*HEADER    SIGNALING PROTEIN                       24-JUL-00   1FF1              
*TITLE     STRUCTURE OF THE SECOND EPS15 HOMOLOGY DOMAIN OF HUMAN                
*TITLE    2 EPS15 IN COMPLEX WITH PTGSSSTNPFL                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EPIDERMAL GROWTH FACTOR RECEPTOR SUBSTRATE 15;             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SECOND EH DOMAIN;                                          
*COMPND   5 SYNONYM: EPS15;                                                      
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: PTGSSSTNPFL PEPTIDE;                                       
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PRSETA;                                   
*SOURCE   8 MOL_ID: 2;                                                           
*SOURCE   9 SYNTHETIC: YES;                                                      
*SOURCE  10 OTHER_DETAILS: CHEMICALLY SYNTHESIZED PEPTIDE                        
*KEYWDS    COMPLEX, EH DOMAIN, NPF, HRB, CALCIUM BINDING, SIGNALING              
*KEYWDS   2 DOMAIN, EF-HAND                                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    T.DE BEER, A.N.HOOFNAGLE, J.L.ENMON, R.C.BOWERS, M.YAMABHAI,          
*AUTHOR   2 B.K.KAY, M.OVERDUIN                                                  
*REVDAT   1   24-JUL-02 1FF1    0                                                
!! Restraint file for EH2 in complex with the peptide PTGSSSTNPFL
!!
!! Several Xplor restraints files have been concatenated :
!! 1) EH2c_noes_TB_SUM.tbl     - EH2 intramolecular NOE restraint file
!! 2) EH2_NPFL_noes_TB_SUM.tbl - intermolecular NOEs between EH2 and peptide
!! 3) NPFL_noes_TB_SUM.tbl     - peptide - intramolecular NOE restraint file
!! 4) eh2_hbon.tbl             - hydrogen bond file for EH2
!! 5) eh2_dihe.tbl             - dihedral angle file for EH2
!! 6) CAL_restraints.tbl       - calcium-oxygen restraint file to place calcium in structures

!! EH2c_noes_TB_SUM.tbl - Xplor restraint file -  intramolecular NOEs for EH2
assign (resid 7 and name HN )(resid 7 and name HA ) 0.0 0.0 3.5
assign (resid 7 and name HN )(resid 7 and name HB# ) 0.0 0.0 3.1
assign (resid 7 and name HN )(resid 7 and name HD1 ) 0.0 0.0 5
assign (resid 7 and name HN )(resid 7 and name HE3 ) 0.0 0.0 5
assign (resid 7 and name HA )(resid 7 and name HB# ) 0.0 0.0 3.1
assign (resid 7 and name HA )(resid 7 and name HD1 ) 0.0 0.0 2.7
assign (resid 7 and name HB# )(resid 7 and name HD1 ) 0.0 0.0 3.1
assign (resid 7 and name HB# )(resid 7 and name HE1 ) 0.0 0.0 5
assign (resid 7 and name HB# )(resid 7 and name HE3 ) 0.0 0.0 3.1
assign (resid 7 and name HD1 )(resid 7 and name HE1 ) 0.0 0.0 2.7
assign (resid 7 and name HE1 )(resid 7 and name HZ2 ) 0.0 0.0 3.5
assign (resid 8 and name HN )(resid 8 and name HA ) 0.0 0.0 3.5
assign (resid 8 and name HN )(resid 8 and name HB# ) 0.0 0.0 2.7
assign (resid 8 and name HA )(resid 8 and name HB# ) 0.0 0.0 2.7
assign (resid 9 and name HN )(resid 9 and name HA ) 0.0 0.0 3.5
assign (resid 9 and name HN )(resid 9 and name HB ) 0.0 0.0 3.5
assign (resid 9 and name HN )(resid 9 and name HG1# ) 0.0 0.0 5
assign (resid 9 and name HN )(resid 9 and name HG2# ) 0.0 0.0 3.5
assign (resid 9 and name HA )(resid 9 and name HB ) 0.0 0.0 5
assign (resid 9 and name HA )(resid 9 and name HG1# ) 0.0 0.0 2.7
assign (resid 9 and name HA )(resid 9 and name HG2# ) 0.0 0.0 2.7
assign (resid 9 and name HB )(resid 9 and name HG1# ) 0.0 0.0 2.7
assign (resid 9 and name HB )(resid 9 and name HG2# ) 0.0 0.0 2.7
assign (resid 10 and name HN )(resid 10 and name HA ) 0.0 0.0 3.5
assign (resid 10 and name HN )(resid 10 and name HB# ) 0.0 0.0 3.1
assign (resid 10 and name HN )(resid 10 and name HG# ) 0.0 0.0 5
assign (resid 10 and name HA )(resid 10 and name HB# ) 0.0 0.0 3.1
assign (resid 10 and name HA )(resid 10 and name HG# ) 0.0 0.0 4.4
assign (resid 10 and name HA )(resid 10 and name HD# ) 0.0 0.0 4.4
assign (resid 12 and name HN )(resid 12 and name HA ) 0.0 0.0 3.5
assign (resid 12 and name HN )(resid 12 and name HB# ) 0.0 0.0 2.7
assign (resid 12 and name HN )(resid 12 and name HG# ) 0.0 0.0 3.5
assign (resid 12 and name HA )(resid 12 and name HB# ) 0.0 0.0 2.7
assign (resid 12 and name HA )(resid 12 and name HG# ) 0.0 0.0 3.5
assign (resid 12 and name HB# )(resid 12 and name HG# ) 0.0 0.0 2.7
assign (resid 13 and name HN )(resid 13 and name HA ) 0.0 0.0 3.5
assign (resid 13 and name HN )(resid 13 and name HB# ) 0.0 0.0 2.7
assign (resid 13 and name HA )(resid 13 and name HB# ) 0.0 0.0 3.1
assign (resid 14 and name HN )(resid 14 and name HA ) 0.0 0.0 3.5
assign (resid 14 and name HN )(resid 14 and name HB# ) 0.0 0.0 3.1
assign (resid 14 and name HN )(resid 14 and name HG# ) 0.0 0.0 4.4
assign (resid 14 and name HA )(resid 14 and name HB# ) 0.0 0.0 3.1
assign (resid 14 and name HA )(resid 14 and name HG# ) 0.0 0.0 4.4
assign (resid 15 and name HN )(resid 15 and name HA ) 0.0 0.0 3.5
assign (resid 15 and name HN )(resid 15 and name HB# ) 0.0 0.0 2.7
assign (resid 15 and name HA )(resid 15 and name HB# ) 0.0 0.0 2.7
assign (resid 16 and name HN )(resid 16 and name HA ) 0.0 0.0 3.5
assign (resid 16 and name HN )(resid 16 and name HB# ) 0.0 0.0 3.5
assign (resid 16 and name HN )(resid 16 and name HG# ) 0.0 0.0 3.1
assign (resid 16 and name HA )(resid 16 and name HG# ) 0.0 0.0 3.1
assign (resid 17 and name HN )(resid 17 and name HB# ) 0.0 0.0 4.4
assign (resid 17 and name HN )(resid 17 and name HD# ) 0.0 0.0 3.5
assign (resid 17 and name HN )(resid 17 and name HE# ) 0.0 0.0 5
assign (resid 17 and name HA )(resid 17 and name HB# ) 0.0 0.0 3.1
assign (resid 17 and name HA )(resid 17 and name HD# ) 0.0 0.0 2.7
assign (resid 18 and name HN )(resid 18 and name HA ) 0.0 0.0 3.5
assign (resid 18 and name HN )(resid 18 and name HB# ) 0.0 0.0 3.1
assign (resid 19 and name HN )(resid 19 and name HA ) 0.0 0.0 3.5
assign (resid 19 and name HN )(resid 19 and name HB# ) 0.0 0.0 2.7
assign (resid 19 and name HA )(resid 19 and name HB# ) 0.0 0.0 2.7
assign (resid 20 and name HN )(resid 20 and name HA ) 0.0 0.0 3.5
assign (resid 20 and name HN )(resid 20 and name HB ) 0.0 0.0 2.7
assign (resid 20 and name HN )(resid 20 and name HG1# ) 0.0 0.0 3.5
assign (resid 20 and name HN )(resid 20 and name HG2# ) 0.0 0.0 3.5
assign (resid 20 and name HA )(resid 20 and name HB ) 0.0 0.0 3.5
assign (resid 21 and name HN )(resid 21 and name HA ) 0.0 0.0 3.5
assign (resid 21 and name HN )(resid 21 and name HB# ) 0.0 0.0 4.4
assign (resid 21 and name HN )(resid 21 and name HD# ) 0.0 0.0 5
assign (resid 21 and name HA )(resid 21 and name HB# ) 0.0 0.0 2.7
assign (resid 22 and name HN )(resid 22 and name HA ) 0.0 0.0 3.5
assign (resid 22 and name HN )(resid 22 and name HB# ) 0.0 0.0 2.7
assign (resid 22 and name HA )(resid 22 and name HB# ) 0.0 0.0 2.7
assign (resid 23 and name HN )(resid 23 and name HA ) 0.0 0.0 3.5
assign (resid 23 and name HN )(resid 23 and name HB# ) 0.0 0.0 3.5
assign (resid 23 and name HA )(resid 23 and name HB# ) 0.0 0.0 2.7
assign (resid 24 and name HN )(resid 24 and name HA ) 0.0 0.0 3.5
assign (resid 24 and name HN )(resid 24 and name HB# ) 0.0 0.0 3.1
assign (resid 24 and name HN )(resid 24 and name HG ) 0.0 0.0 3.5
assign (resid 24 and name HN )(resid 24 and name HD## ) 0.0 0.0 3.5
assign (resid 24 and name HA )(resid 24 and name HD2# ) 0.0 0.0 2.7
assign (resid 25 and name HN )(resid 25 and name HA ) 0.0 0.0 3.5
assign (resid 25 and name HN )(resid 25 and name HB# ) 0.0 0.0 3.5
assign (resid 25 and name HA )(resid 25 and name HB# ) 0.0 0.0 2.7
assign (resid 26 and name HA )(resid 26 and name HB# ) 0.0 0.0 2.4
assign (resid 26 and name HA )(resid 26 and name HG# ) 0.0 0.0 3.5
assign (resid 26 and name HA )(resid 26 and name HD# ) 0.0 0.0 4.4
assign (resid 27 and name HN )(resid 27 and name HA ) 0.0 0.0 3.5
assign (resid 27 and name HN )(resid 27 and name HB ) 0.0 0.0 2.7
assign (resid 27 and name HN )(resid 27 and name HG## ) 0.0 0.0 3.5
assign (resid 27 and name HA )(resid 27 and name HB ) 0.0 0.0 3.5
assign (resid 27 and name HA )(resid 27 and name HG## ) 0.0 0.0 2.7
assign (resid 28 and name HA )(resid 28 and name HB# ) 0.0 0.0 2.4
assign (resid 29 and name HN )(resid 29 and name HA# ) 0.0 0.0 3.1
assign (resid 30 and name HN )(resid 30 and name HD# ) 0.0 0.0 3.5
assign (resid 30 and name HN )(resid 30 and name HE# ) 0.0 0.0 5
assign (resid 30 and name HN )(resid 30 and name HA ) 0.0 0.0 3.5
assign (resid 30 and name HN )(resid 30 and name HB# ) 0.0 0.0 2.7
assign (resid 30 and name HA )(resid 30 and name HB# ) 0.0 0.0 2.7
assign (resid 30 and name HA )(resid 30 and name HD# ) 0.0 0.0 2.7
assign (resid 30 and name HB# )(resid 30 and name HD# ) 0.0 0.0 2.7
assign (resid 31 and name HN )(resid 31 and name HB# ) 0.0 0.0 3.1
assign (resid 31 and name HN )(resid 31 and name HG ) 0.0 0.0 3.5
assign (resid 31 and name HN )(resid 31 and name HD## ) 0.0 0.0 5
