  -0.548  12.400   4.763
   34   1HB   ASP   5          2HB       ASP   5  -1.077  11.952   2.336
   35   2HB   ASP   5          1HB       ASP   5  -1.570  13.536   2.930
   36    H    ALA   6           H        ALA   6   2.588  12.915   3.426
   37    HA   ALA   6           HA       ALA   6   3.229  10.488   2.284
   38   1HB   ALA   6          1HB       ALA   6   5.325  11.604   4.022
   39   2HB   ALA   6          2HB       ALA   6   4.616  12.739   2.874
   40   3HB   ALA   6          3HB       ALA   6   5.348  11.241   2.296
   41    H    ASN   7           H        ASN   7   2.881  11.288   5.680
   42    HA   ASN   7           HA       ASN   7   4.111   8.942   6.703
   43   1HB   ASN   7          2HB       ASN   7   3.182  11.275   7.803
   44   2HB   ASN   7          1HB       ASN   7   1.985  10.115   8.357
   45   1HD2  ASN   7          1HD2      ASN   7   2.444   9.530  10.340
   46   2HD2  ASN   7          2HD2      ASN   7   4.007   9.138  10.958
   47    H    SER   8           H        SER   8   0.724   9.843   6.111
   48    HA   SER   8           HA       SER   8  -0.408   7.422   6.997
   49   1HB   SER   8          2HB       SER   8  -1.431   9.801   6.173
   50   2HB   SER   8          1HB       SER   8  -1.793   8.797   4.777
   51    HG   SER   8           HG       SER   8  -2.906   8.800   7.268
   52    H    LEU   9           H        LEU   9   1.020   8.412   3.974
   53    HA   LEU   9           HA       LEU   9   0.076   6.337   2.325
   54   1HB   LEU   9          2HB       LEU   9   1.221   8.439   1.581
   55   2HB   LEU   9          1HB       LEU   9   2.731   7.758   2.148
   56    HG   LEU   9           HG       LEU   9   1.040   6.513  -0.012
   57   1HD1  LEU   9          1HD1      LEU   9   3.322   8.441  -0.144
   58   2HD1  LEU   9          2HD1      LEU   9   1.747   8.536  -0.931
   59   3HD1  LEU   9          3HD1      LEU   9   2.936   7.356  -1.481
   60   1HD2  LEU   9          1HD2      LEU   9   3.558   5.624  -0.389
   61   2HD2  LEU   9          2HD2      LEU   9   2.331   4.758   0.535
   62   3HD2  LEU   9          3HD2      LEU   9   3.521   5.758   1.370
   63    H    ALA  10           H        ALA  10   2.992   6.653   4.309
   64    HA   ALA  10           HA       ALA  10   4.186   4.217   3.599
   65   1HB   ALA  10          1HB       ALA  10   5.211   4.591   6.029
   66   2HB   ALA  10          2HB       ALA  10   4.537   6.199   5.763
   67   3HB   ALA  10          3HB       ALA  10   5.711   5.536   4.626
   68    H    GLN  11           H        GLN  11   1.487   4.855   5.624
   69    HA   GLN  11           HA       GLN  11   1.743   2.481   7.220
   70   1HB   GLN  11          2HB       GLN  11   0.638   4.310   8.256
   71   2HB   GLN  11          1HB       GLN  11  -0.445   4.522   6.884
   72   1HG   GLN  11          2HG       GLN  11  -1.417   2.322   7.376
   73   2HG   GLN  11          1HG       GLN  11  -0.417   2.223   8.820
   74   1HE2  GLN  11          1HE2      GLN  11  -2.530   4.632   7.277
   75   2HE2  GLN  11          2HE2      GLN  11  -3.394   5.040   8.707
   76    H    ALA  12           H        ALA  12  -0.275   3.510   4.481
   77    HA   ALA  12           HA       ALA  12  -1.913   1.306   4.234
   78   1HB   ALA  12          1HB       ALA  12  -0.736   2.322   1.723
   79   2HB   ALA  12          2HB       ALA  12  -1.526   3.510   2.764
   80   3HB   ALA  12          3HB       ALA  12  -2.430   2.111   2.178
   81    H    LYS  13           H        LYS  13   1.424   1.726   3.314
   82    HA   LYS  13           HA       LYS  13   1.622  -0.944   2.182
   83   1HB   LYS  13          2HB       LYS  13   4.178  -0.091   2.227
   84   2HB   LYS  13          1HB       LYS  13   3.049   0.299   0.942
   85   1HG   LYS  13          2HG       LYS  13   2.712   2.454   1.699
   86   2HG   LYS  13          1HG       LYS  13   3.338   2.085   3.312
   87   1HD   LYS  13          2HD       LYS  13   4.963   2.150   0.767
   88   2HD   LYS  13          1HD       LYS  13   4.922   3.428   1.982
   89   1HE   LYS  13          2HE       LYS  13   5.497   1.157   3.445
   90   2HE   LYS  13          1HE       LYS  13   6.402   0.924   1.950
   91   1HZ   LYS  13          1HZ       LYS  13   7.440   3.071   2.269
   92   2HZ   LYS  13          2HZ       LYS  13   7.701   2.096   3.625
   93   3HZ   LYS  13          3HZ       LYS  13   6.547   3.331   3.683
   94    H    GLU  14           H        GLU  14   3.294   0.874   4.780
   95    HA   GLU  14           HA       GLU  14   4.669  -1.159   5.987
   96   1HB   GLU  14          2HB       GLU  14   3.289   1.269   7.102
   97   2HB   GLU  14          1HB       GLU  14   4.063   0.121   8.188
   98   1HG   GLU  14          2HG       GLU  14   5.495   1.413   5.886
   99   2HG   GLU  14          1HG       GLU  14   5.443   2.109   7.505
  100    H    ALA  15           H        ALA  15   1.269  -0.389   6.155
  101    HA   ALA  15           HA       ALA  15   0.644  -2.395   8.132
  102   1HB   ALA  15          1HB       ALA  15  -0.660  -0.246   7.671
  103   2HB   ALA  15          2HB       ALA  15  -1.596  -1.722   7.911
  104   3HB   ALA  15          3HB       ALA  15  -1.337  -1.096   6.282
  105    H    ALA  16           H        ALA  16   0.401  -2.087   4.618
  106    HA   ALA  16           HA       ALA  16  -0.841  -4.615   4.177
  107   1HB   ALA  16          1HB       ALA  16   0.305  -4.136   1.807
  108   2HB   ALA  16          2HB       ALA  16   0.399  -2.511   2.488
  109   3HB   ALA  16          3HB       ALA  16  -1.164  -3.315   2.334
  110    H    ILE  17           H        ILE  17   2.359  -3.510   4.704
  111    HA   ILE  17           HA       ILE  17   3.808  -5.697   3.625
  112    HB   ILE  17           HB       ILE  17   4.488  -3.546   5.631
  113   1HG1  ILE  17          2HG1      ILE  17   5.680  -3.903   2.900
  114   2HG1  ILE  17          1HG1      ILE  17   4.121  -3.112   3.095
  115   1HG2  ILE  17          1HG2      ILE  17   6.019  -5.080   6.317
  116   2HG2  ILE  17          2HG2      ILE  17   6.903  -4.338   4.986
  117   3HG2  ILE  17          3HG2      ILE  17   6.087  -5.884   4.750
  118   1HD1  ILE  17          1HD1      ILE  17   6.084  -2.039   4.917
  119   2HD1  ILE  17          2HD1      ILE  17   5.087  -1.217   3.717
  120   3HD1  ILE  17          3HD1      ILE  17   6.624  -1.938   3.241
  121    H    LYS  18           H        LYS  18   2.195  -5.032   6.629
  122    HA   LYS  18           HA       LYS  18   3.441  -7.139   8.129
  123   1HB   LYS  18          2HB       LYS  18   1.696  -4.938   8.640
  124   2HB   LYS  18          1HB       LYS  18   0.935  -6.396   9.263
  125   1HG   LYS  18          2HG       LYS  18   2.638  -6.793  10.782
  126   2HG   LYS  18          1HG       LYS  18   3.796  -5.803   9.893
  127   1HD   LYS  18          2HD       LYS  18   3.331  -4.169  11.341
  128   2HD   LYS  18          1HD       LYS  18   1.762  -4.035  10.545
  129   1HE   LYS  18          2HE       LYS  18   0.783  -5.574  12.128
  130   2HE   LYS  18          1HE       LYS  18   2.357  -5.860  12.871
  131   1HZ   LYS  18          1HZ       LYS  18   0.684  -4.169  13.894
  132   2HZ   LYS  18          2HZ       LYS  18   1.340  -3.113  12.751
  133   3HZ   LYS  18          3HZ       LYS  18   2.341  -3.841  13.905
  134    H    GLU  19           H        GLU  19   0.791  -6.886   5.934
  135    HA   GLU  19           HA       GLU  19  -0.444  -9.350   6.834
  136   1HB   GLU  19          2HB       GLU  19  -1.133  -7.172   5.001
  137   2HB   GLU  19          1HB       GLU  19  -1.551  -8.759   4.369
  138   1HG   GLU  19          2HG       GLU  19  -3.469  -8.170   5.484
  139   2HG   GLU  19          1HG       GLU  19  -2.623  -9.125   6.701
  140    H    LEU  20           H        LEU  20   1.577  -8.206   4.190
  141    HA   LEU  20           HA       LEU  20   1.522 -10.567   2.659
  142   1HB   LEU  20          2HB       LEU  20   2.660  -8.080   2.392
  143   2HB   LEU  20          1HB       LEU  20   4.058  -9.122   2.590
  144    HG   LEU  20           HG       LEU  20   2.256 -10.347   0.751
  145   1HD1  LEU  20          1HD1      LEU  20   2.542  -8.569  -1.056
  146   2HD1  LEU  20          2HD1      LEU  20   2.818  -7.445   0.272
  147   3HD1  LEU  20          3HD1      LEU  20   1.287  -8.313   0.154
  148   1HD2  LEU  20          1HD2      LEU  20   4.972  -9.123   0.356
  149   2HD2  LEU  20          2HD2      LEU  20   4.190 -10.279  -0.715
  150   3HD2  LEU  20          3HD2      LEU  20   4.656 -10.761   0.914
  151    H    LYS  21           H        LYS  21   3.369  -9.580   5.454
  152    HA   LYS  21           HA       LYS  21   5.161 -11.844   5.307
  153   1HB   LYS  21          2HB       LYS  21   6.008 -11.026   7.483
  154   2HB   LYS  21          1HB       LYS  21   6.009  -9.773   6.250
  155   1HG   LYS  21          2HG       LYS  21   5.069  -8.531   7.855
  156   2HG   LYS  21          1HG       LYS  21   3.590  -9.361   7.374
  157   1HD   LYS  21          2HD       LYS  21   3.696 -10.847   9.177
  158   2HD   LYS  21          1HD       LYS  21   5.403 -10.510   9.468
  159   1HE   LYS  21          2HE       LYS  21   3.113  -8.600   9.927
  160   2HE   LYS  21          1HE       LYS  21   3.987  -9.485  11.176
  161   1HZ   LYS  21          1HZ       LYS  21   4.910  -7.340  11.121
  162   2HZ   LYS  21          2HZ       LYS  21   5.005  -7.318   9.432
  163   3HZ   LYS  21          3HZ       LYS  21   6.035  -8.322  10.323
  164    H    GLN  22           H        GLN  22   2.223 -10.910   6.972
  165    HA   GLN  22           HA       GLN  22   2.220 -13.150   8.767
  166   1HB   GLN  22          2HB       GLN  22   0.465 -10.870   8.168
  167   2HB   GLN  22          1HB       GLN  22  -0.400 -12.333   8.618
  168   1HG   GLN  22          2HG       GLN  22   0.761 -12.456  10.705
  169   2HG   GLN  22          1HG       GLN  22   1.825 -11.127  10.243
  170   1HE2  GLN  22          1HE2      GLN  22  -0.636 -11.841  12.177
  171   2HE2  GLN  22          2HE2      GLN  22  -1.453 -10.321  12.241
  172    H    TYR  23           H        TYR  23   1.093 -12.499   5.543
  173    HA   TYR  23           HA       TYR  23  -0.574 -14.850   5.382
  174   1HB   TYR  23          2HB       TYR  23   0.158 -12.601   3.581
  175   2HB   TYR  23          1HB       TYR  23  -0.296 -14.122   2.810
  176    HD1  TYR  23           1HD      TYR  23  -2.504 -15.209   3.859
  177    HD2  TYR  23           2HD      TYR  23  -1.513 -11.076   3.956
  178    HE1  TYR  23           1HE      TYR  23  -4.878 -14.653   4.141
  179    HE2  TYR  23           2HE      TYR  23  -3.882 -10.507   4.239
  180    HH   TYR  23           HH       TYR  23  -5.942 -11.494   4.979
  181    H    GLY  24           H        GLY  24   2.586 -13.811   4.159
  182   1HA   GLY  24          2HA       GLY  24   4.395 -15.425   4.112
  183   2HA   GLY  24          1HA       GLY  24   3.215 -16.652   3.680
  184    H    ILE  25           H        ILE  25   2.299 -14.057   1.912
  185    HA   ILE  25           HA       ILE  25   2.944 -15.103  -0.553
  186    HB   ILE  25           HB       ILE  25   3.021 -12.188  -0.683
  187   1HG1  ILE  25          2HG1      ILE  25   0.682 -13.493   0.733
  188   2HG1  ILE  25          1HG1      ILE  25   1.758 -12.267   1.396
  189   1HG2  ILE  25          1HG2      ILE  25   0.822 -12.825  -1.985
  190   2HG2  ILE  25          2HG2      ILE  25   1.484 -14.453  -1.849
  191   3HG2  ILE  25          3HG2      ILE  25   2.416 -13.188  -2.649
  192   1HD1  ILE  25          1HD1      ILE  25   0.940 -10.769  -0.487
  193   2HD1  ILE  25          2HD1      ILE  25  -0.190 -11.121   0.819
  194   3HD1  ILE  25          3HD1      ILE  25  -0.333 -11.963  -0.724
  195    H    GLY  26           H        GLY  26   4.397 -13.949  -2.271
  196   1HA   GLY  26          2HA       GLY  26   7.080 -14.293  -1.410
  197   2HA   GLY  26          1HA       GLY  26   6.563 -13.719  -2.992
  198    H    ASP  27           H        ASP  27   8.744 -12.851  -1.154
  199    HA   ASP  27           HA       ASP  27   8.168 -10.378   0.011
  200   1HB   ASP  27          2HB       ASP  27  10.587  -9.951  -0.105
  201   2HB   ASP  27          1HB       ASP  27  10.256 -11.592   0.440
  202    H    TYR  28           H        TYR  28   8.508 -11.294  -3.279
  203    HA   TYR  28           HA       TYR  28   9.345  -9.034  -4.601
  204   1HB   TYR  28          2HB       TYR  28   8.297 -11.400  -5.391
  205   2HB   TYR  28          1HB       TYR  28   6.915 -10.350  -5.693
  206    HD1  TYR  28           1HD      TYR  28   8.748  -7.890  -6.306
  207    HD2  TYR  28           2HD      TYR  28   8.608 -11.882  -7.763
  208    HE1  TYR  28           1HE      TYR  28   9.744  -7.144  -8.409
  209    HE2  TYR  28           2HE      TYR  28   9.611 -11.145  -9.884
  210    HH   TYR  28           HH       TYR  28  10.933  -9.336 -10.768
  211    H    TYR  29           H        TYR  29   6.126  -9.777  -3.413
  212    HA   TYR  29           HA       TYR  29   4.929  -7.379  -4.358
  213   1HB   TYR  29          2HB       TYR  29   3.846  -9.240  -2.247
  214   2HB   TYR  29          1HB       TYR  29   2.934  -8.201  -3.339
  215    HD1  TYR  29           1HD      TYR  29   4.728  -8.799  -5.791
  216    HD2  TYR  29           2HD      TYR  29   2.762 -11.302  -2.951
  217    HE1  TYR  29           1HE      TYR  29   4.673 -10.629  -7.437
  218    HE2  TYR  29           2HE      TYR  29   2.691 -13.128  -4.601
  219    HH   TYR  29           HH       TYR  29   4.355 -13.623  -6.866
  220    H    ILE  30           H        ILE  30   5.751  -8.416  -1.008
  221    HA   ILE  30           HA       ILE  30   4.935  -6.096   0.285
  222    HB   ILE  30           HB       ILE  30   5.764  -8.035   1.507
  223   1HG1  ILE  30          2HG1      ILE  30   5.833  -5.728   2.527
  224   2HG1  ILE  30          1HG1      ILE  30   6.896  -6.915   3.269
  225   1HG2  ILE  30          1HG2      ILE  30   8.152  -8.522   1.638
  226   2HG2  ILE  30          2HG2      ILE  30   8.463  -7.263   0.440
  227   3HG2  ILE  30          3HG2      ILE  30   7.518  -8.686   0.001
  228   1HD1  ILE  30          1HD1      ILE  30   8.452  -5.691   1.324
  229   2HD1  ILE  30          2HD1      ILE  30   8.522  -5.432   3.066
  230   3HD1  ILE  30          3HD1      ILE  30   7.522  -4.386   2.058
  231    H    LYS  31           H        LYS  31   7.635  -6.712  -1.791
  232    HA   LYS  31           HA       LYS  31   8.965  -4.202  -1.274
  233   1HB   LYS  31          2HB       LYS  31   9.423  -6.424  -3.253
  234   2HB   LYS  31          1HB       LYS  31  10.404  -4.965  -3.209
  235   1HG   LYS  31          2HG       LYS  31  10.078  -6.841  -0.878
  236   2HG   LYS  31          1HG       LYS  31  11.402  -6.926  -2.041
  237   1HD   LYS  31          2HD       LYS  31  12.506  -5.466  -0.773
  238   2HD   LYS  31          1HD       LYS  31  11.309  -4.253  -1.231
  239   1HE   LYS  31          2HE       LYS  31  10.124  -4.488   0.729
  240   2HE   LYS  31          1HE       LYS  31  10.690  -6.136   0.997
  241   1HZ   LYS  31          1HZ       LYS  31  12.944  -5.103   1.383
  242   2HZ   LYS  31          2HZ       LYS  31  11.781  -4.818   2.578
  243   3HZ   LYS  31          3HZ       LYS  31  12.157  -3.607   1.458
  244    H    LEU  32           H        LEU  32   7.238  -5.710  -4.008
  245    HA   LEU  32           HA       LEU  32   7.392  -3.607  -5.781
  246   1HB   LEU  32          2HB       LEU  32   6.161  -4.948  -7.091
  247   2HB   LEU  32          1HB       LEU  32   6.226  -6.083  -5.768
  248    HG   LEU  32           HG       LEU  32   3.985  -5.999  -6.439
  249   1HD1  LEU  32          1HD1      LEU  32   3.371  -4.218  -4.322
  250   2HD1  LEU  32          2HD1      LEU  32   4.857  -5.089  -3.933
  251   3HD1  LEU  32          3HD1      LEU  32   3.383  -5.986  -4.318
  252   1HD2  LEU  32          1HD2      LEU  32   4.508  -3.535  -7.436
  253   2HD2  LEU  32          2HD2      LEU  32   3.554  -3.122  -6.012
  254   3HD2  LEU  32          3HD2      LEU  32   2.886  -4.199  -7.238
  255    H    ILE  33           H        ILE  33   5.710  -3.771  -2.842
  256    HA   ILE  33           HA       ILE  33   3.711  -1.781  -3.381
  257    HB   ILE  33           HB       ILE  33   4.717  -3.157  -0.901
  258   1HG1  ILE  33          2HG1      ILE  33   2.118  -3.113  -2.433
  259   2HG1  ILE  33          1HG1      ILE  33   3.211  -4.472  -2.197
  260   1HG2  ILE  33          1HG2      ILE  33   3.546  -0.552  -0.970
  261   2HG2  ILE  33          2HG2      ILE  33   4.057  -1.506   0.419
  262   3HG2  ILE  33          3HG2      ILE  33   2.422  -1.676  -0.213
  263   1HD1  ILE  33          1HD1      ILE  33   0.935  -3.881  -0.739
  264   2HD1  ILE  33          2HD1      ILE  33   2.267  -3.440   0.330
  265   3HD1  ILE  33          3HD1      ILE  33   2.172  -5.070  -0.335
  266    H    ASN  34           H        ASN  34   6.644  -1.858  -1.349
  267    HA   ASN  34           HA       ASN  34   6.719   0.798  -0.612
  268   1HB   ASN  34          2HB       ASN  34   8.315  -1.338  -0.157
  269   2HB   ASN  34          1HB       ASN  34   9.343  -0.411  -1.246
  270   1HD2  ASN  34          1HD2      ASN  34   9.767  -0.994   1.538
  271   2HD2  ASN  34          2HD2      ASN  34   9.860   0.524   2.357
  272    H    ASN  35           H        ASN  35   7.387  -0.572  -3.720
  273    HA   ASN  35           HA       ASN  35   8.975   1.581  -4.716
  274   1HB   ASN  35          2HB       ASN  35   7.682  -0.839  -5.853
  275   2HB   ASN  35          1HB       ASN  35   8.042   0.472  -6.972
  276   1HD2  ASN  35          1HD2      ASN  35  10.185   1.059  -7.337
  277   2HD2  ASN  35          2HD2      ASN  35  11.500   0.020  -6.915
  278    H    ALA  36           H        ALA  36   5.600   1.103  -4.267
  279    HA   ALA  36           HA       ALA  36   4.471   2.632  -6.278
  280   1HB   ALA  36          1HB       ALA  36   3.435   1.263  -4.279
  281   2HB   ALA  36          2HB       ALA  36   2.534   2.547  -5.088
  282   3HB   ALA  36          3HB       ALA  36   3.334   2.866  -3.549
  283    H    LYS  37           H        LYS  37   3.575   4.793  -6.216
  284    HA   LYS  37           HA       LYS  37   5.346   6.669  -4.813
  285   1HB   LYS  37          2HB       LYS  37   4.877   8.278  -6.563
  286   2HB   LYS  37          1HB       LYS  37   5.413   6.764  -7.290
  287   1HG   LYS  37          2HG       LYS  37   2.493   7.287  -6.975
  288   2HG   LYS  37          1HG       LYS  37   3.386   8.062  -8.282
  289   1HD   LYS  37          2HD       LYS  37   3.458   6.177  -9.467
  290   2HD   LYS  37          1HD       LYS  37   4.031   5.248  -8.081
  291   1HE   LYS  37          2HE       LYS  37   2.009   4.231  -8.522
  292   2HE   LYS  37          1HE       LYS  37   1.555   5.411  -7.294
  293   1HZ   LYS  37          1HZ       LYS  37   0.920   6.917  -9.154
  294   2HZ   LYS  37          2HZ       LYS  37  -0.033   5.526  -9.033
  295   3HZ   LYS  37          3HZ       LYS  37   1.162   5.630 -10.225
  296    H    THR  38           H        THR  38   2.049   5.756  -5.394
  297    HA   THR  38           HA       THR  38   1.077   7.969  -3.727
  298    HB   THR  38           HB       THR  38  -1.095   7.578  -4.647
  299    HG1  THR  38           1HG      THR  38  -1.424   5.476  -4.809
  300   1HG2  THR  38          1HG2      THR  38   0.865   8.439  -6.233
  301   2HG2  THR  38          2HG2      THR  38  -0.804   8.257  -6.772
  302   3HG2  THR  38          3HG2      THR  38   0.380   7.001  -7.132
  303    H    VAL  39           H        VAL  39  -1.390   6.437  -3.054
  304    HA   VAL  39           HA       VAL  39  -0.247   4.365  -1.338
  305    HB   VAL  39           HB       VAL  39  -0.661   6.677  -0.184
  306   1HG1  VAL  39          1HG1      VAL  39  -3.352   5.370   0.097
  307   2HG1  VAL  39          2HG1      VAL  39  -3.031   6.808  -0.871
  308   3HG1  VAL  39          3HG1      VAL  39  -2.802   6.852   0.879
  309   1HG2  VAL  39          1HG2      VAL  39  -1.373   5.221   1.868
  310   2HG2  VAL  39          2HG2      VAL  39   0.207   4.997   1.108
  311   3HG2  VAL  39          3HG2      VAL  39  -1.115   3.897   0.737
  312    H    GLU  40           H        GLU  40  -3.250   5.793  -2.584
  313    HA   GLU  40           HA       GLU  40  -5.079   3.910  -1.817
  314   1HB   GLU  40          2HB       GLU  40  -5.222   6.055  -3.396
  315   2HB   GLU  40          1HB       GLU  40  -5.241   4.815  -4.641
  316   1HG   GLU  40          2HG       GLU  40  -7.068   3.961  -2.708
  317   2HG   GLU  40          1HG       GLU  40  -7.345   5.690  -2.892
  318    H    GLY  41           H        GLY  41  -2.832   3.697  -4.538
  319   1HA   GLY  41          2HA       GLY  41  -3.846   1.141  -5.393
  320   2HA   GLY  41          1HA       GLY  41  -2.402   1.946  -5.993
  321    H    VAL  42           H        VAL  42  -1.436   2.254  -3.165
  322    HA   VAL  42           HA       VAL  42   0.218  -0.010  -3.066
  323    HB   VAL  42           HB       VAL  42  -0.408   1.871  -0.798
  324   1HG1  VAL  42          1HG1      VAL  42   1.732  -0.144  -1.345
  325   2HG1  VAL  42          2HG1      VAL  42   0.759   0.084   0.115
  326   3HG1  VAL  42          3HG1      VAL  42   2.040   1.235  -0.287
  327   1HG2  VAL  42          1HG2      VAL  42   0.266   3.154  -2.723
  328   2HG2  VAL  42          2HG2      VAL  42   1.615   2.063  -3.020
  329   3HG2  VAL  42          3HG2      VAL  42   1.612   3.086  -1.585
  330    H    GLU  43           H        GLU  43  -2.430   0.916  -0.870
  331    HA   GLU  43           HA       GLU  43  -2.393  -1.456   0.640
  332   1HB   GLU  43          2HB       GLU  43  -4.908  -0.747   1.025
  333   2HB   GLU  43          1HB       GLU  43  -3.590   0.200   1.704
  334   1HG   GLU  43          2HG       GLU  43  -3.799   1.870   0.084
  335   2HG   GLU  43          1HG       GLU  43  -4.781   0.847  -0.967
  336    H    SER  44           H        SER  44  -4.305  -0.527  -2.188
  337    HA   SER  44           HA       SER  44  -5.743  -2.987  -2.311
  338   1HB   SER  44          2HB       SER  44  -6.836  -2.069  -4.121
  339   2HB   SER  44          1HB       SER  44  -6.230  -0.594  -3.365
  340    HG   SER  44           HG       SER  44  -5.322  -0.263  -5.227
  341    H    LEU  45           H        LEU  45  -2.650  -1.910  -3.363
  342    HA   LEU  45           HA       LEU  45  -2.144  -3.602  -5.527
  343   1HB   LEU  45          2HB       LEU  45  -0.586  -2.006  -3.646
  344   2HB   LEU  45          1HB       LEU  45   0.273  -3.426  -4.193
  345   1HD1  LEU  45          1HD1      LEU  45   1.237  -3.621  -5.983
  346   2HD1  LEU  45          2HD1      LEU  45   2.009  -2.033  -6.042
  347   3HD1  LEU  45          3HD1      LEU  45   1.051  -2.601  -7.410
  348   1HD2  LEU  45          1HD2      LEU  45  -2.173  -1.770  -6.235
  349   2HD2  LEU  45          2HD2      LEU  45  -1.254  -2.799  -7.331
  350   3HD2  LEU  45          3HD2      LEU  45  -1.061  -1.048  -7.397
  351    H    LYS  46           H        LYS  46  -1.190  -4.127  -2.123
  352    HA   LYS  46           HA       LYS  46  -0.458  -6.839  -2.573
  353   1HB   LYS  46          2HB       LYS  46   0.624  -6.193  -0.703
  354   2HB   LYS  46          1HB       LYS  46  -0.583  -4.986  -0.286
  355   1HG   LYS  46          2HG       LYS  46  -1.173  -7.890   0.126
  356   2HG   LYS  46          1HG       LYS  46  -0.157  -7.013   1.278
  357   1HD   LYS  46          2HD       LYS  46  -2.017  -5.287   1.388
  358   2HD   LYS  46          1HD       LYS  46  -3.018  -6.456   0.534
  359   1HE   LYS  46          2HE       LYS  46  -3.184  -7.838   2.316
  360   2HE   LYS  46          1HE       LYS  46  -1.576  -7.429   2.920
  361   1HZ   LYS  46          1HZ       LYS  46  -2.743  -5.133   3.345
  362   2HZ   LYS  46          2HZ       LYS  46  -2.869  -6.394   4.464
  363   3HZ   LYS  46          3HZ       LYS  46  -4.138  -6.089   3.388
  364    H    ASN  47           H        ASN  47  -3.341  -5.321  -1.119
  365    HA   ASN  47           HA       ASN  47  -4.661  -7.694  -0.447
  366   1HB   ASN  47          2HB       ASN  47  -5.379  -5.425   0.290
  367   2HB   ASN  47          1HB       ASN  47  -5.944  -5.097  -1.345
  368   1HD2  ASN  47          1HD2      ASN  47  -6.787  -6.228   1.669
  369   2HD2  ASN  47          2HD2      ASN  47  -8.287  -6.982   1.263
  370    H    GLU  48           H        GLU  48  -4.244  -6.102  -3.507
  371    HA   GLU  48           HA       GLU  48  -6.290  -7.605  -4.865
  372   1HB   GLU  48          2HB       GLU  48  -5.641  -5.410  -5.716
  373   2HB   GLU  48          1HB       GLU  48  -3.986  -5.960  -5.938
  374   1HG   GLU  48          2HG       GLU  48  -4.553  -6.425  -8.029
  375   2HG   GLU  48          1HG       GLU  48  -5.469  -7.784  -7.379
  376    H    ILE  49           H        ILE  49  -2.817  -7.803  -4.395
  377    HA   ILE  49           HA       ILE  49  -2.318  -9.942  -6.176
  378    HB   ILE  49           HB       ILE  49  -0.199 -10.177  -5.152
  379   1HG1  ILE  49          2HG1      ILE  49  -0.824  -8.502  -2.773
  380   2HG1  ILE  49          1HG1      ILE  49  -1.337 -10.177  -2.750
  381   1HG2  ILE  49          1HG2      ILE  49  -1.181  -7.653  -5.849
  382   2HG2  ILE  49          2HG2      ILE  49   0.492  -8.208  -5.868
  383   3HG2  ILE  49          3HG2      ILE  49  -0.156  -7.413  -4.434
  384   1HD1  ILE  49          1HD1      ILE  49   0.793 -10.955  -2.673
  385   2HD1  ILE  49          2HD1      ILE  49   0.958  -9.431  -1.793
  386   3HD1  ILE  49          3HD1      ILE  49   1.454  -9.533  -3.482
  387    H    LEU  50           H        LEU  50  -3.549  -9.720  -2.957
  388    HA   LEU  50           HA       LEU  50  -3.314 -12.518  -2.359
  389   1HB   LEU  50          2HB       LEU  50  -4.734 -10.219  -1.014
  390   2HB   LEU  50          1HB       LEU  50  -4.740 -11.853  -0.375
  391    HG   LEU  50           HG       LEU  50  -2.071 -10.749  -0.953
  392   1HD1  LEU  50          1HD1      LEU  50  -3.027  -8.735  -0.122
  393   2HD1  LEU  50          2HD1      LEU  50  -2.070  -9.453   1.175
  394   3HD1  LEU  50          3HD1      LEU  50  -3.830  -9.591   1.194
  395   1HD2  LEU  50          1HD2      LEU  50  -1.963 -11.651   1.550
  396   2HD2  LEU  50          2HD2      LEU  50  -1.867 -12.721   0.149
  397   3HD2  LEU  50          3HD2      LEU  50  -3.397 -12.526   1.010
  398    H    LYS  51           H        LYS  51  -5.743 -10.336  -3.624
  399    HA   LYS  51           HA       LYS  51  -8.011 -11.948  -3.350
  400   1HB   LYS  51          2HB       LYS  51  -8.095  -9.589  -4.054
  401   2HB   LYS  51          1HB       LYS  51  -7.338 -10.018  -5.582
  402   1HG   LYS  51          2HG       LYS  51  -9.236 -10.986  -6.413
  403   2HG   LYS  51          1HG       LYS  51  -9.863 -11.388  -4.813
  404   1HD   LYS  51          2HD       LYS  51 -10.097  -8.856  -4.481
  405   2HD   LYS  51          1HD       LYS  51  -9.884  -8.740  -6.229
  406   1HE   LYS  51          2HE       LYS  51 -11.761 -10.559  -6.273
  407   2HE   LYS  51          1HE       LYS  51 -12.120  -9.947  -4.661
  408   1HZ   LYS  51          1HZ       LYS  51 -12.861  -7.990  -5.460
  409   2HZ   LYS  51          2HZ       LYS  51 -13.183  -8.920  -6.836
  410   3HZ   LYS  51          3HZ       LYS  51 -11.789  -7.967  -6.771
  411    H    ALA  52           H        ALA  52  -5.259 -12.213  -5.404
  412    HA   ALA  52           HA       ALA  52  -6.391 -14.627  -6.592
  413   1HB   ALA  52          1HB       ALA  52  -5.432 -14.012  -8.802
  414   2HB   ALA  52          2HB       ALA  52  -5.084 -12.407  -8.157
  415   3HB   ALA  52          3HB       ALA  52  -6.753 -12.962  -8.289
  416    H    LEU  53           H        LEU  53  -4.874 -15.167  -4.668
  417    HA   LEU  53           HA       LEU  53  -2.056 -15.129  -5.355
  418   1HB   LEU  53          2HB       LEU  53  -3.485 -15.166  -2.969
  419   2HB   LEU  53          1HB       LEU  53  -2.784 -16.769  -3.067
  420    HG   LEU  53           HG       LEU  53  -0.997 -14.440  -3.565
  421   1HD1  LEU  53          1HD1      LEU  53  -2.527 -14.115  -1.461
  422   2HD1  LEU  53          2HD1      LEU  53  -0.797 -13.788  -1.379
  423   3HD1  LEU  53          3HD1      LEU  53  -1.438 -15.306  -0.750
  424   1HD2  LEU  53          1HD2      LEU  53  -0.666 -17.170  -3.359
  425   2HD2  LEU  53          2HD2      LEU  53  -0.135 -16.573  -1.786
  426   3HD2  LEU  53          3HD2      LEU  53   0.610 -15.957  -3.260
  427    HA   PRO  54           HA       PRO  54  -2.175 -19.084  -7.378
  428   1HB   PRO  54          2HB       PRO  54   0.474 -19.702  -7.207
  429   2HB   PRO  54          1HB       PRO  54  -0.180 -18.543  -8.369
  430   1HG   PRO  54          2HG       PRO  54   1.151 -18.040  -5.736
  431   2HG   PRO  54          1HG       PRO  54   1.366 -17.192  -7.280
  432   1HD   PRO  54          2HD       PRO  54  -0.160 -16.190  -5.294
  433   2HD   PRO  54          1HD       PRO  54  -0.556 -15.941  -7.007
  434    H    THR  55           H        THR  55  -3.410 -19.993  -5.563
  435    HA   THR  55           HA       THR  55  -1.832 -22.018  -4.178
  436    HB   THR  55           HB       THR  55  -3.650 -21.304  -2.222
  437    HG1  THR  55           1HG      THR  55  -2.483 -18.924  -3.220
  438   1HG2  THR  55          1HG2      THR  55  -0.971 -20.028  -2.156
  439   2HG2  THR  55          2HG2      THR  55  -1.076 -21.789  -2.182
  440   3HG2  THR  55          3HG2      THR  55  -1.856 -20.878  -0.889
  441    H    GLU  56           H        GLU  56  -2.714 -23.810  -4.989
  442    HA   GLU  56           HA       GLU  56  -5.621 -23.945  -5.342
  443   1HB   GLU  56          2HB       GLU  56  -3.295 -25.344  -6.556
  444   2HB   GLU  56          1HB       GLU  56  -4.791 -26.255  -6.405
  445   1HG   GLU  56          2HG       GLU  56  -5.898 -24.965  -7.922
  446   2HG   GLU  56          1HG       GLU  56  -4.929 -23.534  -7.577
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1   8.303  25.324   7.933
    2   2H    MET   1          2HT       MET   1   7.176  25.429   9.214
    3   3H    MET   1          3HT       MET   1   7.266  26.681   8.042
    4    HA   MET   1           HA       MET   1   5.423  25.497   7.445
    5   1HB   MET   1          2HB       MET   1   7.519  25.746   5.794
    6   2HB   MET   1          1HB       MET   1   7.358  23.999   5.770
    7   1HG   MET   1          2HG       MET   1   5.375  24.052   4.666
    8   2HG   MET   1          1HG       MET   1   4.897  25.595   5.373
    9   1HE   MET   1          1HE       MET   1   7.012  23.726   2.844
   10   2HE   MET   1          2HE       MET   1   7.062  24.821   1.467
   11   3HE   MET   1          3HE       MET   1   5.528  24.138   1.986
   12    H    GLU   2           H        GLU   2   4.805  23.187   6.436
   13    HA   GLU   2           HA       GLU   2   5.855  20.978   7.970
   14   1HB   GLU   2          2HB       GLU   2   3.085  22.065   8.416
   15   2HB   GLU   2          1HB       GLU   2   3.495  20.400   8.775
   16   1HG   GLU   2          2HG       GLU   2   5.446  21.499  10.139
   17   2HG   GLU   2          1HG       GLU   2   4.367  22.891  10.128
   18    H    ALA   3           H        ALA   3   5.579  19.060   6.948
   19    HA   ALA   3           HA       ALA   3   3.489  18.493   5.123
   20   1HB   ALA   3          1HB       ALA   3   5.322  18.270   3.182
   21   2HB   ALA   3          2HB       ALA   3   5.972  19.665   4.034
   22   3HB   ALA   3          3HB       ALA   3   4.327  19.708   3.406
   23    H    VAL   4           H        VAL   4   3.237  16.441   5.740
   24    HA   VAL   4           HA       VAL   4   5.390  14.555   5.270
   25    HB   VAL   4           HB       VAL   4   5.075  13.483   7.520