assign (resid 31 and name HA )(resid 31 and name HD2# ) 0.0 0.0 2.7
assign (resid 32 and name HN )(resid 32 and name HA ) 0.0 0.0 3.5
assign (resid 32 and name HN )(resid 32 and name HB# ) 0.0 0.0 3.1
assign (resid 32 and name HA )(resid 32 and name HB# ) 0.0 0.0 2.4
assign (resid 33 and name HN )(resid 33 and name HA# ) 0.0 0.0 2.7
assign (resid 34 and name HN )(resid 34 and name HA ) 0.0 0.0 3.5
assign (resid 34 and name HN )(resid 34 and name HB# ) 0.0 0.0 3.1
assign (resid 34 and name HA )(resid 34 and name HB# ) 0.0 0.0 2.4
assign (resid 35 and name HN )(resid 35 and name HA ) 0.0 0.0 3.5
assign (resid 35 and name HN )(resid 35 and name HB# ) 0.0 0.0 2.4
assign (resid 35 and name HN )(resid 35 and name HG# ) 0.0 0.0 4.4
assign (resid 36 and name HN )(resid 36 and name HA ) 0.0 0.0 3.5
assign (resid 36 and name HN )(resid 36 and name HB ) 0.0 0.0 2.7
assign (resid 36 and name HN )(resid 36 and name HG## ) 0.0 0.0 2.7
assign (resid 36 and name HA )(resid 36 and name HB ) 0.0 0.0 3.5
assign (resid 36 and name HA )(resid 36 and name HG2# ) 0.0 0.0 2.7
assign (resid 36 and name HA )(resid 36 and name HG1# ) 0.0 0.0 2.7
assign (resid 37 and name HN )(resid 37 and name HA ) 0.0 0.0 3.5
assign (resid 37 and name HN )(resid 37 and name HB# ) 0.0 0.0 3.1
assign (resid 37 and name HN )(resid 37 and name HG# ) 0.0 0.0 4.4
assign (resid 39 and name HN )(resid 39 and name HA ) 0.0 0.0 3.5
assign (resid 39 and name HN )(resid 39 and name HB ) 0.0 0.0 2.7
assign (resid 39 and name HN )(resid 39 and name HG2# ) 0.0 0.0 3.5
assign (resid 39 and name HN )(resid 39 and name HG1# ) 0.0 0.0 5
assign (resid 39 and name HA )(resid 39 and name HG2# ) 0.0 0.0 2.7
assign (resid 39 and name HA )(resid 39 and name HG1# ) 0.0 0.0 2.7
assign (resid 40 and name HN )(resid 40 and name HA ) 0.0 0.0 5
assign (resid 40 and name HA )(resid 40 and name HB# ) 0.0 0.0 3.1
assign (resid 40 and name HA )(resid 40 and name HG ) 0.0 0.0 3.5
assign (resid 40 and name HA )(resid 40 and name HD2# ) 0.0 0.0 2.7
assign (resid 40 and name HN )(resid 40 and name HD1# ) 0.0 0.0 5
assign (resid 40 and name HN )(resid 40 and name HD2# ) 0.0 0.0 5
assign (resid 41 and name HN )(resid 41 and name HA ) 0.0 0.0 3.5
assign (resid 41 and name HA )(resid 41 and name HB# ) 0.0 0.0 2.4
assign (resid 41 and name HA )(resid 41 and name HD2# ) 0.0 0.0 2.7
assign (resid 42 and name HN )(resid 42 and name HA ) 0.0 0.0 3.5
assign (resid 42 and name HA )(resid 42 and name HB# ) 0.0 0.0 2.7
assign (resid 42 and name HN )(resid 42 and name HB# ) 0.0 0.0 2.4
assign (resid 42 and name HA )(resid 42 and name HD2# ) 0.0 0.0 4.4
assign (resid 42 and name HB# )(resid 42 and name HD2# ) 0.0 0.0 3.9
assign (resid 43 and name HN )(resid 43 and name HA ) 0.0 0.0 3.5
assign (resid 43 and name HN )(resid 43 and name HB# ) 0.0 0.0 2.7
assign (resid 43 and name HA )(resid 43 and name HB# ) 0.0 0.0 2.4
assign (resid 43 and name HN )(resid 43 and name HG ) 0.0 0.0 3.5
assign (resid 44 and name HN )(resid 44 and name HA ) 0.0 0.0 3.5
assign (resid 44 and name HN )(resid 44 and name HB# ) 0.0 0.0 3.1
assign (resid 45 and name HN )(resid 45 and name HA ) 0.0 0.0 3.5
assign (resid 45 and name HN )(resid 45 and name HB# ) 0.0 0.0 2.7
assign (resid 45 and name HA )(resid 45 and name HD1# ) 0.0 0.0 5
assign (resid 45 and name HA )(resid 45 and name HD2# ) 0.0 0.0 2.7
assign (resid 47 and name HN )(resid 47 and name HA ) 0.0 0.0 3.5
assign (resid 47 and name HN )(resid 47 and name HB ) 0.0 0.0 2.7
assign (resid 47 and name HN )(resid 47 and name HG## ) 0.0 0.0 2.7
assign (resid 47 and name HA )(resid 47 and name HB ) 0.0 0.0 3.5
assign (resid 47 and name HA )(resid 47 and name HG## ) 0.0 0.0 2.7
assign (resid 48 and name HN )(resid 48 and name HA ) 0.0 0.0 3.5
assign (resid 48 and name HN )(resid 48 and name HB# ) 0.0 0.0 3.1
assign (resid 48 and name HA )(resid 48 and name HB# ) 0.0 0.0 2.4
assign (resid 49 and name HN )(resid 49 and name HA ) 0.0 0.0 3.5
assign (resid 49 and name HN )(resid 49 and name HB ) 0.0 0.0 2.7
assign (resid 49 and name HN )(resid 49 and name HG1# ) 0.0 0.0 3.1
assign (resid 49 and name HA )(resid 49 and name HB ) 0.0 0.0 3.5
assign (resid 49 and name HA )(resid 49 and name HG2# ) 0.0 0.0 2.7
assign (resid 49 and name HA )(resid 49 and name HD1# ) 0.0 0.0 2.7
assign (resid 50 and name HN )(resid 50 and name HA ) 0.0 0.0 5
assign (resid 50 and name HN )(resid 50 and name HB# ) 0.0 0.0 3.1
assign (resid 50 and name HN )(resid 50 and name HG ) 0.0 0.0 3.5
assign (resid 51 and name HN )(resid 51 and name HA# ) 0.0 0.0 2.4
assign (resid 52 and name HN )(resid 52 and name HA ) 0.0 0.0 3.5
assign (resid 52 and name HN )(resid 52 and name HB# ) 0.0 0.0 2.7
assign (resid 52 and name HN )(resid 52 and name HG# ) 0.0 0.0 4.4
assign (resid 52 and name HA )(resid 52 and name HB# ) 0.0 0.0 2.7
assign (resid 52 and name HA )(resid 52 and name HG# ) 0.0 0.0 2.7
assign (resid 53 and name HN )(resid 53 and name HA ) 0.0 0.0 3.5
assign (resid 53 and name HN )(resid 53 and name HB ) 0.0 0.0 2.7
assign (resid 53 and name HN )(resid 53 and name HG## ) 0.0 0.0 2.7
assign (resid 53 and name HA )(resid 53 and name HG2# ) 0.0 0.0 2.7
assign (resid 53 and name HA )(resid 53 and name HG1# ) 0.0 0.0 2.7
assign (resid 54 and name HN )(resid 54 and name HA ) 0.0 0.0 3.5
assign (resid 54 and name HN )(resid 54 and name HB# ) 0.0 0.0 2.4
assign (resid 54 and name HN )(resid 54 and name HD1 ) 0.0 0.0 5
assign (resid 54 and name HA )(resid 54 and name HB# ) 0.0 0.0 2.7
assign (resid 54 and name HA )(resid 54 and name HD1 ) 0.0 0.0 5
assign (resid 54 and name HA )(resid 54 and name HE3 ) 0.0 0.0 3.5
assign (resid 54 and name HB# )(resid 54 and name HD1 ) 0.0 0.0 4.4
assign (resid 54 and name HB# )(resid 54 and name HE1 ) 0.0 0.0 4.4
assign (resid 54 and name HB# )(resid 54 and name HE3 ) 0.0 0.0 4.4
assign (resid 55 and name HN )(resid 55 and name HA ) 0.0 0.0 3.5
assign (resid 55 and name HN )(resid 55 and name HB# ) 0.0 0.0 2.7
assign (resid 55 and name HN )(resid 55 and name HG# ) 0.0 0.0 3.5
assign (resid 55 and name HA )(resid 55 and name HB# ) 0.0 0.0 2.4
assign (resid 55 and name HA )(resid 55 and name HG# ) 0.0 0.0 3.1
assign (resid 56 and name HN )(resid 56 and name HA ) 0.0 0.0 3.5
assign (resid 56 and name HN )(resid 56 and name HB# ) 0.0 0.0 3.1
assign (resid 56 and name HN )(resid 56 and name HG ) 0.0 0.0 3.5
assign (resid 56 and name HA )(resid 56 and name HD2# ) 0.0 0.0 2.7
assign (resid 57 and name HN )(resid 57 and name HA ) 0.0 0.0 3.5
assign (resid 57 and name HN )(resid 57 and name HB# ) 0.0 0.0 2.4
assign (resid 57 and name HA )(resid 57 and name HB# ) 0.0 0.0 2.7
assign (resid 58 and name HN )(resid 58 and name HA ) 0.0 0.0 3.5
assign (resid 58 and name HN )(resid 58 and name HB# ) 0.0 0.0 2.4
assign (resid 58 and name HA )(resid 58 and name HB# ) 0.0 0.0 2.7
assign (resid 59 and name HN )(resid 59 and name HA ) 0.0 0.0 3.5
assign (resid 59 and name HN )(resid 59 and name HB ) 0.0 0.0 2.7
assign (resid 59 and name HN )(resid 59 and name HG1# ) 0.0 0.0 3.5
assign (resid 59 and name HA )(resid 59 and name HG2# ) 0.0 0.0 2.7
assign (resid 59 and name HB )(resid 59 and name HG2# ) 0.0 0.0 2.7
assign (resid 60 and name HN )(resid 60 and name HA ) 0.0 0.0 5
assign (resid 60 and name HN )(resid 60 and name HB# ) 0.0 0.0 3.5
assign (resid 61 and name HN )(resid 61 and name HA ) 0.0 0.0 2.7
assign (resid 61 and name HN )(resid 61 and name HB# ) 0.0 0.0 3.5
assign (resid 61 and name HN )(resid 61 and name HD2 ) 0.0 0.0 5
assign (resid 61 and name HA )(resid 61 and name HB# ) 0.0 0.0 2.4
assign (resid 61 and name HA )(resid 61 and name HD2 ) 0.0 0.0 5
assign (resid 61 and name HB# )(resid 61 and name HD2 ) 0.0 0.0 4.4
assign (resid 62 and name HN )(resid 62 and name HA ) 0.0 0.0 3.5
assign (resid 62 and name HN )(resid 62 and name HB# ) 0.0 0.0 3.5
assign (resid 62 and name HA )(resid 62 and name HB# ) 0.0 0.0 2.4
assign (resid 63 and name HN )(resid 63 and name HA# ) 0.0 0.0 3.1
assign (resid 64 and name HN )(resid 64 and name HA ) 0.0 0.0 3.5
assign (resid 64 and name HN )(resid 64 and name HB# ) 0.0 0.0 3.1
assign (resid 64 and name HN )(resid 64 and name HG# ) 0.0 0.0 3.5
assign (resid 64 and name HA )(resid 64 and name HB# ) 0.0 0.0 2.7
assign (resid 64 and name HA )(resid 64 and name HG# ) 0.0 0.0 3.5
assign (resid 65 and name HN )(resid 65 and name HA ) 0.0 0.0 3.5
assign (resid 65 and name HN )(resid 65 and name HB# ) 0.0 0.0 5
assign (resid 65 and name HA )(resid 65 and name HB# ) 0.0 0.0 4.4
assign (resid 65 and name HA )(resid 65 and name HG ) 0.0 0.0 5
assign (resid 65 and name HA )(resid 65 and name HD1# ) 0.0 0.0 5
assign (resid 65 and name HA )(resid 65 and name HD2# ) 0.0 0.0 2.7
assign (resid 66 and name HN )(resid 66 and name HA ) 0.0 0.0 3.5
assign (resid 66 and name HN )(resid 66 and name HB# ) 0.0 0.0 4.4
assign (resid 66 and name HA )(resid 66 and name HB# ) 0.0 0.0 2.4