   26   1HG1  VAL   4          1HG1      VAL   4   6.832  14.646   8.406
   27   2HG1  VAL   4          2HG1      VAL   4   6.128  16.220   8.031
   28   3HG1  VAL   4          3HG1      VAL   4   6.884  15.262   6.756
   29   1HG2  VAL   4          1HG2      VAL   4   4.353  15.448   9.204
   30   2HG2  VAL   4          2HG2      VAL   4   3.230  14.235   8.576
   31   3HG2  VAL   4          3HG2      VAL   4   3.318  15.835   7.833
   32    H    ASP   5           H        ASP   5   2.924  14.973   3.967
   33    HA   ASP   5           HA       ASP   5   0.808  13.383   4.803
   34   1HB   ASP   5          2HB       ASP   5   0.189  13.275   2.386
   35   2HB   ASP   5          1HB       ASP   5   0.541  14.907   2.953
   36    H    ALA   6           H        ALA   6   3.861  12.489   3.414
   37    HA   ALA   6           HA       ALA   6   3.283   9.969   2.391
   38   1HB   ALA   6          1HB       ALA   6   5.490  11.404   2.443
   39   2HB   ALA   6          2HB       ALA   6   5.537   9.654   2.239
   40   3HB   ALA   6          3HB       ALA   6   5.854  10.365   3.822
   41    H    ASN   7           H        ASN   7   3.423  11.046   5.675
   42    HA   ASN   7           HA       ASN   7   4.048   8.686   7.023
   43   1HB   ASN   7          2HB       ASN   7   2.654  11.201   7.677
   44   2HB   ASN   7          1HB       ASN   7   2.216   9.832   8.690
   45   1HD2  ASN   7          1HD2      ASN   7   3.929  12.385   8.930
   46   2HD2  ASN   7          2HD2      ASN   7   5.360  11.824   9.723
   47    H    SER   8           H        SER   8   0.877   9.889   5.956
   48    HA   SER   8           HA       SER   8  -0.565   7.634   6.905
   49   1HB   SER   8          2HB       SER   8  -1.560   9.898   6.410
   50   2HB   SER   8          1HB       SER   8  -1.391   9.528   4.694
   51    HG   SER   8           HG       SER   8  -3.062   8.250   4.813
   52    H    LEU   9           H        LEU   9   1.096   8.433   3.951
   53    HA   LEU   9           HA       LEU   9   0.014   6.363   2.333
   54   1HB   LEU   9          2HB       LEU   9   1.172   8.433   1.518
   55   2HB   LEU   9          1HB       LEU   9   2.685   7.748   2.072
   56    HG   LEU   9           HG       LEU   9   0.935   6.465  -0.022
   57   1HD1  LEU   9          1HD1      LEU   9   3.506   7.717  -0.738
   58   2HD1  LEU   9          2HD1      LEU   9   2.155   8.797  -0.407
   59   3HD1  LEU   9          3HD1      LEU   9   2.013   7.575  -1.666
   60   1HD2  LEU   9          1HD2      LEU   9   2.228   4.718   0.545
   61   2HD2  LEU   9          2HD2      LEU   9   3.439   5.735   1.326
   62   3HD2  LEU   9          3HD2      LEU   9   3.440   5.551  -0.428
   63    H    ALA  10           H        ALA  10   2.974   6.686   4.257
   64    HA   ALA  10           HA       ALA  10   4.125   4.216   3.587
   65   1HB   ALA  10          1HB       ALA  10   5.203   4.636   5.986
   66   2HB   ALA  10          2HB       ALA  10   4.539   6.245   5.698
   67   3HB   ALA  10          3HB       ALA  10   5.682   5.546   4.551
   68    H    GLN  11           H        GLN  11   1.457   4.926   5.624
   69    HA   GLN  11           HA       GLN  11   1.723   2.589   7.280
   70   1HB   GLN  11          2HB       GLN  11   0.647   4.461   8.282
   71   2HB   GLN  11          1HB       GLN  11  -0.461   4.633   6.925
   72   1HG   GLN  11          2HG       GLN  11  -1.432   2.457   7.496
   73   2HG   GLN  11          1HG       GLN  11  -0.399   2.385   8.917
   74   1HE2  GLN  11          1HE2      GLN  11  -1.178   3.188  10.736
   75   2HE2  GLN  11          2HE2      GLN  11  -2.534   4.246  10.875
   76    H    ALA  12           H        ALA  12  -0.249   3.571   4.504
   77    HA   ALA  12           HA       ALA  12  -1.947   1.399   4.326
   78   1HB   ALA  12          1HB       ALA  12  -0.709   2.372   1.813
   79   2HB   ALA  12          2HB       ALA  12  -1.580   3.542   2.810
   80   3HB   ALA  12          3HB       ALA  12  -2.409   2.105   2.207
   81    H    LYS  13           H        LYS  13   1.405   1.727   3.398
   82    HA   LYS  13           HA       LYS  13   1.543  -0.988   2.364
   83   1HB   LYS  13          2HB       LYS  13   4.114  -0.216   2.373
   84   2HB   LYS  13          1HB       LYS  13   2.997   0.184   1.083
   85   1HG   LYS  13          2HG       LYS  13   2.736   2.372   1.809
   86   2HG   LYS  13          1HG       LYS  13   3.392   2.010   3.410
   87   1HD   LYS  13          2HD       LYS  13   5.506   2.336   2.722
   88   2HD   LYS  13          1HD       LYS  13   5.250   1.402   1.245
   89   1HE   LYS  13          2HE       LYS  13   3.984   3.447   0.388
   90   2HE   LYS  13          1HE       LYS  13   4.719   4.316   1.734
   91   1HZ   LYS  13          1HZ       LYS  13   6.476   2.742   0.008
   92   2HZ   LYS  13          2HZ       LYS  13   6.773   4.202   0.807
   93   3HZ   LYS  13          3HZ       LYS  13   5.859   4.189  -0.616
   94    H    GLU  14           H        GLU  14   3.249   0.885   4.900
   95    HA   GLU  14           HA       GLU  14   4.584  -1.121   6.183
   96   1HB   GLU  14          2HB       GLU  14   3.236   1.367   7.180
   97   2HB   GLU  14          1HB       GLU  14   3.911   0.233   8.344
   98   1HG   GLU  14          2HG       GLU  14   6.098   0.430   7.249
   99   2HG   GLU  14          1HG       GLU  14   5.413   1.604   6.126
  100    H    ALA  15           H        ALA  15   1.188  -0.329   6.283
  101    HA   ALA  15           HA       ALA  15   0.562  -2.345   8.275
  102   1HB   ALA  15          1HB       ALA  15  -1.482  -0.965   6.574
  103   2HB   ALA  15          2HB       ALA  15  -0.657  -0.102   7.871
  104   3HB   ALA  15          3HB       ALA  15  -1.616  -1.536   8.236
  105    H    ALA  16           H        ALA  16   0.139  -1.912   4.782
  106    HA   ALA  16           HA       ALA  16  -1.234  -4.365   4.338
  107   1HB   ALA  16          1HB       ALA  16  -1.515  -2.737   2.665
  108   2HB   ALA  16          2HB       ALA  16  -0.480  -3.958   1.927
  109   3HB   ALA  16          3HB       ALA  16   0.221  -2.453   2.524
  110    H    ILE  17           H        ILE  17   2.045  -3.454   4.716
  111    HA   ILE  17           HA       ILE  17   3.280  -5.693   3.477
  112    HB   ILE  17           HB       ILE  17   4.231  -3.599   5.428
  113   1HG1  ILE  17          2HG1      ILE  17   5.095  -4.077   2.580
  114   2HG1  ILE  17          1HG1      ILE  17   3.723  -3.057   2.988
  115   1HG2  ILE  17          1HG2      ILE  17   5.665  -5.294   6.012
  116   2HG2  ILE  17          2HG2      ILE  17   6.547  -4.501   4.708
  117   3HG2  ILE  17          3HG2      ILE  17   5.667  -5.998   4.395
  118   1HD1  ILE  17          1HD1      ILE  17   6.619  -2.633   3.625
  119   2HD1  ILE  17          2HD1      ILE  17   5.336  -1.756   4.458
  120   3HD1  ILE  17          3HD1      ILE  17   5.524  -1.596   2.712
  121    H    LYS  18           H        LYS  18   2.109  -4.921   6.685
  122    HA   LYS  18           HA       LYS  18   3.310  -7.058   8.086
  123   1HB   LYS  18          2HB       LYS  18   1.573  -4.911   8.663
  124   2HB   LYS  18          1HB       LYS  18   0.730  -6.371   9.170
  125   1HG   LYS  18          2HG       LYS  18   2.636  -7.007  10.549
  126   2HG   LYS  18          1HG       LYS  18   3.503  -5.562  10.026
  127   1HD   LYS  18          2HD       LYS  18   2.016  -4.132  11.157
  128   2HD   LYS  18          1HD       LYS  18   0.814  -5.408  11.359
  129   1HE   LYS  18          2HE       LYS  18   2.067  -6.479  13.024
  130   2HE   LYS  18          1HE       LYS  18   3.539  -5.607  12.600
  131   1HZ   LYS  18          1HZ       LYS  18   2.878  -4.502  14.465
  132   2HZ   LYS  18          2HZ       LYS  18   1.226  -4.694  14.150
  133   3HZ   LYS  18          3HZ       LYS  18   2.126  -3.556  13.280
  134    H    GLU  19           H        GLU  19   0.458  -6.798   6.100
  135    HA   GLU  19           HA       GLU  19  -0.641  -9.328   6.892
  136   1HB   GLU  19          2HB       GLU  19  -1.380  -7.133   5.137
  137   2HB   GLU  19          1HB       GLU  19  -1.685  -8.689   4.376
  138   1HG   GLU  19          2HG       GLU  19  -3.676  -8.250   5.448
  139   2HG   GLU  19          1HG       GLU  19  -2.843  -9.290   6.604
  140    H    LEU  20           H        LEU  20   1.317  -8.124   4.216
  141    HA   LEU  20           HA       LEU  20   1.344 -10.447   2.662
  142   1HB   LEU  20          2HB       LEU  20   2.445  -7.958   2.455
  143   2HB   LEU  20          1HB       LEU  20   3.866  -8.950   2.730
  144    HG   LEU  20           HG       LEU  20   2.250 -10.250   0.784
  145   1HD1  LEU  20          1HD1      LEU  20   2.561  -7.304   0.414
  146   2HD1  LEU  20          2HD1      LEU  20   1.168  -8.335   0.086
  147   3HD1  LEU  20          3HD1      LEU  20   2.572  -8.386  -0.978
  148   1HD2  LEU  20          1HD2      LEU  20   4.854  -8.796   0.438
  149   2HD2  LEU  20          2HD2      LEU  20   4.232 -10.117  -0.546
  150   3HD2  LEU  20          3HD2      LEU  20   4.704 -10.408   1.128
  151    H    LYS  21           H        LYS  21   3.174  -9.515   5.500
  152    HA   LYS  21           HA       LYS  21   4.957 -11.781   5.330
  153   1HB   LYS  21          2HB       LYS  21   5.845 -11.014   7.456
  154   2HB   LYS  21          1HB       LYS  21   5.690  -9.652   6.356
  155   1HG   LYS  21          2HG       LYS  21   3.822  -8.805   7.501
  156   2HG   LYS  21          1HG       LYS  21   3.593 -10.304   8.400
  157   1HD   LYS  21          2HD       LYS  21   6.204  -9.473   8.977
  158   2HD   LYS  21          1HD       LYS  21   5.216  -8.013   9.044
  159   1HE   LYS  21          2HE       LYS  21   3.754  -8.990  10.658
  160   2HE   LYS  21          1HE       LYS  21   4.501 -10.574  10.459
  161   1HZ   LYS  21          1HZ       LYS  21   6.608  -9.099  11.161
  162   2HZ   LYS  21          2HZ       LYS  21   5.645  -9.941  12.268
  163   3HZ   LYS  21          3HZ       LYS  21   5.387  -8.289  12.009
  164    H    GLN  22           H        GLN  22   2.023 -10.860   7.018
  165    HA   GLN  22           HA       GLN  22   1.947 -13.117   8.759
  166   1HB   GLN  22          2HB       GLN  22   0.325 -10.801   8.222
  167   2HB   GLN  22          1HB       GLN  22  -0.696 -12.232   8.276
  168   1HG   GLN  22          2HG       GLN  22  -0.647 -12.183  10.481
  169   2HG   GLN  22          1HG       GLN  22   1.103 -12.394  10.450
  170   1HE2  GLN  22          1HE2      GLN  22   2.106 -10.939  11.620
  171   2HE2  GLN  22          2HE2      GLN  22   1.650  -9.284  11.812
  172    H    TYR  23           H        TYR  23   0.978 -12.500   5.481
  173    HA   TYR  23           HA       TYR  23  -0.604 -14.909   5.241
  174   1HB   TYR  23          2HB       TYR  23   0.099 -12.609   3.497
  175   2HB   TYR  23          1HB       TYR  23  -0.243 -14.137   2.687
  176    HD1  TYR  23           1HD      TYR  23  -2.455 -15.302   3.285
  177    HD2  TYR  23           2HD      TYR  23  -1.646 -11.217   4.140
  178    HE1  TYR  23           1HE      TYR  23  -4.864 -14.868   3.458
  179    HE2  TYR  23           2HE      TYR  23  -4.052 -10.770   4.319
  180    HH   TYR  23           HH       TYR  23  -6.283 -12.868   4.844
  181    H    GLY  24           H        GLY  24   2.558 -13.722   4.178
  182   1HA   GLY  24          2HA       GLY  24   4.454 -15.199   4.137
  183   2HA   GLY  24          1HA       GLY  24   3.364 -16.523   3.760
  184    H    ILE  25           H        ILE  25   2.385 -13.944   1.918
  185    HA   ILE  25           HA       ILE  25   3.002 -15.073  -0.522
  186    HB   ILE  25           HB       ILE  25   3.069 -12.166  -0.752
  187   1HG1  ILE  25          2HG1      ILE  25   0.778 -13.421   0.778
  188   2HG1  ILE  25          1HG1      ILE  25   1.848 -12.141   1.342
  189   1HG2  ILE  25          1HG2      ILE  25   2.296 -14.242  -2.280
  190   2HG2  ILE  25          2HG2      ILE  25   1.739 -12.589  -2.525
  191   3HG2  ILE  25          3HG2      ILE  25   0.735 -13.732  -1.638
  192   1HD1  ILE  25          1HD1      ILE  25  -0.294 -11.993  -0.749
  193   2HD1  ILE  25          2HD1      ILE  25   0.953 -10.757  -0.585
  194   3HD1  ILE  25          3HD1      ILE  25  -0.151 -11.078   0.752
  195    H    GLY  26           H        GLY  26   4.434 -13.920  -2.286
  196   1HA   GLY  26          2HA       GLY  26   7.124 -14.283  -1.464
  197   2HA   GLY  26          1HA       GLY  26   6.590 -13.697  -3.036
  198    H    ASP  27           H        ASP  27   8.810 -12.861  -1.242
  199    HA   ASP  27           HA       ASP  27   8.288 -10.387  -0.051
  200   1HB   ASP  27          2HB       ASP  27  10.709  -9.990  -0.215
  201   2HB   ASP  27          1HB       ASP  27  10.368 -11.628   0.333
  202    H    TYR  28           H        TYR  28   8.555 -11.294  -3.352
  203    HA   TYR  28           HA       TYR  28   9.396  -9.044  -4.683
  204   1HB   TYR  28          2HB       TYR  28   8.297 -11.391  -5.457
  205   2HB   TYR  28          1HB       TYR  28   6.927 -10.319  -5.735
  206    HD1  TYR  28           1HD      TYR  28   8.773  -7.886  -6.381
  207    HD2  TYR  28           2HD      TYR  28   8.577 -11.878  -7.829
  208    HE1  TYR  28           1HE      TYR  28   9.747  -7.151  -8.497
  209    HE2  TYR  28           2HE      TYR  28   9.559 -11.154  -9.964
  210    HH   TYR  28           HH       TYR  28   9.696  -8.971 -11.283
  211    H    TYR  29           H        TYR  29   6.199  -9.734  -3.410
  212    HA   TYR  29           HA       TYR  29   5.009  -7.337  -4.349
  213   1HB   TYR  29          2HB       TYR  29   3.957  -9.112  -2.153
  214   2HB   TYR  29          1HB       TYR  29   3.038  -8.118  -3.280
  215    HD1  TYR  29           1HD      TYR  29   4.638  -8.796  -5.776
  216    HD2  TYR  29           2HD      TYR  29   2.998 -11.237  -2.690
  217    HE1  TYR  29           1HE      TYR  29   4.540 -10.703  -7.333
  218    HE2  TYR  29           2HE      TYR  29   2.882 -13.140  -4.246
  219    HH   TYR  29           HH       TYR  29   2.815 -13.066  -7.246
  220    H    ILE  30           H        ILE  30   5.817  -8.341  -0.981
  221    HA   ILE  30           HA       ILE  30   5.116  -6.023   0.323
  222    HB   ILE  30           HB       ILE  30   6.037  -7.933   1.509
  223   1HG1  ILE  30          2HG1      ILE  30   6.152  -5.615   2.506
  224   2HG1  ILE  30          1HG1      ILE  30   7.264  -6.788   3.195
  225   1HG2  ILE  30          1HG2      ILE  30   7.697  -8.654  -0.016
  226   2HG2  ILE  30          2HG2      ILE  30   8.488  -8.315   1.525
  227   3HG2  ILE  30          3HG2      ILE  30   8.620  -7.167   0.190
  228   1HD1  ILE  30          1HD1      ILE  30   8.703  -5.583   1.156
  229   2HD1  ILE  30          2HD1      ILE  30   8.857  -5.286   2.888
  230   3HD1  ILE  30          3HD1      ILE  30   7.798  -4.270   1.909
  231    H    LYS  31           H        LYS  31   7.751  -6.593  -1.861
  232    HA   LYS  31           HA       LYS  31   9.012  -4.031  -1.422
  233   1HB   LYS  31          2HB       LYS  31   9.484  -6.232  -3.427
  234   2HB   LYS  31          1HB       LYS  31  10.448  -4.764  -3.342
  235   1HG   LYS  31          2HG       LYS  31  10.158  -6.751  -1.097
  236   2HG   LYS  31          1HG       LYS  31  11.505  -6.705  -2.236
  237   1HD   LYS  31          2HD       LYS  31  12.483  -4.991  -1.174
  238   2HD   LYS  31          1HD       LYS  31  10.960  -4.122  -0.991
  239   1HE   LYS  31          2HE       LYS  31  11.268  -4.564   1.196
  240   2HE   LYS  31          1HE       LYS  31  10.586  -6.132   0.769
  241   1HZ   LYS  31          1HZ       LYS  31  13.457  -5.851   0.414
  242   2HZ   LYS  31          2HZ       LYS  31  12.562  -7.154   1.015
  243   3HZ   LYS  31          3HZ       LYS  31  12.910  -5.835   2.016