assign (resid 67 and name HN )(resid 67 and name HA ) 0.0 0.0 3.5
assign (resid 67 and name HN )(resid 67 and name HB# ) 0.0 0.0 3.5
assign (resid 68 and name HN )(resid 68 and name HA ) 0.0 0.0 3.5
assign (resid 68 and name HN )(resid 68 and name HB# ) 0.0 0.0 3.1
assign (resid 69 and name HN )(resid 69 and name HA ) 0.0 0.0 3.5
assign (resid 69 and name HN )(resid 69 and name HB# ) 0.0 0.0 3.1
assign (resid 70 and name HN )(resid 70 and name HA ) 0.0 0.0 3.5
assign (resid 70 and name HN )(resid 70 and name HB# ) 0.0 0.0 3.5
assign (resid 70 and name HD# )(resid 70 and name HA ) 0.0 0.0 3.5
assign (resid 70 and name HD# )(resid 70 and name HB# ) 0.0 0.0 3.5
assign (resid 71 and name HN )(resid 71 and name HA ) 0.0 0.0 3.5
assign (resid 71 and name HN )(resid 71 and name HB# ) 0.0 0.0 2.7
assign (resid 72 and name HN )(resid 72 and name HA ) 0.0 0.0 3.5
assign (resid 72 and name HN )(resid 72 and name HB ) 0.0 0.0 3.5
assign (resid 72 and name HN )(resid 72 and name HG2# ) 0.0 0.0 3.5
assign (resid 72 and name HN )(resid 72 and name HG1# ) 0.0 0.0 5
assign (resid 72 and name HA )(resid 72 and name HG2# ) 0.0 0.0 2.7
assign (resid 72 and name HA )(resid 72 and name HG1# ) 0.0 0.0 2.7
assign (resid 73 and name HN )(resid 73 and name HA ) 0.0 0.0 3.5
assign (resid 73 and name HN )(resid 73 and name HB# ) 0.0 0.0 2.7
assign (resid 74 and name HN )(resid 74 and name HA ) 0.0 0.0 3.5
assign (resid 74 and name HN )(resid 74 and name HB# ) 0.0 0.0 3.5
assign (resid 74 and name HN )(resid 74 and name HG# ) 0.0 0.0 3.1
assign (resid 75 and name HN )(resid 75 and name HA ) 0.0 0.0 3.5
assign (resid 75 and name HN )(resid 75 and name HB# ) 0.0 0.0 3.1
assign (resid 76 and name HN )(resid 76 and name HA ) 0.0 0.0 3.5
assign (resid 76 and name HN )(resid 76 and name HB# ) 0.0 0.0 3.1
assign (resid 76 and name HA )(resid 76 and name HD1# ) 0.0 0.0 5
assign (resid 76 and name HA )(resid 76 and name HD2# ) 0.0 0.0 2.7
assign (resid 77 and name HN )(resid 77 and name HA ) 0.0 0.0 3.5
assign (resid 77 and name HN )(resid 77 and name HB ) 0.0 0.0 3.5
assign (resid 77 and name HN )(resid 77 and name HG2# ) 0.0 0.0 3.5
assign (resid 77 and name HA )(resid 77 and name HG2# ) 0.0 0.0 2.7
assign (resid 77 and name HA )(resid 77 and name HG1# ) 0.0 0.0 2.7
assign (resid 78 and name HN )(resid 78 and name HA ) 0.0 0.0 3.5
assign (resid 78 and name HN )(resid 78 and name HB# ) 0.0 0.0 3.5
assign (resid 78 and name HA )(resid 78 and name HD# ) 0.0 0.0 3.5
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assign (resid 30 and name HA )(resid 67 and name HN ) 0.0 0.0 5
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assign (resid 31 and name HN )(resid 65 and name HN ) 0.0 0.0 3.5
assign (resid 31 and name HD## )(resid 65 and name HN ) 0.0 0.0 5
assign (resid 31 and name HD1# )(resid 65 and name HD1# ) 0.0 0.0 5
assign (resid 31 and name HN )(resid 66 and name HN ) 0.0 0.0 5
assign (resid 31 and name HD## )(resid 70 and name HN ) 0.0 0.0 5
assign (resid 32 and name HA )(resid 54 and name HH2 ) 0.0 0.0 5
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assign (resid 36 and name HB )(resid 54 and name HH2 ) 0.0 0.0 5
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assign (resid 54 and name HE1 )(resid 64 and name HN ) 0.0 0.0 5
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assign (resid 54 and name HZ2 )(resid 64 and name HA ) 0.0 0.0 5
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assign (resid 54 and name HA )(resid 65 and name HD1# ) 0.0 0.0 5
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assign (resid 54 and name HH2 )(resid 65 and name HN ) 0.0 0.0 5
assign (resid 54 and name HH2 )(resid 65 and name HG ) 0.0 0.0 5
assign (resid 54 and name HH2 )(resid 65 and name HD1# ) 0.0 0.0 5
assign (resid 54 and name HH2 )(resid 65 and name HD2# ) 0.0 0.0 5
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assign (resid 54 and name HZ3 )(resid 65 and name HG ) 0.0 0.0 5
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assign (resid 59 and name HG2# )(resid 99 and name HN ) 0.0 0.0 5
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assign (resid 60 and name HN )(resid 69 and name HG# ) 0.0 0.0 5
assign (resid 65 and name HD1# )(resid 73 and name HB# ) 0.0 0.0 2.7
assign (resid 72 and name HG1# )(resid 90 and name HD## ) 0.0 0.0 2.7
assign (resid 72 and name HA )(resid 94 and name HD## ) 0.0 0.0 4.4
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assign (resid 72 and name HG1# )(resid 94 and name HD## ) 0.0 0.0 3.5
assign (resid 72 and name HG## )(resid 94 and name HD## ) 0.0 0.0 3.5
assign (resid 72 and name HG2# )(resid 95 and name HA ) 0.0 0.0 5
assign (resid 72 and name HG## )(resid 95 and name HG## ) 0.0 0.0 5
assign (resid 72 and name HG2# )(resid 96 and name HD# ) 0.0 0.0 3.1
assign (resid 75 and name HD# )(resid 94 and name HD## ) 0.0 0.0 4.4
assign (resid 75 and name HE# )(resid 94 and name HD## ) 0.0 0.0 4.4
assign (resid 76 and name HG )(resid 86 and name HG1# ) 0.0 0.0 5
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assign (resid 76 and name HD1# )(resid 90 and name HD## ) 0.0 0.0 4.4
assign (resid 76 and name HD## )(resid 94 and name HD## ) 0.0 0.0 5
assign (resid 76 and name HD1# )(resid 94 and name HD## ) 0.0 0.0 3.5
assign (resid 80 and name HB# )(resid 85 and name HA ) 0.0 0.0 5
assign (resid 80 and name HB# )(resid 86 and name HN ) 0.0 0.0 5
assign (resid 80 and name HB# )(resid 86 and name HB ) 0.0 0.0 5
assign (resid 80 and name HB# )(resid 86 and name HG2# ) 0.0 0.0 2.7
!!
!! EH2_NPFL_noes_TB_SUM.tbl
!! Xplor restraint file -intermolecular NOEs between EH2 and TNPFL
!!
assign (resid 33 and name HN )(resid 110 and name HG# ) 0.0 0.0 5
assign (resid 33 and name HN )(resid 110 and name HB# ) 0.0 0.0 5
assign (resid 34 and name HN )(resid 110 and name HB# ) 0.0 0.0 5
assign (resid 34 and name HN )(resid 110 and name HG# ) 0.0 0.0 5
assign (resid 37 and name HN )(resid 111 and name HZ ) 0.0 0.0 5
assign (resid 40 and name HN )(resid 111 and name HZ ) 0.0 0.0 5
assign (resid 47 and name HN )(resid 111 and name HB# ) 0.0 0.0 5
assign (resid 51 and name HN )(resid 109 and name HD2# ) 0.0 0.0 5
assign (resid 51 and name HN )(resid 111 and name HB# ) 0.0 0.0 3.1
assign (resid 51 and name HN )(resid 112 and name HD## ) 0.0 0.0 5
assign (resid 52 and name HN )(resid 111 and name HB# ) 0.0 0.0 4.4
assign (resid 54 and name HE1 )(resid 109 and name HA ) 0.0 0.0 3.5
assign (resid 54 and name HE1 )(resid 109 and name HB# ) 0.0 0.0 4.4
assign (resid 54 and name HE1 )(resid 109 and name HD2# ) 0.0 0.0 5
assign (resid 54 and name HN )(resid 109 and name HD2# ) 0.0 0.0 5
assign (resid 54 and name HN )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 55 and name HN )(resid 109 and name HD2# ) 0.0 0.0 3.5
assign (resid 51 and name HA# )(resid 109 and name HD2# ) 0.0 0.0 4.4
assign (resid 54 and name HB# )(resid 109 and name HD2# ) 0.0 0.0 4.4
assign (resid 54 and name HD1 )(resid 109 and name HB# ) 0.0 0.0 3.5
assign (resid 54 and name HD1 )(resid 109 and name HA ) 0.0 0.0 3.5
assign (resid 55 and name HB# )(resid 109 and name HD2# ) 0.0 0.0 5
assign (resid 55 and name HG# )(resid 109 and name HD2# ) 0.0 0.0 5
assign (resid 36 and name HG## )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 36 and name HG## )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 37 and name HA )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 37 and name HA )(resid 111 and name HE# ) 0.0 0.0 3.5
assign (resid 37 and name HG# )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 40 and name HB# )(resid 111 and name HD# ) 0.0 0.0 4.4
assign (resid 40 and name HB# )(resid 111 and name HE# ) 0.0 0.0 4.4
assign (resid 40 and name HG )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 40 and name HD1# )(resid 111 and name HD# ) 0.0 0.0 3.5
assign (resid 40 and name HD1# )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 41 and name HG )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 41 and name HD## )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 41 and name HD## )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 47 and name HA )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 47 and name HG## )(resid 111 and name HD# ) 0.0 0.0 3.5
assign (resid 47 and name HG## )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 50 and name HB# )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 50 and name HB# )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 50 and name HD## )(resid 111 and name HD# ) 0.0 0.0 3.5
assign (resid 50 and name HD## )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 51 and name HA# )(resid 111 and name HD# ) 0.0 0.0 4.4
assign (resid 54 and name HB# )(resid 111 and name HD# ) 0.0 0.0 3.5
assign (resid 47 and name HB )(resid 111 and name HB# ) 0.0 0.0 5
assign (resid 47 and name HG## )(resid 111 and name HB# ) 0.0 0.0 5
assign (resid 51 and name HA# )(resid 111 and name HB# ) 0.0 0.0 4.4
!!