  244    H    LEU  32           H        LEU  32   7.224  -5.645  -4.053
  245    HA   LEU  32           HA       LEU  32   7.247  -3.561  -5.867
  246   1HB   LEU  32          2HB       LEU  32   6.027  -4.965  -7.120
  247   2HB   LEU  32          1HB       LEU  32   6.183  -6.083  -5.788
  248    HG   LEU  32           HG       LEU  32   3.915  -6.092  -6.379
  249   1HD1  LEU  32          1HD1      LEU  32   3.297  -4.312  -4.265
  250   2HD1  LEU  32          2HD1      LEU  32   4.833  -5.108  -3.915
  251   3HD1  LEU  32          3HD1      LEU  32   3.391  -6.077  -4.237
  252   1HD2  LEU  32          1HD2      LEU  32   2.742  -4.356  -7.194
  253   2HD2  LEU  32          2HD2      LEU  32   4.322  -3.599  -7.395
  254   3HD2  LEU  32          3HD2      LEU  32   3.351  -3.245  -5.968
  255    H    ILE  33           H        ILE  33   5.687  -3.746  -2.867
  256    HA   ILE  33           HA       ILE  33   3.580  -1.858  -3.370
  257    HB   ILE  33           HB       ILE  33   4.696  -3.231  -0.950
  258   1HG1  ILE  33          2HG1      ILE  33   2.065  -3.126  -2.402
  259   2HG1  ILE  33          1HG1      ILE  33   3.097  -4.518  -2.091
  260   1HG2  ILE  33          1HG2      ILE  33   4.112  -1.650   0.484
  261   2HG2  ILE  33          2HG2      ILE  33   2.466  -1.659  -0.144
  262   3HG2  ILE  33          3HG2      ILE  33   3.670  -0.591  -0.850
  263   1HD1  ILE  33          1HD1      ILE  33   0.851  -3.657  -0.647
  264   2HD1  ILE  33          2HD1      ILE  33   2.250  -3.407   0.400
  265   3HD1  ILE  33          3HD1      ILE  33   1.933  -5.002  -0.281
  266    H    ASN  34           H        ASN  34   6.571  -1.775  -1.432
  267    HA   ASN  34           HA       ASN  34   6.548   0.889  -0.731
  268   1HB   ASN  34          2HB       ASN  34   8.265  -1.188  -0.346
  269   2HB   ASN  34          1HB       ASN  34   9.212  -0.170  -1.426
  270   1HD2  ASN  34          1HD2      ASN  34   9.661   1.994  -0.778
  271   2HD2  ASN  34          2HD2      ASN  34   9.695   2.415   0.897
  272    H    ASN  35           H        ASN  35   7.172  -0.494  -3.842
  273    HA   ASN  35           HA       ASN  35   8.655   1.673  -4.934
  274   1HB   ASN  35          2HB       ASN  35   8.180  -0.850  -5.755
  275   2HB   ASN  35          1HB       ASN  35   7.015   0.011  -6.756
  276   1HD2  ASN  35          1HD2      ASN  35   8.033   2.122  -7.693
  277   2HD2  ASN  35          2HD2      ASN  35   9.564   1.896  -8.462
  278    H    ALA  36           H        ALA  36   5.253   1.060  -4.500
  279    HA   ALA  36           HA       ALA  36   4.128   2.689  -6.434
  280   1HB   ALA  36          1HB       ALA  36   2.462   3.086  -4.304
  281   2HB   ALA  36          2HB       ALA  36   3.275   1.580  -3.877
  282   3HB   ALA  36          3HB       ALA  36   2.407   1.710  -5.405
  283    H    LYS  37           H        LYS  37   3.398   4.822  -6.469
  284    HA   LYS  37           HA       LYS  37   5.070   6.652  -4.915
  285   1HB   LYS  37          2HB       LYS  37   3.279   7.425  -7.207
  286   2HB   LYS  37          1HB       LYS  37   4.699   8.253  -6.597
  287   1HG   LYS  37          2HG       LYS  37   5.633   7.335  -8.431
  288   2HG   LYS  37          1HG       LYS  37   5.860   5.977  -7.328
  289   1HD   LYS  37          2HD       LYS  37   3.247   5.843  -8.509
  290   2HD   LYS  37          1HD       LYS  37   4.466   6.006  -9.775
  291   1HE   LYS  37          2HE       LYS  37   5.446   4.001  -9.282
  292   2HE   LYS  37          1HE       LYS  37   4.984   4.070  -7.582
  293   1HZ   LYS  37          1HZ       LYS  37   3.738   2.362  -8.683
  294   2HZ   LYS  37          2HZ       LYS  37   3.202   3.439  -9.870
  295   3HZ   LYS  37          3HZ       LYS  37   2.681   3.617  -8.271
  296    H    THR  38           H        THR  38   1.724   5.864  -5.594
  297    HA   THR  38           HA       THR  38   0.777   7.973  -3.808
  298    HB   THR  38           HB       THR  38  -1.409   7.534  -4.656
  299    HG1  THR  38           1HG      THR  38  -1.756   5.449  -4.803
  300   1HG2  THR  38          1HG2      THR  38  -0.891   8.572  -6.532
  301   2HG2  THR  38          2HG2      THR  38  -0.580   7.001  -7.264
  302   3HG2  THR  38          3HG2      THR  38   0.736   7.907  -6.520
  303    H    VAL  39           H        VAL  39  -1.610   6.444  -3.000
  304    HA   VAL  39           HA       VAL  39  -0.366   4.389  -1.327
  305    HB   VAL  39           HB       VAL  39  -0.796   6.691  -0.171
  306   1HG1  VAL  39          1HG1      VAL  39  -2.915   6.836   0.940
  307   2HG1  VAL  39          2HG1      VAL  39  -3.462   5.350   0.163
  308   3HG1  VAL  39          3HG1      VAL  39  -3.178   6.797  -0.805
  309   1HG2  VAL  39          1HG2      VAL  39  -1.200   3.911   0.779
  310   2HG2  VAL  39          2HG2      VAL  39  -1.438   5.246   1.905
  311   3HG2  VAL  39          3HG2      VAL  39   0.122   5.025   1.107
  312    H    GLU  40           H        GLU  40  -3.431   5.725  -2.514
  313    HA   GLU  40           HA       GLU  40  -5.171   3.765  -1.689
  314   1HB   GLU  40          2HB       GLU  40  -5.072   5.598  -4.019
  315   2HB   GLU  40          1HB       GLU  40  -6.215   4.263  -4.105
  316   1HG   GLU  40          2HG       GLU  40  -7.641   5.476  -2.932
  317   2HG   GLU  40          1HG       GLU  40  -6.542   5.367  -1.560
  318    H    GLY  41           H        GLY  41  -2.784   3.612  -4.227
  319   1HA   GLY  41          2HA       GLY  41  -3.790   1.068  -5.216
  320   2HA   GLY  41          1HA       GLY  41  -2.387   1.940  -5.817
  321    H    VAL  42           H        VAL  42  -1.292   2.273  -3.103
  322    HA   VAL  42           HA       VAL  42   0.406   0.064  -3.017
  323    HB   VAL  42           HB       VAL  42  -0.265   1.895  -0.714
  324   1HG1  VAL  42          1HG1      VAL  42   1.863  -0.122  -1.249
  325   2HG1  VAL  42          2HG1      VAL  42   0.928   0.163   0.226
  326   3HG1  VAL  42          3HG1      VAL  42   2.223   1.279  -0.235
  327   1HG2  VAL  42          1HG2      VAL  42   0.585   2.847  -3.021
  328   2HG2  VAL  42          2HG2      VAL  42   2.135   2.246  -2.438
  329   3HG2  VAL  42          3HG2      VAL  42   1.245   3.435  -1.496
  330    H    GLU  43           H        GLU  43  -2.380   0.826  -0.945
  331    HA   GLU  43           HA       GLU  43  -2.206  -1.570   0.573
  332   1HB   GLU  43          2HB       GLU  43  -4.744  -0.915   0.999
  333   2HB   GLU  43          1HB       GLU  43  -3.425  -0.012   1.731
  334   1HG   GLU  43          2HG       GLU  43  -3.624   1.740   0.172
  335   2HG   GLU  43          1HG       GLU  43  -4.677   0.787  -0.876
  336    H    SER  44           H        SER  44  -4.369  -0.581  -2.069
  337    HA   SER  44           HA       SER  44  -5.730  -3.040  -2.264
  338   1HB   SER  44          2HB       SER  44  -6.856  -2.072  -4.012
  339   2HB   SER  44          1HB       SER  44  -6.160  -0.611  -3.309
  340    HG   SER  44           HG       SER  44  -4.433  -0.836  -4.827
  341    H    LEU  45           H        LEU  45  -2.635  -1.989  -3.333
  342    HA   LEU  45           HA       LEU  45  -2.177  -3.671  -5.517
  343   1HB   LEU  45          2HB       LEU  45  -0.556  -2.133  -3.618
  344   2HB   LEU  45          1HB       LEU  45   0.270  -3.525  -4.281
  345   1HD1  LEU  45          1HD1      LEU  45   1.194  -3.612  -6.052
  346   2HD1  LEU  45          2HD1      LEU  45   1.884  -2.009  -6.311
  347   3HD1  LEU  45          3HD1      LEU  45   0.777  -2.696  -7.500
  348   1HD2  LEU  45          1HD2      LEU  45  -1.416  -2.647  -7.329
  349   2HD2  LEU  45          2HD2      LEU  45  -1.235  -0.898  -7.210
  350   3HD2  LEU  45          3HD2      LEU  45  -2.269  -1.756  -6.070
  351    H    LYS  46           H        LYS  46  -1.157  -4.221  -2.132
  352    HA   LYS  46           HA       LYS  46  -0.452  -6.930  -2.623
  353   1HB   LYS  46          2HB       LYS  46   0.682  -6.378  -0.772
  354   2HB   LYS  46          1HB       LYS  46  -0.428  -5.086  -0.352
  355   1HG   LYS  46          2HG       LYS  46  -1.171  -7.945   0.151
  356   2HG   LYS  46          1HG       LYS  46  -0.096  -7.084   1.257
  357   1HD   LYS  46          2HD       LYS  46  -1.862  -5.276   1.374
  358   2HD   LYS  46          1HD       LYS  46  -2.935  -6.390   0.534
  359   1HE   LYS  46          2HE       LYS  46  -3.022  -7.864   2.306
  360   2HE   LYS  46          1HE       LYS  46  -1.517  -7.268   3.007
  361   1HZ   LYS  46          1HZ       LYS  46  -2.884  -6.175   4.384
  362   2HZ   LYS  46          2HZ       LYS  46  -4.221  -6.314   3.360
  363   3HZ   LYS  46          3HZ       LYS  46  -3.085  -5.088   3.104
  364    H    ASN  47           H        ASN  47  -3.296  -5.408  -1.118
  365    HA   ASN  47           HA       ASN  47  -4.595  -7.781  -0.402
  366   1HB   ASN  47          2HB       ASN  47  -5.180  -5.118  -0.144
  367   2HB   ASN  47          1HB       ASN  47  -6.370  -5.615  -1.343
  368   1HD2  ASN  47          1HD2      ASN  47  -5.459  -5.668   1.936
  369   2HD2  ASN  47          2HD2      ASN  47  -6.780  -6.610   2.530
  370    H    GLU  48           H        GLU  48  -4.198  -6.238  -3.476
  371    HA   GLU  48           HA       GLU  48  -6.269  -7.770  -4.783
  372   1HB   GLU  48          2HB       GLU  48  -5.695  -5.542  -5.625
  373   2HB   GLU  48          1HB       GLU  48  -4.042  -6.064  -5.922
  374   1HG   GLU  48          2HG       GLU  48  -4.610  -7.288  -7.771
  375   2HG   GLU  48          1HG       GLU  48  -6.269  -7.542  -7.227
  376    H    ILE  49           H        ILE  49  -2.778  -7.865  -4.414
  377    HA   ILE  49           HA       ILE  49  -2.254  -9.976  -6.220
  378    HB   ILE  49           HB       ILE  49  -0.121 -10.190  -5.226
  379   1HG1  ILE  49          2HG1      ILE  49  -0.892  -8.642  -2.772
  380   2HG1  ILE  49          1HG1      ILE  49  -1.139 -10.374  -2.838
  381   1HG2  ILE  49          1HG2      ILE  49  -0.138  -7.439  -4.434
  382   2HG2  ILE  49          2HG2      ILE  49  -1.140  -7.674  -5.865
  383   3HG2  ILE  49          3HG2      ILE  49   0.545  -8.190  -5.875
  384   1HD1  ILE  49          1HD1      ILE  49   1.525  -9.354  -3.558
  385   2HD1  ILE  49          2HD1      ILE  49   1.052 -10.821  -2.699
  386   3HD1  ILE  49          3HD1      ILE  49   1.036  -9.264  -1.866
  387    H    LEU  50           H        LEU  50  -3.356  -9.818  -2.935
  388    HA   LEU  50           HA       LEU  50  -3.044 -12.573  -2.322
  389   1HB   LEU  50          2HB       LEU  50  -4.630 -10.327  -1.087
  390   2HB   LEU  50          1HB       LEU  50  -4.634 -11.953  -0.425
  391    HG   LEU  50           HG       LEU  50  -1.965 -10.786  -0.878
  392   1HD1  LEU  50          1HD1      LEU  50  -3.888  -9.646   1.128
  393   2HD1  LEU  50          2HD1      LEU  50  -2.960  -8.792  -0.105
  394   3HD1  LEU  50          3HD1      LEU  50  -2.135  -9.510   1.279
  395   1HD2  LEU  50          1HD2      LEU  50  -3.343 -12.534   1.098
  396   2HD2  LEU  50          2HD2      LEU  50  -1.876 -11.686   1.587
  397   3HD2  LEU  50          3HD2      LEU  50  -1.838 -12.793   0.214
  398    H    LYS  51           H        LYS  51  -5.577 -10.599  -3.736
  399    HA   LYS  51           HA       LYS  51  -7.720 -12.396  -3.520
  400   1HB   LYS  51          2HB       LYS  51  -7.992 -10.062  -4.245
  401   2HB   LYS  51          1HB       LYS  51  -7.119 -10.416  -5.729
  402   1HG   LYS  51          2HG       LYS  51  -9.051 -12.264  -5.903
  403   2HG   LYS  51          1HG       LYS  51  -9.900 -11.030  -4.969
  404   1HD   LYS  51          2HD       LYS  51  -8.376  -9.986  -7.245
  405   2HD   LYS  51          1HD       LYS  51  -9.692 -11.075  -7.691
  406   1HE   LYS  51          2HE       LYS  51 -11.017  -9.596  -5.942
  407   2HE   LYS  51          1HE       LYS  51  -9.784  -8.412  -6.370
  408   1HZ   LYS  51          1HZ       LYS  51 -11.803  -8.262  -7.743
  409   2HZ   LYS  51          2HZ       LYS  51 -11.511  -9.818  -8.334
  410   3HZ   LYS  51          3HZ       LYS  51 -10.417  -8.570  -8.660
  411    H    ALA  52           H        ALA  52  -4.902 -12.376  -5.515
  412    HA   ALA  52           HA       ALA  52  -5.676 -14.951  -6.641
  413   1HB   ALA  52          1HB       ALA  52  -4.762 -12.619  -8.321
  414   2HB   ALA  52          2HB       ALA  52  -6.350 -13.385  -8.357
  415   3HB   ALA  52          3HB       ALA  52  -4.928 -14.277  -8.897
  416    H    LEU  53           H        LEU  53  -4.074 -15.415  -4.886
  417    HA   LEU  53           HA       LEU  53  -1.401 -14.648  -4.976
  418   1HB   LEU  53          2HB       LEU  53  -2.951 -16.335  -3.420
  419   2HB   LEU  53          1HB       LEU  53  -1.768 -17.414  -4.135
  420    HG   LEU  53           HG       LEU  53  -0.082 -15.534  -3.315
  421   1HD1  LEU  53          1HD1      LEU  53  -1.490 -13.935  -2.395
  422   2HD1  LEU  53          2HD1      LEU  53  -0.950 -14.850  -0.988
  423   3HD1  LEU  53          3HD1      LEU  53  -2.551 -15.142  -1.669
  424   1HD2  LEU  53          1HD2      LEU  53   0.579 -17.057  -1.787
  425   2HD2  LEU  53          2HD2      LEU  53  -0.634 -18.063  -2.581
  426   3HD2  LEU  53          3HD2      LEU  53  -1.032 -17.215  -1.086
  427    HA   PRO  54           HA       PRO  54  -0.690 -18.835  -7.552
  428   1HB   PRO  54          2HB       PRO  54  -3.266 -18.619  -9.044
  429   2HB   PRO  54          1HB       PRO  54  -2.364 -20.060  -8.558
  430   1HG   PRO  54          2HG       PRO  54  -4.554 -19.326  -7.237
  431   2HG   PRO  54          1HG       PRO  54  -3.146 -19.975  -6.375
  432   1HD   PRO  54          2HD       PRO  54  -4.115 -17.163  -6.579
  433   2HD   PRO  54          1HD       PRO  54  -3.322 -17.990  -5.224
  434    H    THR  55           H        THR  55   0.599 -18.467  -9.256
  435    HA   THR  55           HA       THR  55   0.530 -15.942 -10.586
  436    HB   THR  55           HB       THR  55   2.325 -17.346 -12.035
  437    HG1  THR  55           1HG      THR  55   2.935 -19.108 -11.080
  438   1HG2  THR  55          1HG2      THR  55   3.234 -15.529 -10.999
  439   2HG2  THR  55          2HG2      THR  55   3.965 -16.836 -10.066
  440   3HG2  THR  55          3HG2      THR  55   2.577 -15.960  -9.419
  441    H    GLU  56           H        GLU  56  -1.287 -15.704 -11.822
  442    HA   GLU  56           HA       GLU  56  -1.335 -17.188 -14.314
  443   1HB   GLU  56          2HB       GLU  56  -3.849 -17.553 -14.044
  444   2HB   GLU  56          1HB       GLU  56  -2.785 -18.623 -13.143
  445   1HG   GLU  56          2HG       GLU  56  -3.104 -17.017 -11.191
  446   2HG   GLU  56          1HG       GLU  56  -4.437 -16.339 -12.125
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1  -3.893  21.398  11.716
    2   2H    MET   1          2HT       MET   1  -2.444  20.572  12.124
    3   3H    MET   1          3HT       MET   1  -3.955  19.770  12.233
    4    HA   MET   1           HA       MET   1  -2.989  18.997  10.313
    5   1HB   MET   1          2HB       MET   1  -5.069  21.124   9.967
    6   2HB   MET   1          1HB       MET   1  -4.434  20.295   8.543
    7   1HG   MET   1          2HG       MET   1  -5.001  18.187  10.113
    8   2HG   MET   1          1HG       MET   1  -6.229  19.322  10.663
    9   1HE   MET   1          1HE       MET   1  -5.155  18.016   6.614
   10   2HE   MET   1          2HE       MET   1  -6.029  16.653   7.296
   11   3HE   MET   1          3HE       MET   1  -4.639  17.323   8.140
   12    H    GLU   2           H        GLU   2  -1.065  19.189   9.377
   13    HA   GLU   2           HA       GLU   2  -0.333  21.777   8.196
   14   1HB   GLU   2          2HB       GLU   2   0.882  20.845  10.428
   15   2HB   GLU   2          1HB       GLU   2   1.886  20.096   9.196
   16   1HG   GLU   2          2HG       GLU   2   3.013  22.039   9.412
   17   2HG   GLU   2          1HG       GLU   2   1.820  22.579   8.232
   18    H    ALA   3           H        ALA   3   1.078  18.506   8.345
   19    HA   ALA   3           HA       ALA   3   0.451  17.746   5.730
   20   1HB   ALA   3          1HB       ALA   3   2.912  19.390   6.012
   21   2HB   ALA   3          2HB       ALA   3   1.773  19.269   4.669
   22   3HB   ALA   3          3HB       ALA   3   2.967  17.998   4.929
   23    H    VAL   4           H        VAL   4   0.500  15.616   5.918
   24    HA   VAL   4           HA       VAL   4   2.873  14.254   6.838
   25    HB   VAL   4           HB       VAL   4   1.598  12.867   8.509
   26   1HG1  VAL   4          1HG1      VAL   4   1.819  15.793   9.209
   27   2HG1  VAL   4          2HG1      VAL   4   3.183  14.676   9.122
   28   3HG1  VAL   4          3HG1      VAL   4   1.912  14.427  10.316
   29   1HG2  VAL   4          1HG2      VAL   4  -0.366  14.247   9.515
   30   2HG2  VAL   4          2HG2      VAL   4  -0.647  13.213   8.123
   31   3HG2  VAL   4          3HG2      VAL   4  -0.457  14.950   7.901
   32    H    ASP   5           H        ASP   5   1.261  14.432   4.406
   33    HA   ASP   5           HA       ASP   5  -0.357  12.190   4.020
   34   1HB   ASP   5          2HB       ASP   5   0.125  14.282   2.500
   35   2HB   ASP   5          1HB       ASP   5   1.333  13.222   1.783
   36    H    ALA   6           H        ALA   6   3.118  12.586   3.913
   37    HA   ALA   6           HA       ALA   6   3.716  10.111   2.655
   38   1HB   ALA   6          1HB       ALA   6   5.733  11.043   2.611
   39   2HB   ALA   6          2HB       ALA   6   5.853  10.870   4.362
   40   3HB   ALA   6          3HB       ALA   6   5.167  12.341   3.662
   41    H    ASN   7           H        ASN   7   3.228  11.083   5.999
   42    HA   ASN   7           HA       ASN   7   4.198   8.729   7.214
   43   1HB   ASN   7          2HB       ASN   7   3.336  11.144   8.142
   44   2HB   ASN   7          1HB       ASN   7   1.975  10.112   8.574
   45   1HD2  ASN   7          1HD2      ASN   7   2.135   8.837  10.305
   46   2HD2  ASN   7          2HD2      ASN   7   3.563   8.616  11.248
   47    H    SER   8           H        SER   8   0.925   9.735   6.269
   48    HA   SER   8           HA       SER   8  -0.320   7.323   7.110
   49   1HB   SER   8          2HB       SER   8  -1.128   9.812   5.874
   50   2HB   SER   8          1HB       SER   8  -1.919   8.448   5.092
   51    HG   SER   8           HG       SER   8  -1.832   8.754   7.900
   52    H    LEU   9           H        LEU   9   1.190   8.399   4.158
   53    HA   LEU   9           HA       LEU   9   0.219   6.398   2.426
   54   1HB   LEU   9          2HB       LEU   9   1.362   8.543   1.778
   55   2HB   LEU   9          1HB       LEU   9   2.878   7.815   2.267
   56    HG   LEU   9           HG       LEU   9   1.106   6.714   0.092
   57   1HD1  LEU   9          1HD1      LEU   9   2.841   7.616  -1.434
   58   2HD1  LEU   9          2HD1      LEU   9   3.522   8.479  -0.062
   59   3HD1  LEU   9          3HD1      LEU   9   1.891   8.854  -0.613
   60   1HD2  LEU   9          1HD2      LEU   9   2.372   4.907   0.533
   61   2HD2  LEU   9          2HD2      LEU   9   3.612   5.848   1.365
   62   3HD2  LEU   9          3HD2      LEU   9   3.585   5.786  -0.397
   63    H    ALA  10           H        ALA  10   3.156   6.657   4.394
   64    HA   ALA  10           HA       ALA  10   4.322   4.223   3.587
   65   1HB   ALA  10          1HB       ALA  10   5.329   6.249   4.854
   66   2HB   ALA  10          2HB       ALA  10   5.954   4.634   5.157
   67   3HB   ALA  10          3HB       ALA  10   4.825   5.372   6.294
   68    H    GLN  11           H        GLN  11   1.706   4.869   5.708
   69    HA   GLN  11           HA       GLN  11   1.986   2.483   7.281
   70   1HB   GLN  11          2HB       GLN  11   0.926   4.329   8.346
   71   2HB   GLN  11          1HB       GLN  11  -0.199   4.537   7.010
   72   1HG   GLN  11          2HG       GLN  11  -1.166   2.349   7.538
   73   2HG   GLN  11          1HG       GLN  11  -0.112   2.236   8.942
   74   1HE2  GLN  11          1HE2      GLN  11  -2.254   2.003   9.995
   75   2HE2  GLN  11          2HE2      GLN  11  -3.067   3.443  10.496
   76    H    ALA  12           H        ALA  12  -0.005   3.539   4.549
   77    HA   ALA  12           HA       ALA  12  -1.715   1.379   4.336
   78   1HB   ALA  12          1HB       ALA  12  -1.293   3.572   2.856
   79   2HB   ALA  12          2HB       ALA  12  -2.235   2.192   2.284
   80   3HB   ALA  12          3HB       ALA  12  -0.542   2.364   1.809
   81    H    LYS  13           H        LYS  13   1.620   1.725   3.339
   82    HA   LYS  13           HA       LYS  13   1.732  -0.967   2.243
   83   1HB   LYS  13          2HB       LYS  13   4.300  -0.187   2.197
   84   2HB   LYS  13          1HB       LYS  13   3.143   0.243   0.952
   85   1HG   LYS  13          2HG       LYS  13   2.882   2.406   1.756
   86   2HG   LYS  13          1HG       LYS  13   3.607   2.002   3.318
   87   1HD   LYS  13          2HD       LYS  13   5.694   2.349   2.552
   88   2HD   LYS  13          1HD       LYS  13   5.370   1.494   1.042
   89   1HE   LYS  13          2HE       LYS  13   4.052   3.581   0.365
   90   2HE   LYS  13          1HE       LYS  13   4.868   4.375   1.711
   91   1HZ   LYS  13          1HZ       LYS  13   6.158   4.793  -0.195
   92   2HZ   LYS  13          2HZ       LYS  13   6.094   3.182  -0.707
   93   3HZ   LYS  13          3HZ       LYS  13   6.998   3.600   0.660
   94    H    GLU  14           H        GLU  14   3.392   0.865   4.829
   95    HA   GLU  14           HA       GLU  14   4.826  -1.176   5.992
   96   1HB   GLU  14          2HB       GLU  14   3.475   1.258   7.129
   97   2HB   GLU  14          1HB       GLU  14   4.258   0.109   8.205
   98   1HG   GLU  14          2HG       GLU  14   6.376   0.494   7.238
   99   2HG   GLU  14          1HG       GLU  14   5.674   1.370   5.878
  100    H    ALA  15           H        ALA  15   1.438  -0.388   6.209
  101    HA   ALA  15           HA       ALA  15   0.852  -2.448   8.161
  102   1HB   ALA  15          1HB       ALA  15  -0.403  -0.224   7.828
  103   2HB   ALA  15          2HB       ALA  15  -1.353  -1.680   8.125
  104   3HB   ALA  15          3HB       ALA  15  -1.204  -1.043   6.487
  105    H    ALA  16           H        ALA  16   0.215  -1.917   4.700
  106    HA   ALA  16           HA       ALA  16  -1.090  -4.345   4.182
  107   1HB   ALA  16          1HB       ALA  16   0.448  -2.435   2.448
  108   2HB   ALA  16          2HB       ALA  16  -1.290  -2.732   2.508
  109   3HB   ALA  16          3HB       ALA  16  -0.215  -3.934   1.796
  110    H    ILE  17           H        ILE  17   2.244  -3.584   4.651
  111    HA   ILE  17           HA       ILE  17   3.341  -5.900   3.397
  112    HB   ILE  17           HB       ILE  17   4.337  -3.586   4.874
  113   1HG1  ILE  17          2HG1      ILE  17   6.282  -4.964   3.249
  114   2HG1  ILE  17          1HG1      ILE  17   4.736  -4.882   2.410
  115   1HG2  ILE  17          1HG2      ILE  17   5.036  -5.164   6.541
  116   2HG2  ILE  17          2HG2      ILE  17   6.446  -4.643   5.620
  117   3HG2  ILE  17          3HG2      ILE  17   5.725  -6.223   5.310
  118   1HD1  ILE  17          1HD1      ILE  17   5.356  -2.853   1.768
  119   2HD1  ILE  17          2HD1      ILE  17   6.683  -2.806   2.928
  120   3HD1  ILE  17          3HD1      ILE  17   5.057  -2.340   3.428
  121    H    LYS  18           H        LYS  18   2.308  -5.043   6.643
  122    HA   LYS  18           HA       LYS  18   3.329  -7.226   8.055
  123   1HB   LYS  18          2HB       LYS  18   1.456  -5.090   8.501
  124   2HB   LYS  18          1HB       LYS  18   0.806  -6.586   9.160
  125   1HG   LYS  18          2HG       LYS  18   2.031  -6.196  10.967
  126   2HG   LYS  18          1HG       LYS  18   3.449  -6.582   9.990
  127   1HD   LYS  18          2HD       LYS  18   3.307  -4.089   9.270
  128   2HD   LYS  18          1HD       LYS  18   2.319  -3.907  10.720
  129   1HE   LYS  18          2HE       LYS  18   4.447  -3.436  11.501
  130   2HE   LYS  18          1HE       LYS  18   4.263  -5.142  11.903
  131   1HZ   LYS  18          1HZ       LYS  18   6.381  -4.902  10.938
  132   2HZ   LYS  18          2HZ       LYS  18   5.795  -3.962   9.660
  133   3HZ   LYS  18          3HZ       LYS  18   5.419  -5.610   9.739
  134    H    GLU  19           H        GLU  19   0.568  -6.935   5.949
  135    HA   GLU  19           HA       GLU  19  -0.622  -9.427   6.730
  136   1HB   GLU  19          2HB       GLU  19  -1.111  -7.420   4.563
  137   2HB   GLU  19          1HB       GLU  19  -1.837  -9.016   4.436
  138   1HG   GLU  19          2HG       GLU  19  -2.179  -7.650   7.023
  139   2HG   GLU  19          1HG       GLU  19  -3.009  -6.926   5.646
  140    H    LEU  20           H        LEU  20   1.570  -8.330   4.207
  141    HA   LEU  20           HA       LEU  20   1.542 -10.672   2.654
  142   1HB   LEU  20          2HB       LEU  20   3.064  -8.235   2.766
  143   2HB   LEU  20          1HB       LEU  20   4.137  -9.602   2.518
  144    HG   LEU  20           HG       LEU  20   1.987 -10.014   0.773
  145   1HD1  LEU  20          1HD1      LEU  20   1.495  -8.080  -0.315
  146   2HD1  LEU  20          2HD1      LEU  20   3.007  -7.300   0.156
  147   3HD1  LEU  20          3HD1      LEU  20   1.699  -7.470   1.327
  148   1HD2  LEU  20          1HD2      LEU  20   3.637 -10.337  -0.707
  149   2HD2  LEU  20          2HD2      LEU  20   4.687 -10.168   0.698
  150   3HD2  LEU  20          3HD2      LEU  20   4.395  -8.785  -0.356
  151    H    LYS  21           H        LYS  21   3.234  -9.773   5.575
  152    HA   LYS  21           HA       LYS  21   4.927 -12.120   5.543
  153   1HB   LYS  21          2HB       LYS  21   5.688 -11.313   7.751
  154   2HB   LYS  21          1HB       LYS  21   5.810 -10.072   6.513
  155   1HG   LYS  21          2HG       LYS  21   3.802  -9.007   7.331
  156   2HG   LYS  21          1HG       LYS  21   3.575 -10.293   8.519
  157   1HD   LYS  21          2HD       LYS  21   6.142  -9.457   9.021
  158   2HD   LYS  21          1HD       LYS  21   5.326  -7.953   8.592
  159   1HE   LYS  21          2HE       LYS  21   4.728  -7.930  10.758
  160   2HE   LYS  21          1HE       LYS  21   3.495  -9.078  10.242
  161   1HZ   LYS  21          1HZ       LYS  21   5.376 -10.793  10.711
  162   2HZ   LYS  21          2HZ       LYS  21   4.447 -10.184  11.985
  163   3HZ   LYS  21          3HZ       LYS  21   5.995  -9.568  11.700
  164    H    GLN  22           H        GLN  22   2.003 -10.981   7.134
  165    HA   GLN  22           HA       GLN  22   1.773 -13.190   8.925
  166   1HB   GLN  22          2HB       GLN  22   0.615 -10.827   8.951
  167   2HB   GLN  22          1HB       GLN  22  -0.609 -11.637   7.983
  168   1HG   GLN  22          2HG       GLN  22  -0.478 -13.413   9.923
  169   2HG   GLN  22          1HG       GLN  22   0.130 -12.031  10.831
  170   1HE2  GLN  22          1HE2      GLN  22  -1.942 -12.675  11.990
  171   2HE2  GLN  22          2HE2      GLN  22  -3.378 -11.850  11.498
  172    H    TYR  23           H        TYR  23   0.862 -12.581   5.628
  173    HA   TYR  23           HA       TYR  23  -0.890 -14.874   5.440
  174   1HB   TYR  23          2HB       TYR  23   0.066 -12.752   3.560
  175   2HB   TYR  23          1HB       TYR  23  -0.592 -14.246   2.893
  176    HD1  TYR  23           1HD      TYR  23  -1.426 -11.024   3.563
  177    HD2  TYR  23           2HD      TYR  23  -2.858 -14.953   4.335
  178    HE1  TYR  23           1HE      TYR  23  -3.693 -10.134   3.839
  179    HE2  TYR  23           2HE      TYR  23  -5.134 -14.073   4.615
  180    HH   TYR  23           HH       TYR  23  -6.460 -12.154   4.001
  181    H    GLY  24           H        GLY  24   2.376 -13.970   4.455
  182   1HA   GLY  24          2HA       GLY  24   4.086 -15.706   4.532
  183   2HA   GLY  24          1HA       GLY  24   2.890 -16.821   3.889
  184    H    ILE  25           H        ILE  25   2.216 -14.179   2.175
  185    HA   ILE  25           HA       ILE  25   3.186 -15.093  -0.241
  186    HB   ILE  25           HB       ILE  25   3.189 -12.161  -0.163
  187   1HG1  ILE  25          2HG1      ILE  25   0.708 -13.657   0.719
  188   2HG1  ILE  25          1HG1      ILE  25   1.590 -12.444   1.643
  189   1HG2  ILE  25          1HG2      ILE  25   2.910 -12.869  -2.278
  190   2HG2  ILE  25          2HG2      ILE  25   1.202 -12.894  -1.829
  191   3HG2  ILE  25          3HG2      ILE  25   2.148 -14.381  -1.790
  192   1HD1  ILE  25          1HD1      ILE  25   1.048 -10.953  -0.459
  193   2HD1  ILE  25          2HD1      ILE  25  -0.118 -11.171   0.847
  194   3HD1  ILE  25          3HD1      ILE  25  -0.269 -12.107  -0.640
  195    H    GLY  26           H        GLY  26   4.781 -13.773  -1.707
  196   1HA   GLY  26          2HA       GLY  26   7.354 -13.959  -0.406
  197   2HA   GLY  26          1HA       GLY  26   7.061 -13.629  -2.111
  198    H    ASP  27           H        ASP  27   9.027 -12.280  -0.762
  199    HA   ASP  27           HA       ASP  27   8.120  -9.781   0.275
  200   1HB   ASP  27          2HB       ASP  27  10.690 -11.094  -0.218
  201   2HB   ASP  27          1HB       ASP  27  10.735  -9.357  -0.509
  202    H    TYR  28           H        TYR  28   8.701 -10.998  -2.904
  203    HA   TYR  28           HA       TYR  28   9.366  -8.801  -4.410
  204   1HB   TYR  28          2HB       TYR  28   8.500 -11.293  -5.033
  205   2HB   TYR  28          1HB       TYR  28   7.061 -10.365  -5.440
  206    HD1  TYR  28           1HD      TYR  28   8.708  -7.837  -6.210
  207    HD2  TYR  28           2HD      TYR  28   8.936 -11.929  -7.341
  208    HE1  TYR  28           1HE      TYR  28   9.710  -7.180  -8.341
  209    HE2  TYR  28           2HE      TYR  28   9.944 -11.283  -9.489
  210    HH   TYR  28           HH       TYR  28  11.138  -9.452 -10.488
  211    H    TYR  29           H        TYR  29   6.178  -9.738  -3.279
  212    HA   TYR  29           HA       TYR  29   4.905  -7.411  -4.324
  213   1HB   TYR  29          2HB       TYR  29   3.757  -9.407  -2.373
  214   2HB   TYR  29          1HB       TYR  29   2.875  -8.340  -3.459
  215    HD1  TYR  29           1HD      TYR  29   4.956  -8.750  -5.779
  216    HD2  TYR  29           2HD      TYR  29   2.713 -11.421  -3.323
  217    HE1  TYR  29           1HE      TYR  29   5.103 -10.481  -7.520
  218    HE2  TYR  29           2HE      TYR  29   2.840 -13.145  -5.072
  219    HH   TYR  29           HH       TYR  29   3.266 -12.841  -7.931
  220    H    ILE  30           H        ILE  30   6.464  -8.082  -1.296
  221    HA   ILE  30           HA       ILE  30   5.068  -5.999   0.127
  222    HB   ILE  30           HB       ILE  30   6.369  -6.447   1.948
  223   1HG1  ILE  30          2HG1      ILE  30   8.724  -7.574   1.634
  224   2HG1  ILE  30          1HG1      ILE  30   8.599  -6.887   0.017
  225   1HG2  ILE  30          1HG2      ILE  30   6.348  -8.914   0.284
  226   2HG2  ILE  30          2HG2      ILE  30   5.394  -8.503   1.706
  227   3HG2  ILE  30          3HG2      ILE  30   7.098  -8.921   1.878
  228   1HD1  ILE  30          1HD1      ILE  30   9.501  -5.073   0.937
  229   2HD1  ILE  30          2HD1      ILE  30   9.090  -5.583   2.575
  230   3HD1  ILE  30          3HD1      ILE  30   7.879  -4.780   1.570
  231    H    LYS  31           H        LYS  31   7.880  -6.366  -1.862
  232    HA   LYS  31           HA       LYS  31   8.902  -3.710  -1.422
  233   1HB   LYS  31          2HB       LYS  31   9.677  -6.102  -2.983
  234   2HB   LYS  31          1HB       LYS  31  10.203  -4.552  -3.624
  235   1HG   LYS  31          2HG       LYS  31  11.765  -4.297  -2.049