!! NPFL_noes_TB_SUM.tbl
!! intramolecular restraint file for TNPFL
!!
assign (resid 108 and name HN )(resid 108 and name HA ) 0.0 0.0 3.5
assign (resid 108 and name HN )(resid 108 and name HB ) 0.0 0.0 5
assign (resid 108 and name HN )(resid 108 and name HG2# ) 0.0 0.0 2.7
assign (resid 109 and name HN )(resid 109 and name HB# ) 0.0 0.0 2.4
assign (resid 109 and name HD2# )(resid 109 and name HB# ) 0.0 0.0 3.5
assign (resid 111 and name HN )(resid 111 and name HA ) 0.0 0.0 3.5
assign (resid 111 and name HN )(resid 111 and name HB# ) 0.0 0.0 2.7
assign (resid 111 and name HN )(resid 111 and name HD# ) 0.0 0.0 3.5
assign (resid 111 and name HA )(resid 111 and name HB# ) 0.0 0.0 2.7
assign (resid 107 and name HA )(resid 108 and name HN ) 0.0 0.0 2.7
assign (resid 107 and name HB# )(resid 108 and name HN ) 0.0 0.0 4.4
assign (resid 108 and name HN )(resid 109 and name HN ) 0.0 0.0 5
assign (resid 108 and name HN )(resid 109 and name HB# ) 0.0 0.0 5
assign (resid 108 and name HA )(resid 109 and name HN ) 0.0 0.0 3.5
assign (resid 108 and name HB )(resid 109 and name HN ) 0.0 0.0 5
assign (resid 108 and name HG2# )(resid 109 and name HN ) 0.0 0.0 5
assign (resid 109 and name HA )(resid 110 and name HD# ) 0.0 0.0 2.4
assign (resid 109 and name HD2# )(resid 111 and name HN ) 0.0 0.0 5
assign (resid 109 and name HB# )(resid 112 and name HD## ) 0.0 0.0 4.4
assign (resid 109 and name HB# )(resid 112 and name HB# ) 0.0 0.0 5
assign (resid 109 and name HN )(resid 112 and name HB# ) 0.0 0.0 5
assign (resid 109 and name HN )(resid 112 and name HD## ) 0.0 0.0 5
assign (resid 109 and name HD2# )(resid 112 and name HG ) 0.0 0.0 5
assign (resid 109 and name HD2# )(resid 112 and name HD## ) 0.0 0.0 4.4
assign (resid 110 and name HA )(resid 111 and name HN ) 0.0 0.0 5
assign (resid 110 and name HD# )(resid 111 and name HN ) 0.0 0.0 5
assign (resid 110 and name HD# )(resid 111 and name HD# ) 0.0 0.0 3.5
assign (resid 110 and name HG# )(resid 111 and name HD# ) 0.0 0.0 5
assign (resid 110 and name HB# )(resid 111 and name HD# ) 0.0 0.0 4.4
assign (resid 110 and name HD# )(resid 111 and name HE# ) 0.0 0.0 5
assign (resid 110 and name HG# )(resid 111 and name HN ) 0.0 0.0 4.4
assign (resid 111 and name HN )(resid 112 and name HN ) 0.0 0.0 2.7
assign (resid 111 and name HA )(resid 112 and name HN ) 0.0 0.0 5
assign (resid 111 and name HN )(resid 112 and name HD## ) 0.0 0.0 4.4
assign (resid 111 and name HD# )(resid 112 and name HD## ) 0.0 0.0 5
assign (resid 112 and name HA )(resid 112 and name HD## ) 0.0 0.0 5
!!
!! EH2 DIHEDRAL ANGLE RESTRAINTS FOR XPLOR INPUT
!!
!! INCLUDES PHI (CSI & Jhnha), PSI (CSI) 
!!
!! Phi restraints: minimum deviation = 30 degrees -- covered by J-coupling
!! Psi restraints: deviation is set to 60
!!
!! CSI and J-coupling are used together :
!! (accurate determination of small J's is not easy :
!!             Kay and Bax J. Magn. Reson. 86 110-126)
!!
!! examples:
!!
!! phi - sheet
!! assign (resid  i-1 and name c) (resid i and name n)
!!        (resid  i and name ca)  (resid  i and name c) 1 -120.0   30.0  2
!!
!! psi - sheet
!! assign (resid  i and name n)   (resid  i and name ca)
!!        (resid  i and name c)   (resid  i+1 and name n) 1 130.0   60.0  2
!!
!! phi - helix 
!! assign (resid  i-1 and name c) (resid i and name n)
!!        (resid  i and name ca)  (resid  i and name c) 1 -60.0   30.0  2
!!
!! psi - helix
!! assign (resid  i and name n)   (resid  i and name ca)
!!        (resid  i and name c)   (resid  i+1 and name n) 1 -40.0   60.0  2
!!
!! phi - coil and J < 6 Hz
!! assign (resid  i-1 and name c) (resid i and name n)
!!        (resid  i and name ca)  (resid  i and name c) 1 60  120.0  2
!!
!! 
!!  CSI Consensus 
!!  -------------
!!  C   1 -  11  
!!  H  12 -  23  
!!  C  24 -  29  
!!  B  30 -  32  
!!  C  33 -  36  
!!  H  37 -  44  
!!  C  45 -  46  
!!  H  47 -  57  
!!  C  58 -  63  
!!  B  64 -  66  
!!  H  67 -  82  
!!  C  83 - 106  
!!
!! Angle-constraint per residue
!! D1
!! R2
!! W3
!! G4
!! S5
!! P6
!! W7 --- no info from HMQC-J, too weak
!! A8      ---     no info from HMQC-J, too weak
!! V9      ---     no info from HMQC-J, too weak
!!
!! K10 --- J-coupling intermediate - 
!!
!! P11
!!
!! E12
!! Warning, on the edge of a secondary structure element
!! Jhn-ha = small to intermediate -- CSI = 'H'
!!
assign (resid   11 and name c )   (resid   12 and name n ) 
 (resid   12 and name ca)   (resid   12 and name c )  1.0 -60.0 30.0 2
assign (resid   12 and name n )   (resid   12 and name ca) 
 (resid   12 and name c )   (resid   13 and name n )  1.0 -40.0 60.0 2
!!
!! D13
!! Warning, CSI helix conflicts with HMQC-J
!! Jhn-ha = 0.19 ppm (9.6 Hz corr is about 0.5 => 100) - large 
!!  define angle  around  -120 increase boundaries 
!! left psi out
!! 
assign (resid   12 and name c )   (resid   13 and name n ) 
       (resid   13 and name ca)   (resid   13 and name c )  1.0 -120.0 50.0 2
!! assign (resid   13 and name n )   (resid   13 and name ca) 
!!      (resid   13 and name c )   (resid   l4 and name n )  1.0 130.0 60.0 2
!!
!! K14
!! Jhn-ha = small, -- CSI = 'H'
assign (resid   13 and name c )   (resid   14 and name n ) 
       (resid   14 and name ca)   (resid   14 and name c )  1.0 -60.0 30.0 2
assign (resid   14 and name n )   (resid   14 and name ca) 
       (resid   14 and name c )   (resid   15 and name n )  1.0 -40.0 60.0 2
!!
!! A15
!! Jhn-ha = small  -- CSI = 'H'
assign (resid   14 and name c )   (resid   15 and name n ) 
 (resid   15 and name ca)   (resid   15 and name c )  1.0 -60.0 30.0 2
assign (resid   15 and name n )   (resid   15 and name ca) 
 (resid   15 and name c )   (resid   16 and name n )  1.0 -40.0 60.0 2
!!
!! K16
!! Jhn-ha = 0.11p (5.6 Hz) -- intermediate  -- CSI = 'H'  -- LOOSER
assign (resid   15 and name c )   (resid   16 and name n ) 
 (resid   16 and name ca)   (resid   16 and name c )  1.0 -60.0 30.0 2
assign (resid   16 and name n )   (resid   16 and name ca) 
 (resid   16 and name c )   (resid   17 and name n )  1.0 -40.0 60.0 2
!!
!! Y17
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   16 and name c )   (resid   17 and name n ) 
       (resid   17 and name ca)   (resid   17 and name c )  1.0 -60.0 30.0 2
assign (resid   17 and name n )   (resid   17 and name ca) 
       (resid   17 and name c )   (resid   18 and name n )  1.0 -40.0 60.0 2
!!
!! D18
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   17 and name c )   (resid   18 and name n ) 
       (resid   18 and name ca)   (resid   18 and name c )  1.0 -60.0 30.0 2
assign (resid   18 and name n )   (resid   18 and name ca) 
       (resid   18 and name c )   (resid   19 and name n )  1.0 -40.0 60.0 2
!!
!! A19
!! Jhn-ha = intermediate -- CSI = 'H' -- LOOSER
assign (resid   18 and name c )   (resid   19 and name n ) 
 (resid   19 and name ca)   (resid   19 and name c )  1.0 -60.0 40.0 2
assign (resid   19 and name n )   (resid   19 and name ca) 
 (resid   19 and name c )   (resid   20 and name n )  1.0 -40.0 60.0 2
!!
!! I20
!! Jhn-ha = 0.11p (5.6 Hz) -- intermediate  -- CSI = 'H'  --LOOSER
assign (resid   19 and name c )   (resid   20 and name n ) 
 (resid   20 and name ca)   (resid   20 and name c )  1.0 -60.0 40.0 2
assign (resid   20 and name n )   (resid   20 and name ca) 
 (resid   20 and name c )   (resid   21 and name n )  1.0 -40.0 60.0 2
!!
!! F21
! Jhn-ha = small  -- CSI = 'H'  
assign (resid   20 and name c )   (resid   21 and name n ) 
       (resid   21 and name ca)   (resid   21 and name c )  1.0 -60.0 30.0 2
assign (resid   21 and name n )   (resid   21 and name ca) 
       (resid   21 and name c )   (resid   22 and name n )  1.0 -40.0 60.0 2
!!
!! D22
!! Jhn-ha = small
assign (resid   21 and name c )   (resid   22 and name n ) 
       (resid   22 and name ca)   (resid   22 and name c )  1.0 -60.0 30.0 2
assign (resid   22 and name n )   (resid   22 and name ca) 
       (resid   22 and name c )   (resid   23 and name n )  1.0 -40.0 60.0 2
!!
!! S23
!! Jhn-ha = 0.09p (4.6 Hz) -- CSI = 'H'  -- LOOSER
assign (resid   22 and name c )   (resid   23 and name n ) 
 (resid   23 and name ca)   (resid   23 and name c )  1.0 -60.0 40.0 2
assign (resid   23 and name n )   (resid   23 and name ca) 
 (resid   23 and name c )   (resid   24 and name n )  1.0 -40.0 60.0 2
!!
!! L24
!! Jhn-ha = 0.16p (8 Hz) -- intermediate
!!
!! S25
!! Jhn-ha = 0.15p (7.6 Hz) intermediate
!!
!! P26
!!
!! V27
!! Jhn-ha = 0.2p (10 Hz)
assign (resid   26 and name c )   (resid   27 and name n ) 
       (resid   27 and name ca)   (resid   27 and name c )  1.0 -120.0 40.0 2
!! assign (resid   27 and name n )   (resid   27 and name ca)
!!       (resid   27 and name c )   (resid   28 and name n )  1.0 130.0 60.0 2
!!
!! N28
!! No info from HMQC-J
!!
!! G29
!!
!! F30
!! Jhn-ha = 0.21 (10.6 Hz)
!! CSI beta-sheet
assign (resid   29 and name c )   (resid   30 and name n ) 
       (resid   30 and name ca)   (resid   30 and name c )  1.0 -120.0 30.0 2
assign (resid   30 and name n )   (resid   30 and name ca) 
       (resid   30 and name c )   (resid   31 and name n )  1.0 130.0 30.0 2
!!
!! L31
!! Jhn-ha = 0.19p (9.6 Hz) 
!! CSI beta-sheet
assign (resid   30 and name c )   (resid   31 and name n ) 
       (resid   31 and name ca)   (resid   31 and name c )  1.0 -120.0 50.0 2
assign (resid   31 and name n )   (resid   31 and name ca) 
       (resid   31 and name c )   (resid   32 and name n )  1.0 130.0 30.0 2
!!
!! S32
!! Jhn-ha = intermediate 
!! assign (resid   31 and name c )   (resid   32 and name n ) 
!!       (resid   32 and name ca)   (resid   32 and name c )  1.0 -120.0 30.0 2
!! assign (resid   32 and name n )   (resid   32 and name ca) 
!!       (resid   32 and name c )   (resid   33 and name n )  1.0 130.0 30.0 2
!!
!! G33
!!
!! D34
!! Jhn-ha = intermediate 
!!
!! K35
!! Jhn-ha=0.19p (9.6 Hz)
assign (resid   34 and name c )   (resid   35 and name n ) 
       (resid   35 and name ca)   (resid   35 and name c )  1.0 -120.0 40.0 2
!!
!! V36
!!      Jhn-ha=0.16p (8.1 Hz) -- intermediate
assign (resid   35 and name c )   (resid   36 and name n ) 
       (resid   36 and name ca)   (resid   36 and name c )  1.0 -120.0 60.0 2
!!