  236   2HG   LYS  31          1HG       LYS  31  10.688  -4.843  -0.762
  237   1HD   LYS  31          2HD       LYS  31  11.282  -7.092  -2.376
  238   2HD   LYS  31          1HD       LYS  31  12.804  -6.260  -2.054
  239   1HE   LYS  31          2HE       LYS  31  10.794  -7.147   0.012
  240   2HE   LYS  31          1HE       LYS  31  12.330  -7.937  -0.344
  241   1HZ   LYS  31          1HZ       LYS  31  12.490  -6.515   1.602
  242   2HZ   LYS  31          2HZ       LYS  31  12.012  -5.171   0.694
  243   3HZ   LYS  31          3HZ       LYS  31  13.483  -5.936   0.360
  244    H    LEU  32           H        LEU  32   7.342  -5.446  -4.123
  245    HA   LEU  32           HA       LEU  32   7.274  -3.380  -5.946
  246   1HB   LEU  32          2HB       LEU  32   6.100  -4.828  -7.208
  247   2HB   LEU  32          1HB       LEU  32   6.353  -5.943  -5.890
  248    HG   LEU  32           HG       LEU  32   4.082  -6.108  -6.418
  249   1HD1  LEU  32          1HD1      LEU  32   3.507  -6.048  -4.286
  250   2HD1  LEU  32          2HD1      LEU  32   3.469  -4.282  -4.302
  251   3HD1  LEU  32          3HD1      LEU  32   4.989  -5.129  -3.980
  252   1HD2  LEU  32          1HD2      LEU  32   2.761  -4.456  -7.203
  253   2HD2  LEU  32          2HD2      LEU  32   4.292  -3.631  -7.500
  254   3HD2  LEU  32          3HD2      LEU  32   3.369  -3.279  -6.039
  255    H    ILE  33           H        ILE  33   5.636  -3.656  -2.983
  256    HA   ILE  33           HA       ILE  33   3.453  -1.885  -3.512
  257    HB   ILE  33           HB       ILE  33   4.608  -3.266  -1.139
  258   1HG1  ILE  33          2HG1      ILE  33   1.896  -2.984  -2.411
  259   2HG1  ILE  33          1HG1      ILE  33   2.904  -4.419  -2.295
  260   1HG2  ILE  33          1HG2      ILE  33   3.807  -0.607  -0.833
  261   2HG2  ILE  33          2HG2      ILE  33   4.053  -1.804   0.432
  262   3HG2  ILE  33          3HG2      ILE  33   2.452  -1.575  -0.263
  263   1HD1  ILE  33          1HD1      ILE  33   2.256  -3.433   0.328
  264   2HD1  ILE  33          2HD1      ILE  33   1.942  -5.010  -0.397
  265   3HD1  ILE  33          3HD1      ILE  33   0.799  -3.688  -0.634
  266    H    ASN  34           H        ASN  34   6.427  -1.586  -1.576
  267    HA   ASN  34           HA       ASN  34   6.234   1.104  -0.955
  268   1HB   ASN  34          2HB       ASN  34   8.021  -0.871  -0.422
  269   2HB   ASN  34          1HB       ASN  34   8.963   0.137  -1.517
  270   1HD2  ASN  34          1HD2      ASN  34   9.230   2.381  -0.966
  271   2HD2  ASN  34          2HD2      ASN  34   9.218   2.861   0.694
  272    H    ASN  35           H        ASN  35   7.033  -0.360  -3.986
  273    HA   ASN  35           HA       ASN  35   8.463   1.825  -5.108
  274   1HB   ASN  35          2HB       ASN  35   8.413  -0.624  -5.887
  275   2HB   ASN  35          1HB       ASN  35   6.911  -0.202  -6.703
  276   1HD2  ASN  35          1HD2      ASN  35   9.390  -1.067  -7.875
  277   2HD2  ASN  35          2HD2      ASN  35   9.913   0.199  -8.929
  278    H    ALA  36           H        ALA  36   5.091   1.210  -4.639
  279    HA   ALA  36           HA       ALA  36   3.919   2.603  -6.716
  280   1HB   ALA  36          1HB       ALA  36   2.086   2.041  -5.617
  281   2HB   ALA  36          2HB       ALA  36   2.472   3.187  -4.333
  282   3HB   ALA  36          3HB       ALA  36   3.078   1.534  -4.250
  283    H    LYS  37           H        LYS  37   3.283   4.728  -7.061
  284    HA   LYS  37           HA       LYS  37   4.913   6.717  -5.680
  285   1HB   LYS  37          2HB       LYS  37   4.455   8.186  -7.538
  286   2HB   LYS  37          1HB       LYS  37   4.950   6.614  -8.163
  287   1HG   LYS  37          2HG       LYS  37   2.042   7.171  -7.838
  288   2HG   LYS  37          1HG       LYS  37   2.911   7.912  -9.184
  289   1HD   LYS  37          2HD       LYS  37   2.876   6.000 -10.319
  290   2HD   LYS  37          1HD       LYS  37   3.633   5.143  -8.975
  291   1HE   LYS  37          2HE       LYS  37   1.514   4.691  -7.975
  292   2HE   LYS  37          1HE       LYS  37   0.688   5.758  -9.109
  293   1HZ   LYS  37          1HZ       LYS  37   1.650   4.152 -10.866
  294   2HZ   LYS  37          2HZ       LYS  37   0.285   3.683  -9.984
  295   3HZ   LYS  37          3HZ       LYS  37   1.808   3.075  -9.570
  296    H    THR  38           H        THR  38   2.112   5.426  -4.982
  297    HA   THR  38           HA       THR  38   1.042   7.890  -3.845
  298    HB   THR  38           HB       THR  38  -1.180   7.532  -4.630
  299    HG1  THR  38           1HG      THR  38  -1.881   5.681  -5.412
  300   1HG2  THR  38          1HG2      THR  38  -1.006   8.069  -6.813
  301   2HG2  THR  38          2HG2      THR  38   0.145   6.779  -7.158
  302   3HG2  THR  38          3HG2      THR  38   0.688   8.260  -6.369
  303    H    VAL  39           H        VAL  39  -1.419   6.382  -3.014
  304    HA   VAL  39           HA       VAL  39  -0.205   4.378  -1.268
  305    HB   VAL  39           HB       VAL  39  -0.594   6.734  -0.180
  306   1HG1  VAL  39          1HG1      VAL  39  -2.989   6.827  -0.739
  307   2HG1  VAL  39          2HG1      VAL  39  -2.685   6.886   0.999
  308   3HG1  VAL  39          3HG1      VAL  39  -3.247   5.390   0.251
  309   1HG2  VAL  39          1HG2      VAL  39  -0.911   3.972   0.832
  310   2HG2  VAL  39          2HG2      VAL  39  -1.205   5.308   1.943
  311   3HG2  VAL  39          3HG2      VAL  39   0.363   5.145   1.146
  312    H    GLU  40           H        GLU  40  -3.239   5.758  -2.478
  313    HA   GLU  40           HA       GLU  40  -5.021   3.855  -1.592
  314   1HB   GLU  40          2HB       GLU  40  -4.905   5.646  -3.955
  315   2HB   GLU  40          1HB       GLU  40  -6.077   4.337  -4.005
  316   1HG   GLU  40          2HG       GLU  40  -7.410   5.835  -3.004
  317   2HG   GLU  40          1HG       GLU  40  -6.565   5.314  -1.547
  318    H    GLY  41           H        GLY  41  -2.771   3.656  -4.285
  319   1HA   GLY  41          2HA       GLY  41  -3.808   1.095  -5.157
  320   2HA   GLY  41          1HA       GLY  41  -2.409   1.935  -5.813
  321    H    VAL  42           H        VAL  42  -1.204   2.304  -3.174
  322    HA   VAL  42           HA       VAL  42   0.475   0.097  -3.072
  323    HB   VAL  42           HB       VAL  42  -0.166   1.956  -0.783
  324   1HG1  VAL  42          1HG1      VAL  42   2.237   1.373  -0.198
  325   2HG1  VAL  42          2HG1      VAL  42   2.072   0.045  -1.351
  326   3HG1  VAL  42          3HG1      VAL  42   1.021   0.117   0.072
  327   1HG2  VAL  42          1HG2      VAL  42   1.428   3.441  -1.573
  328   2HG2  VAL  42          2HG2      VAL  42   0.613   2.941  -3.056
  329   3HG2  VAL  42          3HG2      VAL  42   2.171   2.241  -2.623
  330    H    GLU  43           H        GLU  43  -2.288   0.862  -0.971
  331    HA   GLU  43           HA       GLU  43  -2.077  -1.502   0.584
  332   1HB   GLU  43          2HB       GLU  43  -4.649  -0.870   0.963
  333   2HB   GLU  43          1HB       GLU  43  -3.337   0.000   1.743
  334   1HG   GLU  43          2HG       GLU  43  -3.476   1.785   0.199
  335   2HG   GLU  43          1HG       GLU  43  -4.549   0.871  -0.865
  336    H    SER  44           H        SER  44  -4.429  -0.610  -1.941
  337    HA   SER  44           HA       SER  44  -5.655  -3.122  -2.104
  338   1HB   SER  44          2HB       SER  44  -6.028  -0.641  -3.269
  339   2HB   SER  44          1HB       SER  44  -5.587  -1.666  -4.637
  340    HG   SER  44           HG       SER  44  -7.376  -2.804  -4.387
  341    H    LEU  45           H        LEU  45  -2.645  -1.962  -3.313
  342    HA   LEU  45           HA       LEU  45  -2.188  -3.599  -5.510
  343   1HB   LEU  45          2HB       LEU  45  -0.586  -2.052  -3.630
  344   2HB   LEU  45          1HB       LEU  45   0.262  -3.469  -4.204
  345   1HD1  LEU  45          1HD1      LEU  45   1.856  -2.093  -6.511
  346   2HD1  LEU  45          2HD1      LEU  45   0.655  -2.982  -7.448
  347   3HD1  LEU  45          3HD1      LEU  45   1.244  -3.638  -5.921
  348   1HD2  LEU  45          1HD2      LEU  45  -1.387  -2.529  -7.362
  349   2HD2  LEU  45          2HD2      LEU  45  -1.166  -0.794  -7.139
  350   3HD2  LEU  45          3HD2      LEU  45  -2.219  -1.695  -6.051
  351    H    LYS  46           H        LYS  46  -1.153  -4.222  -2.151
  352    HA   LYS  46           HA       LYS  46  -0.424  -6.912  -2.674
  353   1HB   LYS  46          2HB       LYS  46   0.636  -6.381  -0.769
  354   2HB   LYS  46          1HB       LYS  46  -0.511  -5.117  -0.360
  355   1HG   LYS  46          2HG       LYS  46  -1.216  -8.002   0.041
  356   2HG   LYS  46          1HG       LYS  46  -0.215  -7.142   1.216
  357   1HD   LYS  46          2HD       LYS  46  -2.017  -5.386   1.314
  358   2HD   LYS  46          1HD       LYS  46  -3.027  -6.474   0.366
  359   1HE   LYS  46          2HE       LYS  46  -3.404  -7.854   2.099
  360   2HE   LYS  46          1HE       LYS  46  -1.765  -7.680   2.726
  361   1HZ   LYS  46          1HZ       LYS  46  -2.359  -5.971   4.046
  362   2HZ   LYS  46          2HZ       LYS  46  -3.904  -6.648   3.913
  363   3HZ   LYS  46          3HZ       LYS  46  -3.470  -5.336   2.938
  364    H    ASN  47           H        ASN  47  -3.342  -5.396  -1.367
  365    HA   ASN  47           HA       ASN  47  -4.698  -7.765  -0.690
  366   1HB   ASN  47          2HB       ASN  47  -5.325  -5.311  -0.151
  367   2HB   ASN  47          1HB       ASN  47  -6.103  -5.304  -1.732
  368   1HD2  ASN  47          1HD2      ASN  47  -7.655  -7.119  -2.104
  369   2HD2  ASN  47          2HD2      ASN  47  -8.673  -7.571  -0.784
  370    H    GLU  48           H        GLU  48  -4.127  -6.194  -3.726
  371    HA   GLU  48           HA       GLU  48  -6.125  -7.683  -5.174
  372   1HB   GLU  48          2HB       GLU  48  -4.069  -5.652  -5.818
  373   2HB   GLU  48          1HB       GLU  48  -4.441  -6.789  -7.107
  374   1HG   GLU  48          2HG       GLU  48  -6.930  -6.085  -6.276
  375   2HG   GLU  48          1HG       GLU  48  -6.031  -4.591  -6.014
  376    H    ILE  49           H        ILE  49  -2.715  -7.925  -4.458
  377    HA   ILE  49           HA       ILE  49  -2.127 -10.047  -6.260
  378    HB   ILE  49           HB       ILE  49  -0.045 -10.271  -5.153
  379   1HG1  ILE  49          2HG1      ILE  49  -0.680  -8.549  -2.828
  380   2HG1  ILE  49          1HG1      ILE  49  -1.325 -10.176  -2.788
  381   1HG2  ILE  49          1HG2      ILE  49  -1.061  -7.686  -5.788
  382   2HG2  ILE  49          2HG2      ILE  49   0.570  -8.322  -5.991
  383   3HG2  ILE  49          3HG2      ILE  49   0.109  -7.548  -4.475
  384   1HD1  ILE  49          1HD1      ILE  49   0.727 -11.114  -2.591
  385   2HD1  ILE  49          2HD1      ILE  49   0.998  -9.573  -1.773
  386   3HD1  ILE  49          3HD1      ILE  49   1.528  -9.793  -3.440
  387    H    LEU  50           H        LEU  50  -3.509  -9.809  -3.113
  388    HA   LEU  50           HA       LEU  50  -3.297 -12.615  -2.500
  389   1HB   LEU  50          2HB       LEU  50  -4.724 -10.307  -1.176
  390   2HB   LEU  50          1HB       LEU  50  -4.736 -11.942  -0.539
  391    HG   LEU  50           HG       LEU  50  -2.070 -10.793  -1.082
  392   1HD1  LEU  50          1HD1      LEU  50  -3.836  -9.767   1.126
  393   2HD1  LEU  50          2HD1      LEU  50  -3.113  -8.837  -0.187
  394   3HD1  LEU  50          3HD1      LEU  50  -2.086  -9.552   1.057
  395   1HD2  LEU  50          1HD2      LEU  50  -1.862 -12.821  -0.065
  396   2HD2  LEU  50          2HD2      LEU  50  -3.364 -12.643   0.845
  397   3HD2  LEU  50          3HD2      LEU  50  -1.913 -11.787   1.364
  398    H    LYS  51           H        LYS  51  -5.647 -10.401  -3.845
  399    HA   LYS  51           HA       LYS  51  -7.931 -12.033  -3.634
  400   1HB   LYS  51          2HB       LYS  51  -7.872  -9.589  -4.281
  401   2HB   LYS  51          1HB       LYS  51  -7.328 -10.096  -5.874
  402   1HG   LYS  51          2HG       LYS  51  -9.510 -10.056  -6.369
  403   2HG   LYS  51          1HG       LYS  51  -9.530 -11.637  -5.584
  404   1HD   LYS  51          2HD       LYS  51 -10.153 -10.573  -3.467
  405   2HD   LYS  51          1HD       LYS  51 -10.137  -8.995  -4.257
  406   1HE   LYS  51          2HE       LYS  51 -11.798 -11.035  -5.570
  407   2HE   LYS  51          1HE       LYS  51 -12.341 -10.551  -3.963
  408   1HZ   LYS  51          1HZ       LYS  51 -11.636  -8.513  -5.967
  409   2HZ   LYS  51          2HZ       LYS  51 -12.670  -8.385  -4.635
  410   3HZ   LYS  51          3HZ       LYS  51 -13.160  -9.250  -6.003
  411    H    ALA  52           H        ALA  52  -5.124 -12.212  -5.599
  412    HA   ALA  52           HA       ALA  52  -6.167 -14.599  -6.900
  413   1HB   ALA  52          1HB       ALA  52  -4.953 -12.300  -8.429
  414   2HB   ALA  52          2HB       ALA  52  -6.631 -12.840  -8.509
  415   3HB   ALA  52          3HB       ALA  52  -5.340 -13.883  -9.105
  416    H    LEU  53           H        LEU  53  -4.640 -15.308  -5.137
  417    HA   LEU  53           HA       LEU  53  -1.819 -14.957  -5.695
  418   1HB   LEU  53          2HB       LEU  53  -3.315 -15.505  -3.415
  419   2HB   LEU  53          1HB       LEU  53  -2.476 -17.008  -3.743
  420    HG   LEU  53           HG       LEU  53  -0.654 -14.779  -3.962
  421   1HD1  LEU  53          1HD1      LEU  53  -0.854 -14.664  -1.254
  422   2HD1  LEU  53          2HD1      LEU  53  -2.551 -14.717  -1.731
  423   3HD1  LEU  53          3HD1      LEU  53  -1.496 -13.454  -2.364
  424   1HD2  LEU  53          1HD2      LEU  53   0.754 -16.181  -2.838
  425   2HD2  LEU  53          2HD2      LEU  53  -0.402 -17.359  -3.457
  426   3HD2  LEU  53          3HD2      LEU  53  -0.520 -16.801  -1.788
  427    HA   PRO  54           HA       PRO  54  -1.278 -18.516  -8.245
  428   1HB   PRO  54          2HB       PRO  54   1.242 -19.277  -7.498
  429   2HB   PRO  54          1HB       PRO  54   0.906 -17.915  -8.573
  430   1HG   PRO  54          2HG       PRO  54   1.503 -17.913  -5.641
  431   2HG   PRO  54          1HG       PRO  54   2.097 -16.820  -6.906
  432   1HD   PRO  54          2HD       PRO  54   0.109 -16.114  -5.235
  433   2HD   PRO  54          1HD       PRO  54   0.146 -15.579  -6.927
  434    H    THR  55           H        THR  55  -0.973 -18.721  -4.792
  435    HA   THR  55           HA       THR  55  -0.522 -21.446  -4.438
  436    HB   THR  55           HB       THR  55  -2.291 -19.708  -2.711
  437    HG1  THR  55           1HG      THR  55   0.524 -20.028  -2.612
  438   1HG2  THR  55          1HG2      THR  55  -2.267 -22.107  -2.126
  439   2HG2  THR  55          2HG2      THR  55  -1.578 -21.069  -0.877
  440   3HG2  THR  55          3HG2      THR  55  -0.517 -22.006  -1.930
  441    H    GLU  56           H        GLU  56  -3.671 -19.764  -4.411
  442    HA   GLU  56           HA       GLU  56  -5.138 -22.217  -4.529
  443   1HB   GLU  56          2HB       GLU  56  -5.954 -20.064  -3.491
  444   2HB   GLU  56          1HB       GLU  56  -6.171 -19.441  -5.120
  445   1HG   GLU  56          2HG       GLU  56  -8.101 -20.506  -5.373
  446   2HG   GLU  56          1HG       GLU  56  -7.432 -22.023  -4.773
  Start of MODEL   21
    1   1H    MET   1          1HT       MET   1   0.984  18.231   9.395
    2   2H    MET   1          2HT       MET   1  -0.494  17.358   9.386
    3   3H    MET   1          3HT       MET   1   0.374  17.557  10.850
    4    HA   MET   1           HA       MET   1  -1.448  19.013  10.858
    5   1HB   MET   1          2HB       MET   1   1.180  19.692  11.269
    6   2HB   MET   1          1HB       MET   1   0.638  20.969  10.191
    7   1HG   MET   1          2HG       MET   1  -1.055  21.639  11.703
    8   2HG   MET   1          1HG       MET   1  -0.812  20.211  12.707