!! K37
!! Jhn-ha = small -- CSI= 'H'
!!  - Warning, next to a PRO -residue
assign (resid   36 and name c )   (resid   37 and name n ) 
 (resid   37 and name ca)   (resid   37 and name c )  1.0 -60.0 30.0 2
assign (resid   37 and name n )   (resid   37 and name ca) 
 (resid   37 and name c )   (resid   38 and name n )  1.0 -40.0 60.0 2
!!
!! P38
!!
!! V39
!! Jhn-ha = 0.16p (8.1 Hz) -- intermediate
assign (resid   38 and name c )   (resid   39 and name n ) 
 (resid   39 and name ca)   (resid   39 and name c )  1.0 -120.0 60.0 2
!!
!! L40
!! Jhn-ha = intermediate CSI='H' --- LOOSER
assign (resid   39 and name c )   (resid   40 and name n ) 
 (resid   40 and name ca)   (resid   40 and name c )  1.0 -60.0 40.0 2
assign (resid   40 and name n )   (resid   40 and name ca) 
 (resid   40 and name c )   (resid   41 and name n )  1.0 -40.0 60.0 2
!!
!! L41
!!      Jhn-ha = small + CSI helix
assign (resid   40 and name c )   (resid   41 and name n ) 
       (resid   41 and name ca)   (resid   41 and name c )  1.0 -60.0 30.0 2
assign (resid   41 and name n )   (resid   41 and name ca) 
       (resid   41 and name c )   (resid   42 and name n )  1.0 -40.0 60.0 2
!!
!! N42
!! Jhn-ha = small + CSI helix
!! Partial overlap with A15
assign (resid   41 and name c )   (resid   42 and name n ) 
       (resid   42 and name ca)   (resid   42 and name c )  1.0 -60.0 30.0 2
assign (resid   42 and name n )   (resid   42 and name ca) 
       (resid   42 and name c )   (resid   43 and name n )  1.0 -40.0 60.0 2
!!
!! S43
!! Jhn-ha = intermediate + CSI-helix -- LOOSER boundaries
assign (resid   42 and name c )   (resid   43 and name n ) 
 (resid   43 and name ca)   (resid   43 and name c )  1.0 -60.0 30.0 2
assign (resid   43 and name n )   (resid   43 and name ca) 
 (resid   43 and name c )   (resid   44 and name n )  1.0 -40.0 60.0 2
!!
!! K44
!!      Jhn-ha = ?  + CSI-helix + Overlap with T102
!!
!! L45 -- coil
!! Jhn-ha = small to intermediate
assign  (resid   44 and name c )   (resid   45 and name n )
 (resid   45 and name ca)   (resid   45 and name c )  1.0 -60.0 40.0 2
!! assign  (resid   45 and name n )   (resid   45 and name ca)
!! (resid   45 and name c )   (resid   46 and name n )  1.0 -40.0 60.0 2
!!
!! P46
!!
!! V47
!! Jhn-ha = small -- CSI-helix
assign (resid   46 and name c )   (resid   47 and name n ) 
       (resid   47 and name ca)   (resid   47 and name c )  1.0 -60.0 30.0 2
assign (resid   47 and name n )   (resid   47 and name ca) 
       (resid   47 and name c )   (resid   48 and name n )  1.0 -40.0 60.0 2
!!
!! D48
!!      Jhn-ha = small -- CSI-helix
assign (resid   47 and name c )   (resid   48 and name n ) 
       (resid   48 and name ca)   (resid   48 and name c )  1.0 -60.0 30.0 2
assign (resid   48 and name n )   (resid   48 and name ca) 
       (resid   48 and name c )   (resid   49 and name n )  1.0 -40.0 60.0 2
!!
!! I49 -- CSI-helix
!!      Jhn-ha = 0.14p (7.0 Hz) -- intermediate
!! assign (resid   48 and name c )   (resid   49 and name n )
!!       (resid   49 and name ca)   (resid   49 and name c )  1.0 -120.0 60.0 2
! assign (resid   49 and name n )   (resid   49 and name ca) 
!       (resid   49 and name c )   (resid   50 and name n )  1.0 -40.0 60.0 2
!!
!! L50 -- CSI-helix
!! Jhn-ha - small
assign (resid   49 and name c )   (resid   50 and name n ) 
       (resid   50 and name ca)   (resid   50 and name c )  1.0 -60.0 30.0 2
assign (resid   50 and name n )   (resid   50 and name ca) 
       (resid   50 and name c )   (resid   51 and name n )  1.0 -40.0 60.0 2
!!
!! G51
!!
!! R52
!! Jhn-ha = 0.1p (5.0 Hz) -- CSI-helix -- LOOSER
assign (resid   51 and name c )   (resid   52 and name n ) 
 (resid   52 and name ca)   (resid   52 and name c )  1.0 -60.0 40.0 2
assign (resid   52 and name n )   (resid   52 and name ca) 
 (resid   52 and name c )   (resid   53 and name n )  1.0 -40.0 60.0 2
!!
!! V53
!! Jhn-ha = small -- CSI-helix 
assign (resid   52 and name c )   (resid   53 and name n ) 
       (resid   53 and name ca)   (resid   53 and name c )  1.0 -60.0 30.0 2
assign (resid   53 and name n )   (resid   53 and name ca) 
       (resid   53 and name c )   (resid   54 and name n )  1.0 -40.0 60.0 2
!!
!! W54
!! Jhn-ha = small  -- CSI-helix
assign (resid   53 and name c )   (resid   54 and name n ) 
       (resid   54 and name ca)   (resid   54 and name c )  1.0 -60.0 30.0 2
assign (resid   54 and name n )   (resid   54 and name ca) 
       (resid   54 and name c )   (resid   55 and name n )  1.0 -40.0 60.0 2
!!
!! E55
!! Jhn-ha = small   -- CSI-helix
assign (resid   54 and name c )   (resid   55 and name n ) 
       (resid   55 and name ca)   (resid   55 and name c )  1.0 -60.0 30.0 2
assign (resid   55 and name n )   (resid   55 and name ca) 
       (resid   55 and name c )   (resid   56 and name n )  1.0 -40.0 60.0 2
!!
!! L56
!! Jhn-ha = 0.06p (3.0 Hz) -- CSI-helix
assign  (resid   55 and name c )   (resid   56 and name n ) 
 (resid   56 and name ca)   (resid   56 and name c )  1.0 -60.0 30.0 2
assign (resid   56 and name n )   (resid   56 and name ca) 
 (resid   56 and name c )   (resid   57 and name n )  1.0 -40.0 60.0 2
!!
!! S57
!! Jhn-ha = 5.6 Hz -- intermediate -- CSI-helix -- LOOSER
assign (resid   56 and name c )   (resid   57 and name n ) 
       (resid   57 and name ca)   (resid   57 and name c )  1.0 -70.0 30.0 2
assign (resid   57 and name n )   (resid   57 and name ca) 
       (resid   57 and name c )   (resid   58 and name n )  1.0 -40.0 60.0 2
!!
!! D58
!!      Jhn-ha = 0.17p (8.6 Hz)
assign  (resid   57 and name c )   (resid   58 and name n ) 
 (resid   58 and name ca)   (resid   58 and name c )  1.0 -120.0 60.0 2
!!
!! I59
!! Jhn-ha = small CSI = 'C' -- can we keep this ?
!! assign  (resid   58 and name c )   (resid   59 and name n ) 
!! (resid   59 and name ca)   (resid   59 and name c )  1.0 -60.0 30.0 2
!! assign (resid   59 and name n )   (resid   59 and name ca)
!! (resid   59 and name c )   (resid   60 and name n )  1.0 -40.0 60.0 2
!!
!! D60
!! Jhn-ha = 0.21p (10.6 Hz)
assign (resid   59 and name c )   (resid   60 and name n ) 
       (resid   60 and name ca)   (resid   60 and name c )  1.0 -120.0 30.0 2
!!
!! H61 (NOTE : psi,phi = 58,36 in classic EF-hands ! +60 ~ 7 Hz
!! Jhn-ha = 0.14p (7.1 Hz) intermediate
!!
!! D62
!! Jhn-ha = 0.18p (9.1 Hz)
assign (resid   61 and name c )   (resid   62 and name n ) 
       (resid   62 and name ca)   (resid   62 and name c )  1.0 -120.0 50.0 2
!!
!! G63
!!
!! M64
!! Jhn-ha = 0.20p (10.1 Hz)
!! CSI - beta-sheet
assign (resid   63 and name c )   (resid   64 and name n ) 
       (resid   64 and name ca)   (resid   64 and name c )  1.0 -120.0 30.0 2
assign (resid   64 and name n )   (resid   64 and name ca) 
       (resid   64 and name c )   (resid   65 and name n )  1.0 130.0 30.0 2
!!
!! L65
!! Jhn-ha = 0.22p (11.1 Hz)
!! CSI - beta-sheet
assign (resid   64 and name c )   (resid   65 and name n ) 
       (resid   65 and name ca)   (resid   65 and name c )  1.0 -120.0 30.0 2
assign (resid   65 and name n )   (resid   65 and name ca) 
       (resid   65 and name c )   (resid   66 and name n )  1.0 130.0 30.0 2
!!
!! D66
!! Jhn-ha = 'unclear' appears 0.16-0.22p (8-11 Hz)
!!      CSI - beta-sheet
assign (resid   65 and name c )   (resid   66 and name n ) 
       (resid   66 and name ca)   (resid   66 and name c )  1.0 -120.0 50.0 2
assign (resid   66 and name n )   (resid   66 and name ca) 
       (resid   66 and name c )   (resid   67 and name n )  1.0 130.0 50.0 2
!!
!! R67
!! Jhn-ha = small -- CSI = 'H'
!! Warning, on the edge of a secondary structure element
assign (resid   66 and name c )   (resid   67 and name n ) 
       (resid   67 and name ca)   (resid   67 and name c )  1.0 -60.0 30.0 2
assign (resid   67 and name n )   (resid   67 and name ca) 
       (resid   67 and name c )   (resid   68 and name n )  1.0 -40.0 60.0 2
!!
!! D68
!! Jhn-ha = 0.1p (5.1 Hz) -- CSI = 'H' -- LOOSER
assign (resid   67 and name c )   (resid   68 and name n ) 
       (resid   68 and name ca)   (resid   68 and name c )  1.0 -60.0 30.0 2
assign (resid   68 and name n )   (resid   68 and name ca) 
       (resid   68 and name c )   (resid   69 and name n )  1.0 -40.0 60.0 2
!!
!! E69
!! Jhn-ha = small -- CSI = 'H'
assign (resid   68 and name c )   (resid   69 and name n ) 
       (resid   69 and name ca)   (resid   69 and name c )  1.0 -60.0 30.0 2
assign (resid   69 and name n )   (resid   69 and name ca) 
       (resid   69 and name c )   (resid   70 and name n )  1.0 -40.0 60.0 2
!!
!! F70
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   69 and name c )   (resid   70 and name n ) 
       (resid   70 and name ca)   (resid   70 and name c )  1.0 -60.0 30.0 2
assign (resid   70 and name n )   (resid   70 and name ca) 
       (resid   70 and name c )   (resid   71 and name n )  1.0 -40.0 60.0 2
!!
!! A71
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   70 and name c )   (resid   71 and name n ) 
       (resid   71 and name ca)   (resid   71 and name c )  1.0 -60.0 30.0 2
assign (resid   71 and name n )   (resid   71 and name ca) 
       (resid   71 and name c )   (resid   72 and name n )  1.0 -40.0 60.0 2
!!
!! V72
!!      Jhn-ha = intermediate -- CSI = 'H'
assign (resid   71 and name c )   (resid   72 and name n ) 
       (resid   72 and name ca)   (resid   72 and name c )  1.0 -60.0 30.0 2
assign (resid   72 and name n )   (resid   72 and name ca) 
       (resid   72 and name c )   (resid   73 and name n )  1.0 -40.0 60.0 2
!!
!! A73
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   72 and name c )   (resid   73 and name n ) 
       (resid   73 and name ca)   (resid   73 and name c )  1.0 -60.0 30.0 2
assign (resid   73 and name n )   (resid   73 and name ca) 
       (resid   73 and name c )   (resid   74 and name n )  1.0 -40.0 60.0 2
!!