    9   1HE   MET   1          1HE       MET   1   1.231  23.366  11.287
   10   2HE   MET   1          2HE       MET   1   2.197  21.900  11.108
   11   3HE   MET   1          3HE       MET   1   2.692  23.151  12.254
   12    H    GLU   2           H        GLU   2   0.696  20.309   8.320
   13    HA   GLU   2           HA       GLU   2  -1.718  21.029   6.793
   14   1HB   GLU   2          2HB       GLU   2  -0.153  22.706   5.681
   15   2HB   GLU   2          1HB       GLU   2  -0.590  23.031   7.350
   16   1HG   GLU   2          2HG       GLU   2   1.509  22.527   8.147
   17   2HG   GLU   2          1HG       GLU   2   1.911  21.528   6.750
   18    H    ALA   3           H        ALA   3   1.342  19.380   6.709
   19    HA   ALA   3           HA       ALA   3   0.598  18.102   4.218
   20   1HB   ALA   3          1HB       ALA   3   2.343  18.803   2.879
   21   2HB   ALA   3          2HB       ALA   3   3.317  19.350   4.248
   22   3HB   ALA   3          3HB       ALA   3   1.914  20.286   3.733
   23    H    VAL   4           H        VAL   4   0.600  16.142   5.244
   24    HA   VAL   4           HA       VAL   4   3.201  14.980   5.769
   25    HB   VAL   4           HB       VAL   4   2.452  14.027   7.969
   26   1HG1  VAL   4          1HG1      VAL   4   4.003  16.005   7.664
   27   2HG1  VAL   4          2HG1      VAL   4   3.205  15.878   9.233
   28   3HG1  VAL   4          3HG1      VAL   4   2.617  17.032   8.035
   29   1HG2  VAL   4          1HG2      VAL   4   0.721  15.756   9.034
   30   2HG2  VAL   4          2HG2      VAL   4   0.215  14.256   8.248
   31   3HG2  VAL   4          3HG2      VAL   4   0.148  15.789   7.372
   32    H    ASP   5           H        ASP   5   1.074  14.622   3.823
   33    HA   ASP   5           HA       ASP   5  -0.540  12.411   4.329
   34   1HB   ASP   5          2HB       ASP   5  -0.287  14.089   2.246
   35   2HB   ASP   5          1HB       ASP   5   0.573  12.694   1.593
   36    H    ALA   6           H        ALA   6   2.848  12.620   3.592
   37    HA   ALA   6           HA       ALA   6   3.355  10.067   2.618
   38   1HB   ALA   6          1HB       ALA   6   4.889  12.204   3.104
   39   2HB   ALA   6          2HB       ALA   6   5.542  10.598   2.811
   40   3HB   ALA   6          3HB       ALA   6   5.365  11.189   4.462
   41    H    ASN   7           H        ASN   7   2.782  11.168   5.892
   42    HA   ASN   7           HA       ASN   7   3.732   8.893   7.256
   43   1HB   ASN   7          2HB       ASN   7   1.651  10.950   8.001
   44   2HB   ASN   7          1HB       ASN   7   2.189   9.684   9.099
   45   1HD2  ASN   7          1HD2      ASN   7   2.475  12.248   9.844
   46   2HD2  ASN   7          2HD2      ASN   7   4.136  12.715   9.823
   47    H    SER   8           H        SER   8   0.484   9.775   6.116
   48    HA   SER   8           HA       SER   8  -0.731   7.361   6.989
   49   1HB   SER   8          2HB       SER   8  -1.711   9.757   6.187
   50   2HB   SER   8          1HB       SER   8  -1.970   8.810   4.724
   51    HG   SER   8           HG       SER   8  -3.659   8.830   6.478
   52    H    LEU   9           H        LEU   9   0.874   8.405   4.078
   53    HA   LEU   9           HA       LEU   9   0.018   6.314   2.383
   54   1HB   LEU   9          2HB       LEU   9   1.059   8.489   1.675
   55   2HB   LEU   9          1HB       LEU   9   2.604   7.860   2.214
   56    HG   LEU   9           HG       LEU   9   0.922   6.620   0.036
   57   1HD1  LEU   9          1HD1      LEU   9   3.324   8.406  -0.133
   58   2HD1  LEU   9          2HD1      LEU   9   1.687   8.778  -0.673
   59   3HD1  LEU   9          3HD1      LEU   9   2.625   7.531  -1.489
   60   1HD2  LEU   9          1HD2      LEU   9   3.434   5.868   1.385
   61   2HD2  LEU   9          2HD2      LEU   9   3.417   5.728  -0.372
   62   3HD2  LEU   9          3HD2      LEU   9   2.222   4.861   0.593
   63    H    ALA  10           H        ALA  10   2.893   6.788   4.395
   64    HA   ALA  10           HA       ALA  10   4.219   4.413   3.686
   65   1HB   ALA  10          1HB       ALA  10   5.231   4.858   6.109
   66   2HB   ALA  10          2HB       ALA  10   4.470   6.425   5.836
   67   3HB   ALA  10          3HB       ALA  10   5.674   5.819   4.699
   68    H    GLN  11           H        GLN  11   1.494   4.927   5.711
   69    HA   GLN  11           HA       GLN  11   1.881   2.570   7.312
   70   1HB   GLN  11          2HB       GLN  11   0.709   4.350   8.363
   71   2HB   GLN  11          1HB       GLN  11  -0.400   4.510   7.005
   72   1HG   GLN  11          2HG       GLN  11  -1.267   2.272   7.509
   73   2HG   GLN  11          1HG       GLN  11  -0.239   2.212   8.935
   74   1HE2  GLN  11          1HE2      GLN  11  -1.678   2.262  10.548
   75   2HE2  GLN  11          2HE2      GLN  11  -2.852   3.508  10.798
   76    H    ALA  12           H        ALA  12  -0.162   3.506   4.567
   77    HA   ALA  12           HA       ALA  12  -1.718   1.225   4.353
   78   1HB   ALA  12          1HB       ALA  12  -1.483   3.456   2.894
   79   2HB   ALA  12          2HB       ALA  12  -2.315   2.012   2.312
   80   3HB   ALA  12          3HB       ALA  12  -0.645   2.324   1.829
   81    H    LYS  13           H        LYS  13   1.580   1.816   3.374
   82    HA   LYS  13           HA       LYS  13   1.886  -0.825   2.203
   83   1HB   LYS  13          2HB       LYS  13   4.394   0.136   2.200
   84   2HB   LYS  13          1HB       LYS  13   3.216   0.521   0.959
   85   1HG   LYS  13          2HG       LYS  13   2.814   2.634   1.797
   86   2HG   LYS  13          1HG       LYS  13   3.503   2.239   3.378
   87   1HD   LYS  13          2HD       LYS  13   5.056   2.427   0.793
   88   2HD   LYS  13          1HD       LYS  13   4.974   3.697   2.015
   89   1HE   LYS  13          2HE       LYS  13   5.702   1.200   3.234
   90   2HE   LYS  13          1HE       LYS  13   6.777   1.546   1.880
   91   1HZ   LYS  13          1HZ       LYS  13   7.430   2.460   4.133
   92   2HZ   LYS  13          2HZ       LYS  13   6.169   3.571   3.949
   93   3HZ   LYS  13          3HZ       LYS  13   7.448   3.554   2.843
   94    H    GLU  14           H        GLU  14   3.389   1.045   4.846
   95    HA   GLU  14           HA       GLU  14   4.943  -0.942   5.975
   96   1HB   GLU  14          2HB       GLU  14   5.058   1.346   6.768
   97   2HB   GLU  14          1HB       GLU  14   3.389   1.286   7.319
   98   1HG   GLU  14          2HG       GLU  14   4.672  -0.824   8.623
   99   2HG   GLU  14          1HG       GLU  14   5.808   0.523   8.680
  100    H    ALA  15           H        ALA  15   1.520  -0.309   6.230
  101    HA   ALA  15           HA       ALA  15   1.071  -2.430   8.156
  102   1HB   ALA  15          1HB       ALA  15  -1.066  -1.021   6.584
  103   2HB   ALA  15          2HB       ALA  15  -0.275  -0.265   7.968
  104   3HB   ALA  15          3HB       ALA  15  -1.179  -1.765   8.180
  105    H    ALA  16           H        ALA  16   0.902  -1.963   4.699
  106    HA   ALA  16           HA       ALA  16  -0.574  -4.347   4.139
  107   1HB   ALA  16          1HB       ALA  16   0.296  -3.934   1.780
  108   2HB   ALA  16          2HB       ALA  16   1.027  -2.469   2.429
  109   3HB   ALA  16          3HB       ALA  16  -0.722  -2.682   2.491
  110    H    ILE  17           H        ILE  17   2.772  -3.599   4.690
  111    HA   ILE  17           HA       ILE  17   3.805  -5.967   3.448
  112    HB   ILE  17           HB       ILE  17   5.261  -4.037   3.696
  113   1HG1  ILE  17          2HG1      ILE  17   6.261  -6.232   5.516
  114   2HG1  ILE  17          1HG1      ILE  17   6.196  -6.377   3.763
  115   1HG2  ILE  17          1HG2      ILE  17   4.585  -4.331   6.584
  116   2HG2  ILE  17          2HG2      ILE  17   4.656  -2.881   5.583
  117   3HG2  ILE  17          3HG2      ILE  17   6.147  -3.656   6.121
  118   1HD1  ILE  17          1HD1      ILE  17   7.539  -3.957   4.472
  119   2HD1  ILE  17          2HD1      ILE  17   8.140  -5.350   3.571
  120   3HD1  ILE  17          3HD1      ILE  17   8.259  -5.319   5.331
  121    H    LYS  18           H        LYS  18   2.706  -5.040   6.636
  122    HA   LYS  18           HA       LYS  18   3.690  -7.263   8.069
  123   1HB   LYS  18          2HB       LYS  18   2.083  -4.990   8.595
  124   2HB   LYS  18          1HB       LYS  18   1.156  -6.394   9.113
  125   1HG   LYS  18          2HG       LYS  18   3.350  -7.091  10.301
  126   2HG   LYS  18          1HG       LYS  18   3.789  -5.393  10.108
  127   1HD   LYS  18          2HD       LYS  18   2.217  -4.676  11.590
  128   2HD   LYS  18          1HD       LYS  18   1.093  -5.978  11.191
  129   1HE   LYS  18          2HE       LYS  18   1.882  -6.313  13.428
  130   2HE   LYS  18          1HE       LYS  18   2.585  -7.556  12.398
  131   1HZ   LYS  18          1HZ       LYS  18   4.412  -6.882  13.554
  132   2HZ   LYS  18          2HZ       LYS  18   3.880  -5.285  13.719
  133   3HZ   LYS  18          3HZ       LYS  18   4.514  -5.816  12.245
  134    H    GLU  19           H        GLU  19   0.872  -6.765   6.058
  135    HA   GLU  19           HA       GLU  19  -0.473  -9.166   6.801
  136   1HB   GLU  19          2HB       GLU  19  -0.868  -6.993   4.900
  137   2HB   GLU  19          1HB       GLU  19  -1.288  -8.552   4.203
  138   1HG   GLU  19          2HG       GLU  19  -3.287  -8.023   5.115
  139   2HG   GLU  19          1HG       GLU  19  -2.561  -8.821   6.509
  140    H    LEU  20           H        LEU  20   1.623  -8.247   4.097
  141    HA   LEU  20           HA       LEU  20   1.599 -10.751   2.816
  142   1HB   LEU  20          2HB       LEU  20   2.887  -8.247   2.470
  143   2HB   LEU  20          1HB       LEU  20   4.134  -9.480   2.467
  144    HG   LEU  20           HG       LEU  20   2.178 -10.535   0.824
  145   1HD1  LEU  20          1HD1      LEU  20   0.876  -8.776   0.286
  146   2HD1  LEU  20          2HD1      LEU  20   2.195  -8.416  -0.828
  147   3HD1  LEU  20          3HD1      LEU  20   2.104  -7.593   0.730
  148   1HD2  LEU  20          1HD2      LEU  20   4.424  -8.923  -0.288
  149   2HD2  LEU  20          2HD2      LEU  20   3.808 -10.495  -0.799
  150   3HD2  LEU  20          3HD2      LEU  20   4.758 -10.359   0.679
  151    H    LYS  21           H        LYS  21   3.171  -9.596   5.650
  152    HA   LYS  21           HA       LYS  21   5.182 -11.668   5.710
  153   1HB   LYS  21          2HB       LYS  21   5.492  -9.357   6.682
  154   2HB   LYS  21          1HB       LYS  21   4.364  -9.816   7.950
  155   1HG   LYS  21          2HG       LYS  21   6.334 -11.843   7.778
  156   2HG   LYS  21          1HG       LYS  21   7.160 -10.284   7.796
  157   1HD   LYS  21          2HD       LYS  21   6.961 -10.743  10.052
  158   2HD   LYS  21          1HD       LYS  21   5.532  -9.750   9.758
  159   1HE   LYS  21          2HE       LYS  21   4.985 -12.542   9.260
  160   2HE   LYS  21          1HE       LYS  21   5.616 -12.300  10.887
  161   1HZ   LYS  21          1HZ       LYS  21   3.866 -10.345  10.826
  162   2HZ   LYS  21          2HZ       LYS  21   3.430 -11.916  11.272
  163   3HZ   LYS  21          3HZ       LYS  21   3.115 -11.366   9.704
  164    H    GLN  22           H        GLN  22   2.090 -10.955   7.301
  165    HA   GLN  22           HA       GLN  22   2.245 -13.340   8.929
  166   1HB   GLN  22          2HB       GLN  22  -0.019 -12.729   9.672
  167   2HB   GLN  22          1HB       GLN  22   1.102 -11.383   9.812
  168   1HG   GLN  22          2HG       GLN  22  -0.072 -10.117   8.413
  169   2HG   GLN  22          1HG       GLN  22  -0.297 -11.435   7.264
  170   1HE2  GLN  22          1HE2      GLN  22  -1.807 -13.212   8.255
  171   2HE2  GLN  22          2HE2      GLN  22  -3.293 -12.606   8.896
  172    H    TYR  23           H        TYR  23   0.949 -12.433   5.844
  173    HA   TYR  23           HA       TYR  23  -0.827 -14.674   5.588
  174   1HB   TYR  23          2HB       TYR  23   0.139 -12.488   3.795
  175   2HB   TYR  23          1HB       TYR  23  -0.548 -13.933   3.054
  176    HD1  TYR  23           1HD      TYR  23  -2.818 -14.700   4.393
  177    HD2  TYR  23           2HD      TYR  23  -1.320 -10.740   4.006
  178    HE1  TYR  23           1HE      TYR  23  -5.081 -13.817   4.749
  179    HE2  TYR  23           2HE      TYR  23  -3.577  -9.844   4.363
  180    HH   TYR  23           HH       TYR  23  -6.162 -11.130   3.931
  181    H    GLY  24           H        GLY  24   2.439 -13.867   4.528
  182   1HA   GLY  24          2HA       GLY  24   4.121 -15.577   4.383
  183   2HA   GLY  24          1HA       GLY  24   2.861 -16.721   3.945
  184    H    ILE  25           H        ILE  25   2.111 -14.025   2.243
  185    HA   ILE  25           HA       ILE  25   2.660 -15.071  -0.253
  186    HB   ILE  25           HB       ILE  25   2.868 -12.126  -0.161
  187   1HG1  ILE  25          2HG1      ILE  25   0.403 -13.562   0.853
  188   2HG1  ILE  25          1HG1      ILE  25   1.368 -12.371   1.719
  189   1HG2  ILE  25          1HG2      ILE  25   0.638 -13.164  -1.617
  190   2HG2  ILE  25          2HG2      ILE  25   2.070 -14.140  -1.957
  191   3HG2  ILE  25          3HG2      ILE  25   2.107 -12.397  -2.223
  192   1HD1  ILE  25          1HD1      ILE  25  -0.576 -11.972  -0.502
  193   2HD1  ILE  25          2HD1      ILE  25   0.718 -10.804  -0.248
  194   3HD1  ILE  25          3HD1      ILE  25  -0.441 -11.130   1.041
  195    H    GLY  26           H        GLY  26   4.114 -13.856  -1.945
  196   1HA   GLY  26          2HA       GLY  26   6.822 -14.283  -1.072
  197   2HA   GLY  26          1HA       GLY  26   6.302 -13.841  -2.695
  198    H    ASP  27           H        ASP  27   8.541 -12.818  -1.153
  199    HA   ASP  27           HA       ASP  27   8.048 -10.278  -0.066
  200   1HB   ASP  27          2HB       ASP  27  10.504  -9.875  -0.673
  201   2HB   ASP  27          1HB       ASP  27  10.163 -11.245   0.380
  202    H    TYR  28           H        TYR  28   8.230 -11.364  -3.353
  203    HA   TYR  28           HA       TYR  28   8.912  -9.165  -4.832
  204   1HB   TYR  28          2HB       TYR  28   7.735 -11.551  -5.421
  205   2HB   TYR  28          1HB       TYR  28   6.387 -10.452  -5.691
  206    HD1  TYR  28           1HD      TYR  28   8.062 -12.176  -7.724
  207    HD2  TYR  28           2HD      TYR  28   8.104  -8.082  -6.579
  208    HE1  TYR  28           1HE      TYR  28   8.966 -11.571  -9.930
  209    HE2  TYR  28           2HE      TYR  28   9.003  -7.466  -8.766
  210    HH   TYR  28           HH       TYR  28  10.201  -8.441 -10.614
  211    H    TYR  29           H        TYR  29   5.795  -9.866  -3.399
  212    HA   TYR  29           HA       TYR  29   4.642  -7.395  -4.248
  213   1HB   TYR  29          2HB       TYR  29   3.500  -9.460  -2.369
  214   2HB   TYR  29          1HB       TYR  29   2.614  -8.195  -3.219
  215    HD1  TYR  29           1HD      TYR  29   3.764 -11.538  -3.407
  216    HD2  TYR  29           2HD      TYR  29   2.886  -8.134  -5.813
  217    HE1  TYR  29           1HE      TYR  29   3.630 -12.983  -5.388
  218    HE2  TYR  29           2HE      TYR  29   2.711  -9.583  -7.795
  219    HH   TYR  29           HH       TYR  29   3.453 -11.730  -8.577
  220    H    ILE  30           H        ILE  30   6.367  -8.325  -1.385
  221    HA   ILE  30           HA       ILE  30   5.229  -6.251   0.245
  222    HB   ILE  30           HB       ILE  30   6.699  -6.830   1.892
  223   1HG1  ILE  30          2HG1      ILE  30   8.980  -7.965   1.293
  224   2HG1  ILE  30          1HG1      ILE  30   8.701  -7.231  -0.283
  225   1HG2  ILE  30          1HG2      ILE  30   5.653  -8.854   1.649
  226   2HG2  ILE  30          2HG2      ILE  30   7.354  -9.306   1.632
  227   3HG2  ILE  30          3HG2      ILE  30   6.453  -9.208   0.122