!! M74
!! Jhn-ha = small -- CSI = 'H'
assign (resid   73 and name c )   (resid   74 and name n ) 
       (resid   74 and name ca)   (resid   74 and name c )  1.0 -60.0 30.0 2
assign (resid   74 and name n )   (resid   74 and name ca) 
       (resid   74 and name c )   (resid   75 and name n )  1.0 -40.0 60.0 2
!!
!! F75
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   74 and name c )   (resid   75 and name n ) 
       (resid   75 and name ca)   (resid   75 and name c )  1.0 -60.0 30.0 2
assign (resid   75 and name n )   (resid   75 and name ca) 
       (resid   75 and name c )   (resid   76 and name n )  1.0 -40.0 60.0 2
!!
!! L76
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   75 and name c )   (resid   76 and name n ) 
       (resid   76 and name ca)   (resid   76 and name c )  1.0 -60.0 30.0 2
assign (resid   76 and name n )   (resid   76 and name ca) 
       (resid   76 and name c )   (resid   77 and name n )  1.0 -40.0 60.0 2
!!
!! V77
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   76 and name c )   (resid   77 and name n ) 
       (resid   77 and name ca)   (resid   77 and name c )  1.0 -60.0 30.0 2
assign (resid   77 and name n )   (resid   77 and name ca) 
       (resid   77 and name c )   (resid   78 and name n )  1.0 -40.0 60.0 2
!!
!! Y78
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   77 and name c )   (resid   78 and name n ) 
       (resid   78 and name ca)   (resid   78 and name c )  1.0 -60.0 30.0 2
assign (resid   78 and name n )   (resid   78 and name ca) 
       (resid   78 and name c )   (resid   79 and name n )  1.0 -40.0 60.0 2
!!
!! C79
!!      Jhn-ha = small -- CSI = 'H'
assign (resid   78 and name c )   (resid   79 and name n ) 
       (resid   79 and name ca)   (resid   79 and name c )  1.0 -60.0 30.0 2
assign (resid   79 and name n )   (resid   79 and name ca) 
       (resid   79 and name c )   (resid   80 and name n )  1.0 -40.0 60.0 2
!!
!! A80
!!      Jhn-ha = small -- on the edge -- CSI = 'H'
assign (resid   79 and name c )   (resid   80 and name n ) 
       (resid   80 and name ca)   (resid   80 and name c )  1.0 -60.0 30.0 2
assign (resid   80 and name n )   (resid   80 and name ca) 
       (resid   80 and name c )   (resid   81 and name n )  1.0 -40.0 60.0 2
!!
!! L81
!! Jhn-ha = small -- on the edge -- CSI = 'H'
assign (resid   80 and name c )   (resid   81 and name n ) 
       (resid   81 and name ca)   (resid   81 and name c )  1.0 -60.0 30.0 2
assign (resid   81 and name n )   (resid   81 and name ca) 
       (resid   81 and name c )   (resid   82 and name n )  1.0 -40.0 60.0 2
!!
!! E82
!! Jhn-ha = 0.18p (9.1 Hz)
assign (resid   81 and name c )   (resid   82 and name n ) 
       (resid   82 and name ca)   (resid   82 and name c )  1.0 -120.0 50.0 2
!!
!! K83
!!      Jhn-ha = 0.16p (8.1 Hz)
assign (resid   82 and name c )   (resid   83 and name n ) 
       (resid   83 and name ca)   (resid   83 and name c )  1.0 -120.0 60.0 2
!!
!! E84
!! Jhn-ha = large but undetermined due to overlap
assign (resid   83 and name c )   (resid   84 and name n ) 
       (resid   84 and name ca)   (resid   84 and name c )  1.0 -120.0 60.0 2
!!
!! P85
!!
!! V86
!! Jhn-ha = 0.15p (7.6 Hz) -- intermediate
!!
!! P87
!!
!! M88
!!      Jhn-ha = 0.12p (6.0 Hz) -- intermediate
!!
!! S89
!! Jhn-ha = 0.16p (8.1 Hz)  - close to intermediate
assign (resid   88 and name c )   (resid   89 and name n ) 
 (resid   89 and name ca)   (resid   89 and name c )  1.0 -120.0 60.0 2
!!
!! L90
!! Jhn-ha = small
!!
!! P91
!! P92
!!
!! A93
!! Jhn-ha = small
!!
!!      L94
!!      Not determined
!!
!!      V95
!!      Jhn-ha = small
!!
!! P96
!! P97
!!
!! S98
!! Too weak in HMQC-J
!!
!! K99
!! Jhn-ha = 0.23p
assign (resid   98 and name c )   (resid   99 and name n ) 
       (resid   99 and name ca)   (resid   99 and name c )  1.0 -120.0 30.0 2
!!
!! R100
!! Jhn-ha = intermediate
!!
!! K101
!! Too weak in HMQC-J
!!
!! T102
!! not determined
!!
!! W103
!! Jhn-ha = 0.15p
!! disordered, so let's drop this
!! 
!! L104
!! Jhn-ha = 0.16/0.17 (8.0 Hz)
!!
!! E105
!! Jhn-ha = large
!!
!! I106
!!      Jhn-ha = large
!!
! EH2 hydrogen bonds from slow NH exchange
!
! Added hydrogen bonds based on helical conformations
! * means newly added
! ** means edited
!!
!! START
!!
!! helix A
!!
!! * K14 HN 
assign (resid   14 and  name N    )(resid   10 and  name O    ) 3.3 0.9 0.2
assign (resid   14 and  name HN   )(resid   10 and  name O    ) 2.4 0.9 0.4
!!
!! * A15 HN
assign (resid   15 and  name N    )(resid   11 and  name O    ) 3.3 0.9 0.2
assign (resid   15 and  name HN   )(resid   11 and  name O    ) 2.4 0.9 0.4
!!
!! * K16 HN
assign (resid   16 and  name N    )(resid   12 and  name O    ) 3.3 0.9 0.2
assign (resid   16 and  name HN   )(resid   12 and  name O    ) 2.4 0.9 0.4
!!
!! Y17 HN -- FAST
assign (resid   17 and  name N    )(resid   13 and  name O    ) 3.3 0.9 0.2
assign (resid   17 and  name HN   )(resid   13 and  name O    ) 2.4 0.9 0.4
!!
!! * D18 HN
assign (resid   18 and  name N    )(resid   14 and  name O    ) 3.3 0.9 0.2
assign (resid   18 and  name HN   )(resid   14 and  name O    ) 2.4 0.9 0.4
!!
!! * A19 -- leave out for now
! assign (resid   19 and  name N    )(resid   15 and  name O    ) 3.3 0.9 0.2
! assign (resid   19 and  name HN   )(resid   15 and  name O    ) 2.4 0.9 0.4
!
!! I20 HN -- FAST
assign (resid   20 and  name N    )(resid   16 and  name O    ) 3.3 0.9 0.2
assign (resid   20 and  name HN   )(resid   16 and  name O    ) 2.4 0.9 0.4
!!
!! F21 HN -- MEDIUM 
assign (resid   21 and  name N    )(resid   17 and  name O    ) 3.3 0.9 0.2
assign (resid   21 and  name HN   )(resid   17 and  name O    ) 2.4 0.9 0.4
!!
!! D22 HN -- MEDIUM
assign (resid   22 and  name N    )(resid   18 and  name O    ) 3.3 0.9 0.2
assign (resid   22 and  name HN   )(resid   18 and  name O    ) 2.4 0.9 0.4
!!
!! S23 HN -- VERY FAST 
!! * could be to 19:O or 20:O
!! assign (resid   23 and  name N    )(resid   20 and  name O    ) 3.3 0.9 0.2
!! assign (resid   23 and  name HN   )(resid   20 and  name O    ) 2.4 0.9 0.4
!!
!! L24 HN -- SLOW (bidentate wait for second run)
!! * target ?
!! assign (resid   24 and  name N    )(resid   21 and  name O    ) 3.3 0.9 0.2
!! assign (resid   24 and  name HN   )(resid   21 and  name O    ) 2.4 0.9 0.4
!!
!! beta-sheet
!! F30 HN -- VERY FAST
!! L31 HN -- MEDIUM
assign (resid   31 and  name N    )(resid   65 and  name O    ) 3.3 0.9 0.2
assign (resid   31 and  name HN   )(resid   65 and  name O    ) 2.4 0.9 0.4
!!
!! helix B
!! K35 HN 
assign (resid   35 and  name N    )(resid   32 and  name O    ) 3.3 0.9 0.2
assign (resid   35 and  name HN   )(resid   32 and  name O    ) 2.4 0.9 0.4
!!
!! V36 HN -- VERY FAST 
!! * added
assign (resid   36 and  name N    )(resid   32 and  name O    ) 3.3 0.9 0.2
assign (resid   36 and  name HN   )(resid   32 and  name O    ) 2.4 0.9 0.4
!!
!! K37 HN -- VERY FAST
!! * added
assign (resid   37 and  name N    )(resid   33 and  name O    ) 3.3 0.9 0.2
assign (resid   37 and  name HN   )(resid   33 and  name O    ) 2.4 0.9 0.4
!!
!! * V39 HN 
assign (resid   39 and  name N    )(resid   35 and  name O    ) 3.3 0.9 0.2
assign (resid   39 and  name HN   )(resid   35 and  name O    ) 2.4 0.9 0.4
!!
!! * L40 HN
assign (resid   40 and  name N    )(resid   36 and  name O    ) 3.3 0.9 0.2
assign (resid   40 and  name HN   )(resid   36 and  name O    ) 2.4 0.9 0.4
!!
!! * L41 HN
assign (resid   41 and  name N    )(resid   37 and  name O    ) 3.3 0.9 0.2
assign (resid   41 and  name HN   )(resid   37 and  name O    ) 2.4 0.9 0.4
!!
!! * N42 HN
!! * unclear
!! assign (resid   42 and  name N    )(resid   38 and  name O    ) 3.3 0.9 0.2
!! assign (resid   42 and  name HN   )(resid   38 and  name O    ) 2.4 0.9 0.4
!!
!! * S43 HN + helix cap residue ?
!! assign (resid   43 and  name OG   )(resid   40 and  name O    ) 3.3 0.9 0.2
!! assign (resid   43 and  name HG   )(resid   40 and  name O    ) 2.4 0.9 0.4
!! assign (resid   43 and  name N    )(resid   40 and  name O    ) 3.3 0.9 0.2
!! assign (resid   43 and  name HN   )(resid   40 and  name O    ) 2.4 0.9 0.4
!! assign (resid   43 and  name OG   )(resid   45 and  name O    ) 2.4 0.9 0.2
!!
!!
!! * K44 HN
!! * unclear
!! assign (resid   44 and  name N    )(resid   41 and  name O    ) 3.3 0.9 0.2
!! assign (resid   44 and  name HN   )(resid   41 and  name O    ) 2.4 0.9 0.4
!!
!! helix C
!!
!! * I49 HN
assign (resid   49 and  name N    )(resid   46 and  name O    ) 3.3 0.9 0.2
assign (resid   49 and  name HN   )(resid   46 and  name O    ) 2.4 0.9 0.4
!!
!! * L50 HN
assign (resid   50 and  name N    )(resid   46 and  name O    ) 3.3 0.9 0.2
assign (resid   50 and  name HN   )(resid   46 and  name O    ) 2.4 0.9 0.4
!!
!!
!! * G51 HN
assign (resid   51 and  name N    )(resid   47 and  name O    ) 3.3 0.9 0.2
assign (resid   51 and  name HN   )(resid   47 and  name O    ) 2.4 0.9 0.4
!!
!! * R52 HN
assign (resid   52 and  name N    )(resid   48 and  name O    ) 3.3 0.9 0.2
assign (resid   52 and  name HN   )(resid   48 and  name O    ) 2.4 0.9 0.4
!!
!! * V53 HN
assign (resid   53 and  name N    )(resid   49 and  name O    ) 3.3 0.9 0.2
assign (resid   53 and  name HN   )(resid   49 and  name O    ) 2.4 0.9 0.4
!!