  228   1HD1  ILE  30          1HD1      ILE  30   8.192  -5.165   1.424
  229   2HD1  ILE  30          2HD1      ILE  30   9.715  -5.447   0.574
  230   3HD1  ILE  30          3HD1      ILE  30   9.511  -6.017   2.232
  231    H    LYS  31           H        LYS  31   7.764  -6.617  -2.075
  232    HA   LYS  31           HA       LYS  31   8.923  -4.008  -1.660
  233   1HB   LYS  31          2HB       LYS  31   9.445  -6.352  -3.412
  234   2HB   LYS  31          1HB       LYS  31  10.023  -4.784  -3.956
  235   1HG   LYS  31          2HG       LYS  31  11.849  -5.228  -2.760
  236   2HG   LYS  31          1HG       LYS  31  10.862  -4.845  -1.348
  237   1HD   LYS  31          2HD       LYS  31  10.165  -7.394  -1.626
  238   2HD   LYS  31          1HD       LYS  31  11.752  -7.478  -2.395
  239   1HE   LYS  31          2HE       LYS  31  11.625  -6.021   0.167
  240   2HE   LYS  31          1HE       LYS  31  11.351  -7.759   0.254
  241   1HZ   LYS  31          1HZ       LYS  31  13.456  -8.211  -0.563
  242   2HZ   LYS  31          2HZ       LYS  31  13.734  -6.888   0.452
  243   3HZ   LYS  31          3HZ       LYS  31  13.660  -6.667  -1.223
  244    H    LEU  32           H        LEU  32   6.995  -5.631  -4.194
  245    HA   LEU  32           HA       LEU  32   6.859  -3.565  -6.004
  246   1HB   LEU  32          2HB       LEU  32   5.412  -4.885  -7.119
  247   2HB   LEU  32          1HB       LEU  32   5.782  -6.045  -5.864
  248    HG   LEU  32           HG       LEU  32   3.459  -6.082  -6.072
  249   1HD1  LEU  32          1HD1      LEU  32   4.726  -5.128  -3.773
  250   2HD1  LEU  32          2HD1      LEU  32   3.206  -6.032  -3.886
  251   3HD1  LEU  32          3HD1      LEU  32   3.189  -4.266  -3.895
  252   1HD2  LEU  32          1HD2      LEU  32   2.367  -4.396  -7.025
  253   2HD2  LEU  32          2HD2      LEU  32   3.776  -3.351  -6.855
  254   3HD2  LEU  32          3HD2      LEU  32   2.587  -3.446  -5.556
  255    H    ILE  33           H        ILE  33   5.558  -3.668  -2.865
  256    HA   ILE  33           HA       ILE  33   3.518  -1.666  -3.270
  257    HB   ILE  33           HB       ILE  33   4.633  -3.094  -0.871
  258   1HG1  ILE  33          2HG1      ILE  33   2.043  -3.030  -2.381
  259   2HG1  ILE  33          1HG1      ILE  33   3.039  -4.410  -1.939
  260   1HG2  ILE  33          1HG2      ILE  33   4.142  -1.408   0.483
  261   2HG2  ILE  33          2HG2      ILE  33   2.452  -1.568   0.014
  262   3HG2  ILE  33          3HG2      ILE  33   3.502  -0.454  -0.852
  263   1HD1  ILE  33          1HD1      ILE  33   0.756  -3.379  -0.634
  264   2HD1  ILE  33          2HD1      ILE  33   2.133  -3.202   0.455
  265   3HD1  ILE  33          3HD1      ILE  33   1.732  -4.784  -0.208
  266    H    ASN  34           H        ASN  34   6.557  -1.813  -1.402
  267    HA   ASN  34           HA       ASN  34   6.716   0.831  -0.641
  268   1HB   ASN  34          2HB       ASN  34   8.437  -1.432  -0.653
  269   2HB   ASN  34          1HB       ASN  34   9.358  -0.062  -1.268
  270   1HD2  ASN  34          1HD2      ASN  34   9.508   1.830   0.049
  271   2HD2  ASN  34          2HD2      ASN  34   9.371   1.705   1.766
  272    H    ASN  35           H        ASN  35   7.201  -0.504  -3.797
  273    HA   ASN  35           HA       ASN  35   8.755   1.662  -4.834
  274   1HB   ASN  35          2HB       ASN  35   7.587  -0.826  -5.857
  275   2HB   ASN  35          1HB       ASN  35   7.621   0.483  -7.034
  276   1HD2  ASN  35          1HD2      ASN  35   9.218  -0.191  -8.336
  277   2HD2  ASN  35          2HD2      ASN  35  10.850  -0.452  -7.833
  278    H    ALA  36           H        ALA  36   5.382   1.170  -4.289
  279    HA   ALA  36           HA       ALA  36   4.268   2.764  -6.293
  280   1HB   ALA  36          1HB       ALA  36   2.586   3.201  -4.203
  281   2HB   ALA  36          2HB       ALA  36   3.394   1.711  -3.711
  282   3HB   ALA  36          3HB       ALA  36   2.547   1.786  -5.255
  283    H    LYS  37           H        LYS  37   3.473   4.899  -6.264
  284    HA   LYS  37           HA       LYS  37   5.211   6.730  -4.778
  285   1HB   LYS  37          2HB       LYS  37   3.640   6.927  -7.326
  286   2HB   LYS  37          1HB       LYS  37   4.117   8.387  -6.470
  287   1HG   LYS  37          2HG       LYS  37   5.737   7.923  -8.165
  288   2HG   LYS  37          1HG       LYS  37   6.474   7.631  -6.588
  289   1HD   LYS  37          2HD       LYS  37   7.057   5.869  -8.176
  290   2HD   LYS  37          1HD       LYS  37   6.087   5.233  -6.847
  291   1HE   LYS  37          2HE       LYS  37   4.354   4.713  -8.191
  292   2HE   LYS  37          1HE       LYS  37   4.560   6.154  -9.185
  293   1HZ   LYS  37          1HZ       LYS  37   5.862   5.069 -10.636
  294   2HZ   LYS  37          2HZ       LYS  37   5.128   3.681 -10.007
  295   3HZ   LYS  37          3HZ       LYS  37   6.649   4.162  -9.443
  296    H    THR  38           H        THR  38   1.829   6.009  -5.421
  297    HA   THR  38           HA       THR  38   0.970   8.090  -3.549
  298    HB   THR  38           HB       THR  38  -1.031   6.340  -4.866
  299    HG1  THR  38           1HG      THR  38   0.681   8.075  -6.295
  300   1HG2  THR  38          1HG2      THR  38  -2.332   8.229  -5.000
  301   2HG2  THR  38          2HG2      THR  38  -0.947   9.319  -4.994
  302   3HG2  THR  38          3HG2      THR  38  -1.436   8.501  -3.511
  303    H    VAL  39           H        VAL  39  -1.511   6.544  -2.896
  304    HA   VAL  39           HA       VAL  39  -0.339   4.411  -1.275
  305    HB   VAL  39           HB       VAL  39  -0.799   6.684  -0.036
  306   1HG1  VAL  39          1HG1      VAL  39  -3.432   5.269   0.255
  307   2HG1  VAL  39          2HG1      VAL  39  -3.189   6.735  -0.697
  308   3HG1  VAL  39          3HG1      VAL  39  -2.926   6.760   1.049
  309   1HG2  VAL  39          1HG2      VAL  39  -1.403   5.157   1.979
  310   2HG2  VAL  39          2HG2      VAL  39   0.152   4.965   1.162
  311   3HG2  VAL  39          3HG2      VAL  39  -1.173   3.860   0.809
  312    H    GLU  40           H        GLU  40  -3.353   5.842  -2.481
  313    HA   GLU  40           HA       GLU  40  -5.147   3.890  -1.783
  314   1HB   GLU  40          2HB       GLU  40  -4.960   5.874  -3.940
  315   2HB   GLU  40          1HB       GLU  40  -5.978   4.494  -4.326
  316   1HG   GLU  40          2HG       GLU  40  -6.829   5.104  -1.819
  317   2HG   GLU  40          1HG       GLU  40  -6.414   6.697  -2.452
  318    H    GLY  41           H        GLY  41  -2.740   3.798  -4.324
  319   1HA   GLY  41          2HA       GLY  41  -3.711   1.270  -5.361
  320   2HA   GLY  41          1HA       GLY  41  -2.275   2.137  -5.892
  321    H    VAL  42           H        VAL  42  -1.105   2.448  -3.314
  322    HA   VAL  42           HA       VAL  42   0.540   0.269  -3.115
  323    HB   VAL  42           HB       VAL  42  -0.330   2.028  -0.823
  324   1HG1  VAL  42          1HG1      VAL  42   0.814   0.477   0.338
  325   2HG1  VAL  42          2HG1      VAL  42   2.225   1.321  -0.313
  326   3HG1  VAL  42          3HG1      VAL  42   1.629  -0.141  -1.103
  327   1HG2  VAL  42          1HG2      VAL  42   1.306   3.540  -1.413
  328   2HG2  VAL  42          2HG2      VAL  42   0.730   3.029  -2.999
  329   3HG2  VAL  42          3HG2      VAL  42   2.218   2.354  -2.337
  330    H    GLU  43           H        GLU  43  -2.360   0.866  -1.139
  331    HA   GLU  43           HA       GLU  43  -2.203  -1.601   0.258
  332   1HB   GLU  43          2HB       GLU  43  -4.733  -1.031   0.669
  333   2HB   GLU  43          1HB       GLU  43  -3.470  -0.058   1.409
  334   1HG   GLU  43          2HG       GLU  43  -3.778   1.701  -0.084
  335   2HG   GLU  43          1HG       GLU  43  -4.667   0.693  -1.228
  336    H    SER  44           H        SER  44  -4.232  -0.538  -2.459
  337    HA   SER  44           HA       SER  44  -5.609  -2.965  -2.783
  338   1HB   SER  44          2HB       SER  44  -6.562  -1.994  -4.650
  339   2HB   SER  44          1HB       SER  44  -6.004  -0.556  -3.794
  340    HG   SER  44           HG       SER  44  -5.447  -1.070  -6.206
  341    H    LEU  45           H        LEU  45  -2.429  -1.979  -3.661
  342    HA   LEU  45           HA       LEU  45  -1.943  -3.696  -5.835
  343   1HB   LEU  45          2HB       LEU  45  -0.169  -2.418  -3.783
  344   2HB   LEU  45          1HB       LEU  45   0.487  -3.523  -4.972
  345   1HD1  LEU  45          1HD1      LEU  45   1.042  -2.845  -7.072
  346   2HD1  LEU  45          2HD1      LEU  45   1.939  -1.704  -6.067
  347   3HD1  LEU  45          3HD1      LEU  45   1.034  -1.125  -7.465
  348   1HD2  LEU  45          1HD2      LEU  45  -2.307  -1.586  -6.047
  349   2HD2  LEU  45          2HD2      LEU  45  -1.432  -2.289  -7.406
  350   3HD2  LEU  45          3HD2      LEU  45  -1.405  -0.546  -7.148
  351    H    LYS  46           H        LYS  46  -0.995  -4.185  -2.411
  352    HA   LYS  46           HA       LYS  46  -0.318  -6.920  -2.856
  353   1HB   LYS  46          2HB       LYS  46   0.812  -6.352  -1.003
  354   2HB   LYS  46          1HB       LYS  46  -0.288  -5.045  -0.605
  355   1HG   LYS  46          2HG       LYS  46  -1.048  -7.897  -0.077
  356   2HG   LYS  46          1HG       LYS  46  -0.004  -7.009   1.037
  357   1HD   LYS  46          2HD       LYS  46  -1.793  -5.202   1.047
  358   2HD   LYS  46          1HD       LYS  46  -2.838  -6.374   0.251
  359   1HE   LYS  46          2HE       LYS  46  -3.085  -7.631   2.106
  360   2HE   LYS  46          1HE       LYS  46  -1.448  -7.307   2.676
  361   1HZ   LYS  46          1HZ       LYS  46  -3.040  -6.282   4.135
  362   2HZ   LYS  46          2HZ       LYS  46  -3.771  -5.465   2.849
  363   3HZ   LYS  46          3HZ       LYS  46  -2.194  -5.070   3.314
  364    H    ASN  47           H        ASN  47  -3.143  -5.290  -1.447
  365    HA   ASN  47           HA       ASN  47  -4.540  -7.582  -0.663
  366   1HB   ASN  47          2HB       ASN  47  -5.103  -4.784  -0.927
  367   2HB   ASN  47          1HB       ASN  47  -6.436  -5.685  -1.644
  368   1HD2  ASN  47          1HD2      ASN  47  -6.002  -4.104   0.919
  369   2HD2  ASN  47          2HD2      ASN  47  -6.624  -5.142   2.151
  370    H    GLU  48           H        GLU  48  -4.017  -6.193  -3.802
  371    HA   GLU  48           HA       GLU  48  -6.079  -7.714  -5.116
  372   1HB   GLU  48          2HB       GLU  48  -3.861  -5.914  -6.008
  373   2HB   GLU  48          1HB       GLU  48  -4.581  -7.009  -7.180
  374   1HG   GLU  48          2HG       GLU  48  -6.576  -5.562  -5.649
  375   2HG   GLU  48          1HG       GLU  48  -5.479  -4.491  -6.519
  376    H    ILE  49           H        ILE  49  -2.637  -7.998  -4.514
  377    HA   ILE  49           HA       ILE  49  -2.152 -10.237  -6.176
  378    HB   ILE  49           HB       ILE  49  -0.073 -10.489  -5.057
  379   1HG1  ILE  49          2HG1      ILE  49  -0.457  -8.582  -2.869
  380   2HG1  ILE  49          1HG1      ILE  49  -1.419 -10.038  -2.699
  381   1HG2  ILE  49          1HG2      ILE  49  -1.005  -7.891  -5.817
  382   2HG2  ILE  49          2HG2      ILE  49   0.572  -8.635  -6.069
  383   3HG2  ILE  49          3HG2      ILE  49   0.240  -7.757  -4.575
  384   1HD1  ILE  49          1HD1      ILE  49   1.119  -9.731  -1.858
  385   2HD1  ILE  49          2HD1      ILE  49   1.362 -10.496  -3.428
  386   3HD1  ILE  49          3HD1      ILE  49   0.353 -11.277  -2.214
  387    H    LEU  50           H        LEU  50  -3.526  -9.811  -3.049
  388    HA   LEU  50           HA       LEU  50  -3.379 -12.571  -2.261
  389   1HB   LEU  50          2HB       LEU  50  -4.778 -10.145  -1.146
  390   2HB   LEU  50          1HB       LEU  50  -4.916 -11.734  -0.415
  391    HG   LEU  50           HG       LEU  50  -2.158 -10.820  -0.886
  392   1HD1  LEU  50          1HD1      LEU  50  -3.997  -9.390   1.011
  393   2HD1  LEU  50          2HD1      LEU  50  -2.969  -8.702  -0.248
  394   3HD1  LEU  50          3HD1      LEU  50  -2.243  -9.408   1.197
  395   1HD2  LEU  50          1HD2      LEU  50  -2.296 -11.550   1.689
  396   2HD2  LEU  50          2HD2      LEU  50  -2.107 -12.700   0.364
  397   3HD2  LEU  50          3HD2      LEU  50  -3.702 -12.411   1.063
  398    H    LYS  51           H        LYS  51  -5.721 -10.421  -3.752
  399    HA   LYS  51           HA       LYS  51  -7.998 -12.045  -3.514
  400   1HB   LYS  51          2HB       LYS  51  -7.257  -9.651  -4.903
  401   2HB   LYS  51          1HB       LYS  51  -8.088 -10.716  -6.028
  402   1HG   LYS  51          2HG       LYS  51  -9.180  -9.969  -3.327
  403   2HG   LYS  51          1HG       LYS  51  -9.556  -9.101  -4.817
  404   1HD   LYS  51          2HD       LYS  51 -10.064 -11.664  -5.558
  405   2HD   LYS  51          1HD       LYS  51 -10.511 -11.709  -3.852
  406   1HE   LYS  51          2HE       LYS  51 -11.745  -9.460  -4.484
  407   2HE   LYS  51          1HE       LYS  51 -11.704 -10.172  -6.092
  408   1HZ   LYS  51          1HZ       LYS  51 -12.907 -11.369  -3.660
  409   2HZ   LYS  51          2HZ       LYS  51 -12.774 -12.164  -5.147
  410   3HZ   LYS  51          3HZ       LYS  51 -13.730 -10.784  -5.008
  411    H    ALA  52           H        ALA  52  -5.158 -12.338  -5.416
  412    HA   ALA  52           HA       ALA  52  -6.154 -14.816  -6.567
  413   1HB   ALA  52          1HB       ALA  52  -5.334 -14.242  -8.810
  414   2HB   ALA  52          2HB       ALA  52  -4.957 -12.613  -8.245
  415   3HB   ALA  52          3HB       ALA  52  -6.632 -13.166  -8.291
  416    H    LEU  53           H        LEU  53  -4.546 -15.011  -4.572
  417    HA   LEU  53           HA       LEU  53  -1.859 -14.619  -4.662
  418   1HB   LEU  53          2HB       LEU  53  -3.629 -16.586  -3.410
  419   2HB   LEU  53          1HB       LEU  53  -1.988 -17.163  -3.632
  420    HG   LEU  53           HG       LEU  53  -2.377 -14.478  -2.396
  421   1HD1  LEU  53          1HD1      LEU  53  -2.614 -17.029  -0.816
  422   2HD1  LEU  53          2HD1      LEU  53  -3.996 -16.042  -1.293
  423   3HD1  LEU  53          3HD1      LEU  53  -2.760 -15.373  -0.227
  424   1HD2  LEU  53          1HD2      LEU  53  -0.333 -16.613  -2.501
  425   2HD2  LEU  53          2HD2      LEU  53  -0.460 -15.706  -0.993
  426   3HD2  LEU  53          3HD2      LEU  53  -0.148 -14.860  -2.509
  427    HA   PRO  54           HA       PRO  54  -0.938 -17.131  -8.324
  428   1HB   PRO  54          2HB       PRO  54   1.142 -15.705  -9.195
  429   2HB   PRO  54          1HB       PRO  54  -0.511 -15.103  -9.370
  430   1HG   PRO  54          2HG       PRO  54   1.579 -14.349  -7.373
  431   2HG   PRO  54          1HG       PRO  54   0.410 -13.318  -8.216
  432   1HD   PRO  54          2HD       PRO  54   0.123 -14.280  -5.626
  433   2HD   PRO  54          1HD       PRO  54  -1.199 -13.688  -6.649
  434    H    THR  55           H        THR  55   1.553 -17.652  -9.141
  435    HA   THR  55           HA       THR  55   2.931 -18.730  -6.768
  436    HB   THR  55           HB       THR  55   3.691 -20.459  -8.702
  437    HG1  THR  55           1HG      THR  55   2.080 -20.839 -10.103
  438   1HG2  THR  55          1HG2      THR  55   1.050 -20.936  -7.400
  439   2HG2  THR  55          2HG2      THR  55   2.529 -20.873  -6.442
  440   3HG2  THR  55          3HG2      THR  55   2.360 -22.069  -7.726
  441    H    GLU  56           H        GLU  56   3.353 -16.223  -8.314
  442    HA   GLU  56           HA       GLU  56   5.058 -14.973  -9.149
  443   1HB   GLU  56          2HB       GLU  56   6.060 -16.375  -7.035
  444   2HB   GLU  56          1HB       GLU  56   7.183 -16.831  -8.308
  445   1HG   GLU  56          2HG       GLU  56   8.054 -14.746  -8.482
  446   2HG   GLU  56          1HG       GLU  56   6.542 -13.956  -8.039