!! * W54 HN
assign (resid   54 and  name N    )(resid   50 and  name O    ) 3.3 0.9 0.2
assign (resid   54 and  name HN   )(resid   50 and  name O    ) 2.4 0.9 0.4
!!
!!
!! E55 HN -- MEDIUM -- taken out - bifurcanated
!! assign (resid   55 and  name N    )(resid   51 and  name O    ) 3.3 0.9 0.2
!! assign (resid   55 and  name HN   )(resid   51 and  name O    ) 2.4 0.9 0.4
!!
!! L56 HN -- SLOW 
assign (resid   56 and  name N    )(resid   52 and  name O    ) 3.3 0.9 0.2
assign (resid   56 and  name HN   )(resid   52 and  name O    ) 2.4 0.9 0.4
!!
!! S57 HN -- SLOW  (bidentate) -- wait for second run
!! or S57:HG or S57:HG E69:O
!! assign (resid   57 and  name N    )(resid   53 and  name O    ) 3.3 0.9 0.2
!! assign (resid   57 and  name HN   )(resid   53 and  name O    ) 2.4 0.9 0.4
!!
!! S57 HN -- SLOW
!! assign (resid   57 and  name N    )(resid   54 and  name O    ) 3.3 0.9 0.2
!! assign (resid   57 and  name HN   )(resid   54 and  name O    ) 2.4 0.9 0.4
!!
!! D58 HN -- SLOW --  EF-hand wait for second run
assign (resid   58 and  name N    )(resid   54 and  name O    ) 3.3 0.9 0.2
assign (resid   58 and  name HN   )(resid   54 and  name O    ) 2.4 0.9 0.4
!!
!! I59 HN -- SLOW 
assign (resid   59 and  name N    )(resid   57 and  name O    ) 3.3 0.9 0.2
assign (resid   59 and  name HN   )(resid   57 and  name O    ) 2.4 0.9 0.4
!!
!! assign (resid   59 and  name N    )(resid   69 and  name OE1    ) 3.3 0.9 0.2
!!      assign (resid   59 and  name HN   )(resid   69 and  name OE1    ) 2.4 0.9 0.4
!!
!! D60 HN VERY FAST
!! -- long H-bond
!!      assign (resid   60 and  name N    )(resid   69 and  name OE1    ) 3.3 0.9 0.2
!!      assign (resid   60 and  name HN   )(resid   69 and  name OE1    ) 2.4 0.9 0.4
!!
!! H61 HN MEDIUM - bifurcated -- long bonds
!! assign (resid   61 and  name N    )(resid   58 and  name O    ) 3.3 0.9 0.2
!! assign (resid   61 and  name HN   )(resid   58 and  name O    ) 2.4 0.9 0.4
!! + 
!! assign (resid   61 and  name N    )(resid   58 and  name OD1    ) 3.3 0.9 0.2
!! assign (resid   61 and  name HN   )(resid   58 and  name OD1    ) 2.4 0.9 0.4
!! these bonds are long thus leaving it out for now
!!
!! D62 HN MEDIUM
!! in EF-hands
!!      assign (resid   62 and  name N    )(resid   58 and  name OD1    ) 3.3 0.9 0.2
!!      assign (resid   62 and  name HN   )(resid   58 and  name OD1    ) 2.4 0.9 0.4 
!!
!!      assign (resid   62 and  name N    )(resid   60 and  name OD2    ) 3.3 0.9 0.2
!!      assign (resid   62 and  name HN   )(resid   60 and  name OD2    ) 2.4 0.9 0.4 
!!
!! G63 HN FAST -- in EF-hand :
!! in EF-hands   G63:HN to Asp-58 O side chain + H2O
!!      assign (resid   63 and  name N    )(resid   58 and  name OD2    ) 3.3 0.9 0.2
!!      assign (resid   63 and  name HN   )(resid   58 and  name OD2    ) 2.4 0.9 0.4
!!
!! M64 HN SLOW 
!!
!!      assign (resid   64 and  name N    )(resid   62 and  name OD2    ) 3.3 0.9 0.2
!!      assign (resid   64 and  name HN   )(resid   62 and  name OD2    ) 2.4 0.9 0.4
!!
!! L65 HN SLOW
assign (resid   65 and  name N    )(resid   31 and  name O    ) 3.3 0.9 0.2
assign (resid   65 and  name HN   )(resid   31 and  name O    ) 2.4 0.9 0.4
!!
!! D66 HN SLOW 
!!
! assign (resid   66 and  name N    )(resid   69 and  name OE2    ) 3.3 0.9 0.2
! assign (resid   66 and  name HN   )(resid   69 and  name OE2    ) 2.4 0.9 0.4
!! 
!! R67 HN VERY FAST
!! bonds to conserved H2O
!! D68 HN VERY FAST
!! no bonds
!!
!! E69 HN SLOW 
!! to side chain of D66 
!! assign (resid   69 and  name N    )(resid   66 and  name OD1    ) 3.3 0.9 0.2
!! assign (resid   69 and  name HN   )(resid   66 and  name OD1    ) 2.4 0.9 0.4
!!
!! helix D
!!
!! F70 HN SLOW
assign (resid   70 and  name N    )(resid   66 and  name O    ) 3.3 0.9 0.2
assign (resid   70 and  name HN   )(resid   66 and  name O    ) 2.4 0.9 0.4
!!
!! A71 HN SLOW 
assign (resid   71 and  name N    )(resid   67 and  name O    ) 3.3 0.9 0.2
assign (resid   71 and  name HN   )(resid   67 and  name O    ) 2.4 0.9 0.4
!!
!! V72 HN SLOW 
assign (resid   72 and  name N    )(resid   68 and  name O    ) 3.3 0.9 0.2
assign (resid   72 and  name HN   )(resid   68 and  name O    ) 2.4 0.9 0.4
!!
!! A73 HN SLOW
assign (resid   73 and  name N    )(resid   69 and  name O    ) 3.3 0.9 0.2
assign (resid   73 and  name HN   )(resid   69 and  name O    ) 2.4 0.9 0.4
!!
!! M74 HN SLOW
assign (resid   74 and  name N    )(resid   70 and  name O    ) 3.3 0.9 0.2
assign (resid   74 and  name HN   )(resid   70 and  name O    ) 2.4 0.9 0.4
!!
!! F75 HN SLOW 
assign (resid   75 and  name N    )(resid   71 and  name O    ) 3.3 0.9 0.2
assign (resid   75 and  name HN   )(resid   71 and  name O    ) 2.4 0.9 0.4
!!
!! L76 HN SLOW
assign (resid   76 and  name N    )(resid   72 and  name O    ) 3.3 0.9 0.2
assign (resid   76 and  name HN   )(resid   72 and  name O    ) 2.4 0.9 0.4
!!
!! V77 HN SLOW
assign (resid   77 and  name N    )(resid   73 and  name O    ) 3.3 0.9 0.2
assign (resid   77 and  name HN   )(resid   73 and  name O    ) 2.4 0.9 0.4
!!
!! Y78 HN SLOW
assign (resid   78 and  name N    )(resid   74 and  name O    ) 3.3 0.9 0.2
assign (resid   78 and  name HN   )(resid   74 and  name O    ) 2.4 0.9 0.4
!!
!! C79 HN SLOW
assign (resid   79 and  name N    )(resid   75 and  name O    ) 3.3 0.9 0.2
assign (resid   79 and  name HN   )(resid   75 and  name O    ) 2.4 0.9 0.2
!!
!! * A80 HN  -- removed when 7/45 violated
!! assign (resid   80 and  name N    )(resid   76 and  name O    ) 3.3 0.9 0.2
!! assign (resid   80 and  name HN   )(resid   76 and  name O    ) 2.4 0.9 0.2
!!
!! * L81 HN    -- removed when 7/25 violated
!! assign (resid   81 and  name N    )(resid   77 and  name O    ) 3.3 0.9 0.2
!! assign (resid   81 and  name HN   )(resid   77 and  name O    ) 2.4 0.9 0.2
!!
!! * E82 HN   
assign (resid   82 and  name N    )(resid   78 and  name O    ) 3.3 0.9 0.2
assign (resid   82 and  name HN   )(resid   78 and  name O    ) 2.4 0.9 0.2
!!
!! * K83:HN or E84:HN to C79:O
!!
!!
!!
!! END
!! Table containing Ca-constraints
!!
!! assign () () d dminus dplus
!!
!! thus limits are 1.8 - 2.8
!!
assign (resid   58 and   name OD1   )(resid  113 and   name CAL   )  2.5 0.8 0.3
assign (resid   60 and   name OD1   )(resid  113 and   name CAL   )  2.5 0.8 0.3
assign (resid   62 and   name OD1   )(resid  113 and   name CAL   )  2.5 0.8 0.3
assign (resid   64 and   name O     )(resid  113 and   name CAL   )  2.5 0.8 0.3
assign (resid   69 and   name OE1   )(resid  113 and   name CAL   )  2.5 0.8 0.3
assign (resid   69 and   name OE2   )(resid  113 and   name CAL   )  2.5 0.8 0.3

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   PRO   6           HA       PRO   6   2.175   6.299 -23.317
    2   1HB   PRO   6          2HB       PRO   6   0.734   3.981 -23.147
    3   2HB   PRO   6          1HB       PRO   6   1.201   4.715 -24.694
    4   1HG   PRO   6          2HG       PRO   6   2.411   2.416 -23.248
    5   2HG   PRO   6          1HG       PRO   6   2.172   2.659 -24.985
    6   1HD   PRO   6          2HD       PRO   6   4.569   3.006 -23.712
    7   2HD   PRO   6          1HD       PRO   6   4.117   3.830 -25.221
    8    H    TRP   7           H        TRP   7   0.348   5.418 -21.576
    9    HA   TRP   7           HA       TRP   7   1.740   5.488 -18.982
   10   1HB   TRP   7          2HB       TRP   7  -0.293   6.828 -19.531
   11   2HB   TRP   7          1HB       TRP   7  -1.204   5.330 -19.723
   12    HD1  TRP   7           HD1      TRP   7   1.322   5.134 -17.033
   13    HE1  TRP   7           HE1      TRP   7   0.195   5.282 -14.716
   14    HE3  TRP   7           HE3      TRP   7  -3.352   6.619 -18.433
   15    HZ2  TRP   7           HZ2      TRP   7  -2.359   5.948 -13.609
   16    HZ3  TRP   7           HZ3      TRP   7  -5.113   7.004 -16.732
   17    HH2  TRP   7           HH2      TRP   7  -4.622   6.671 -14.324
   18    H    ALA   8           H        ALA   8   2.335   3.616 -17.979
   19    HA   ALA   8           HA       ALA   8   1.999   1.002 -18.767
   20   1HB   ALA   8          1HB       ALA   8   3.364   1.845 -16.876
   21   2HB   ALA   8          2HB       ALA   8   2.385   0.459 -16.392
   22   3HB   ALA   8          3HB       ALA   8   1.890   2.090 -15.936
   23    H    VAL   9           H        VAL   9  -0.418   3.044 -17.240
   24    HA   VAL   9           HA       VAL   9  -2.280   0.744 -16.924
   25    HB   VAL   9           HB       VAL   9  -2.212   3.643 -16.068
   26   1HG1  VAL   9          1HG1      VAL   9  -4.510   3.294 -16.669
   27   2HG1  VAL   9          2HG1      VAL   9  -4.418   3.097 -14.918
   28   3HG1  VAL   9          3HG1      VAL   9  -4.515   1.678 -15.961
   29   1HG2  VAL   9          1HG2      VAL   9  -2.571   2.402 -13.819
   30   2HG2  VAL   9          2HG2      VAL   9  -0.986   2.269 -14.579
   31   3HG2  VAL   9          3HG2      VAL   9  -2.142   0.943 -14.713
   32    H    LYS  10           H        LYS  10  -4.506   0.999 -17.850
   33    HA   LYS  10           HA       LYS  10  -4.440   2.565 -20.411
   34   1HB   LYS  10          2HB       LYS  10  -4.937  -0.204 -19.736
   35   2HB   LYS  10          1HB       LYS  10  -6.344   0.485 -20.545
   36   1HG   LYS  10          2HG       LYS  10  -4.600   1.463 -22.222
   37   2HG   LYS  10          1HG       LYS  10  -3.522   0.234 -21.561
   38   1HD   LYS  10          2HD       LYS  10  -5.036  -1.536 -22.183
   39   2HD   LYS  10          1HD       LYS  10  -6.284  -0.378 -22.641
   40   1HE   LYS  10          2HE       LYS  10  -3.944   0.326 -24.103
   41   2HE   LYS  10          1HE       LYS  10  -4.166  -1.426 -24.276
   42   1HZ   LYS  10          1HZ       LYS  10  -6.539   0.285 -24.393
   43   2HZ   LYS  10          2HZ       LYS  10  -6.224  -1.182 -25.189
   44   3HZ   LYS  10          3HZ       LYS  10  -5.524   0.260 -25.752
   45    HA   PRO  11           HA       PRO  11  -8.251   4.484 -19.389
   46   1HB   PRO  11          2HB       PRO  11  -9.854   4.062 -21.567
   47   2HB   PRO  11          1HB       PRO  11  -8.465   5.168 -21.590
   48   1HG   PRO  11          2HG       PRO  11  -8.700   2.398 -22.644
   49   2HG   PRO  11          1HG       PRO  11  -7.832   3.790 -23.309
   50   1HD   PRO  11          2HD       PRO  11  -6.622   1.743 -21.954
   51   2HD   PRO  11          1HD       PRO  11  -5.971   3.394 -22.045
   52    H    GLU  12           H        GLU  12  -8.657   1.193 -20.649
   53    HA   GLU  12           HA       GLU  12 -11.283   0.825 -19.404
   54   1HB   GLU  12          2HB       GLU  12 -10.898  -1.517 -20.234
   55   2HB   GLU  12          1HB       GLU  12 -10.677  -0.294 -21.484
   56   1HG   GLU  12          2HG       GLU  12  -8.583  -1.033 -21.824
   57   2HG   GLU  12          1HG       GLU  12  -8.176  -0.616 -20.160
   58    H    ASP  13           H        ASP  13  -7.929   0.279 -18.539
   59    HA   ASP  13           HA       ASP  13  -8.539  -1.517 -16.303
   60   1HB   ASP  13          2HB       ASP  13  -6.079  -0.013 -17.250
   61   2HB   ASP  13          1HB       ASP  13  -6.069  -1.128 -15.883
   62    H    LYS  14           H        LYS  14  -7.738   1.894 -16.807
   63    HA   LYS  14           HA       LYS  14  -7.652   2.599 -14.007
   64   1HB   LYS  14          2HB       LYS  14  -6.588   4.023 -15.603
   65   2HB   LYS  14          1HB       LYS  14  -8.028   4.073 -16.619
   66   1HG   LYS  14          2HG       LYS  14  -7.967   6.167 -15.468
   67   2HG   LYS  14          1HG       LYS  14  -9.209   5.209 -14.665
   68   1HD   LYS  14          2HD       LYS  14  -7.948   4.916 -12.757
   69   2HD   LYS  14          1HD       LYS  14  -6.417   4.984 -13.633
   70   1HE   LYS  14          2HE       LYS  14  -6.315   7.082 -12.679
   71   2HE   LYS  14          1HE       LYS  14  -7.335   7.515 -14.066
   72   1HZ   LYS  14          1HZ       LYS  14  -8.149   7.972 -11.631
   73   2HZ   LYS  14          2HZ       LYS  14  -8.606   6.338 -11.699
   74   3HZ   LYS  14          3HZ       LYS  14  -9.235   7.446 -12.822
   75    H    ALA  15           H        ALA  15 -10.137   1.991 -16.313
   76    HA   ALA  15           HA       ALA  15 -12.280   3.525 -15.120
   77   1HB   ALA  15          1HB       ALA  15 -11.778   1.763 -17.327
   78   2HB   ALA  15          2HB       ALA  15 -13.164   2.827 -17.086
   79   3HB   ALA  15          3HB       ALA  15 -13.202   1.173 -16.472
   80    H    LYS  16           H        LYS  16 -11.180   0.143 -14.859
   81    HA   LYS  16           HA       LYS  16 -13.198  -0.556 -12.873
   82   1HB   LYS  16          2HB       LYS  16 -12.322  -2.675 -13.164
   83   2HB   LYS  16          1HB       LYS  16 -11.688  -1.929 -14.628
   84   1HG   LYS  16          2HG       LYS  16  -9.579  -1.440 -13.484
   85   2HG   LYS  16          1HG       LYS  16 -10.212  -2.146 -11.997
   86   1HD   LYS  16          2HD       LYS  16  -8.957  -3.904 -12.948
   87   2HD   LYS  16          1HD       LYS  16 -10.613  -4.272 -13.427
   88   1HE   LYS  16          2HE       LYS  16 -10.168  -3.047 -15.602
   89   2HE   LYS  16          1HE       LYS  16  -8.460  -2.978 -15.127
   90   1HZ   LYS  16          1HZ       LYS  16  -9.061  -4.986 -16.451
   91   2HZ   LYS  16          2HZ       LYS  16 -10.061  -5.478 -15.169
   92   3HZ   LYS  16          3HZ       LYS  16  -8.384  -5.336 -14.935
   93    H    TYR  17           H        TYR  17 -10.013   0.833 -12.909
   94    HA   TYR  17           HA       TYR  17  -9.318   0.370 -10.126
   95   1HB   TYR  17          2HB       TYR  17  -8.474   2.429 -12.199
   96   2HB   TYR  17          1HB       TYR  17  -7.669   2.204 -10.651
   97    HD1  TYR  17           HD1      TYR  17  -8.854  -0.938 -11.680
   98    HD2  TYR  17           HD2      TYR  17  -5.756   1.918 -12.507
   99    HE1  TYR  17           HE1      TYR  17  -7.470  -2.731 -12.686
  100    HE2  TYR  17           HE2      TYR  17  -4.357   0.123 -13.496
  101    HH   TYR  17           HH       TYR  17  -5.008  -2.270 -14.658
  102    H    ASP  18           H        ASP  18 -10.955   2.901 -11.968
  103    HA   ASP  18           HA       ASP  18 -11.202   4.772  -9.752
  104   1HB   ASP  18          2HB       ASP  18 -11.824   4.529 -12.578
  105   2HB   ASP  18          1HB       ASP  18 -13.174   5.255 -11.707
  106    H    ALA  19           H        ALA  19 -12.779   1.856 -10.507
  107    HA   ALA  19           HA       ALA  19 -15.353   2.628  -9.235
  108   1HB   ALA  19          1HB       ALA  19 -14.552   0.825 -11.211
  109   2HB   ALA  19          2HB       ALA  19 -16.127   0.837 -10.417
  110   3HB   ALA  19          3HB       ALA  19 -14.840  -0.204  -9.808
  111    H    ILE  20           H        ILE  20 -12.418   0.802  -8.723
  112    HA   ILE  20           HA       ILE  20 -13.185  -0.333  -6.148
  113    HB   ILE  20           HB       ILE  20 -10.694  -0.013  -7.840
  114   1HG1  ILE  20          2HG1      ILE  20 -11.840  -2.600  -6.841
  115   2HG1  ILE  20          1HG1      ILE  20 -12.643  -1.764  -8.172
  116   1HG2  ILE  20          1HG2      ILE  20  -9.435  -1.258  -6.206
  117   2HG2  ILE  20          2HG2      ILE  20 -10.853  -1.424  -5.174
  118   3HG2  ILE  20          3HG2      ILE  20 -10.121   0.161  -5.420
  119   1HD1  ILE  20          1HD1      ILE  20 -10.310  -1.624  -9.267
  120   2HD1  ILE  20          2HD1      ILE  20 -11.082  -3.210  -9.231
  121   3HD1  ILE  20          3HD1      ILE  20  -9.814  -2.822  -8.068
  122    H    PHE  21           H        PHE  21 -11.403   2.434  -7.410
  123    HA   PHE  21           HA       PHE  21 -10.427   3.422  -4.899
  124   1HB   PHE  21          2HB       PHE  21  -9.272   4.312  -6.682
  125   2HB   PHE  21          1HB       PHE  21 -10.688   4.284  -7.730
  126    HD1  PHE  21           HD1      PHE  21  -8.592   6.314  -5.627
  127    HD2  PHE  21           HD2      PHE  21 -12.536   6.024  -7.305
  128    HE1  PHE  21           HE1      PHE  21  -8.942   8.737  -5.226
  129    HE2  PHE  21           HE2      PHE  21 -12.885   8.447  -6.903
  130    HZ   PHE  21           HZ       PHE  21 -11.090   9.803  -5.865
  131    H    ASP  22           H        ASP  22 -13.302   4.045  -6.852
  132    HA   ASP  22           HA       ASP  22 -14.376   6.008  -4.942
  133   1HB   ASP  22          2HB       ASP  22 -14.767   6.453  -7.237
  134   2HB   ASP  22          1HB       ASP  22 -15.223   4.781  -7.567
  135    H    SER  23           H        SER  23 -14.179   2.700  -4.936
  136    HA   SER  23           HA       SER  23 -16.929   2.162  -3.964
  137   1HB   SER  23          2HB       SER  23 -14.553   0.678  -4.904
  138   2HB   SER  23          1HB       SER  23 -15.412  -0.107  -3.581
  139    HG   SER  23           HG       SER  23 -17.348   0.243  -4.864
  140    H    LEU  24           H        LEU  24 -14.039   3.334  -2.752
  141    HA   LEU  24           HA       LEU  24 -14.477   2.235  -0.005
  142   1HB   LEU  24          2HB       LEU  24 -12.134   3.923  -0.761
  143   2HB   LEU  24          1HB       LEU  24 -12.193   2.509   0.285
  144    HG   LEU  24           HG       LEU  24 -12.535   2.348  -2.716
  145   1HD1  LEU  24          1HD1      LEU  24 -10.007   1.420  -1.541
  146   2HD1  LEU  24          2HD1      LEU  24 -10.236   3.164  -1.443
  147   3HD1  LEU  24          3HD1      LEU  24 -10.287   2.355  -3.011
  148   1HD2  LEU  24          1HD2      LEU  24 -12.558   0.073  -2.413
  149   2HD2  LEU  24          2HD2      LEU  24 -13.136   0.515  -0.805
  150   3HD2  LEU  24          3HD2      LEU  24 -11.429   0.148  -1.060
  151    H    SER  25           H        SER  25 -14.983   4.945  -1.969
  152    HA   SER  25           HA       SER  25 -16.078   6.995  -1.385
  153   1HB   SER  25          2HB       SER  25 -15.221   6.589   1.473
  154   2HB   SER  25          1HB       SER  25 -16.651   7.410   0.853
  155    HG   SER  25           HG       SER  25 -17.456   5.507   1.443
  156    HA   PRO  26           HA       PRO  26 -11.833   8.596  -1.644
  157   1HB   PRO  26          2HB       PRO  26 -12.388  10.286  -3.715
  158   2HB   PRO  26          1HB       PRO  26 -12.010   8.567  -3.948
  159   1HG   PRO  26          2HG       PRO  26 -14.645   9.944  -3.956
  160   2HG   PRO  26          1HG       PRO  26 -14.064   8.615  -4.968
  161   1HD   PRO  26          2HD       PRO  26 -15.735   8.279  -2.834
  162   2HD   PRO  26          1HD       PRO  26 -14.624   7.026  -3.426
  163    H    VAL  27           H        VAL  27 -11.031  10.669  -1.053
  164    HA   VAL  27           HA       VAL  27 -13.101  12.603  -0.068
  165    HB   VAL  27           HB       VAL  27 -10.395  11.820   1.068
  166   1HG1  VAL  27          1HG1      VAL  27 -11.839  13.246   2.979
  167   2HG1  VAL  27          2HG1      VAL  27 -12.123  14.139   1.485
  168   3HG1  VAL  27          3HG1      VAL  27 -10.474  13.858   2.046
  169   1HG2  VAL  27          1HG2      VAL  27 -11.636  10.744   2.820
  170   2HG2  VAL  27          2HG2      VAL  27 -12.349  10.195   1.302
  171   3HG2  VAL  27          3HG2      VAL  27 -13.157  11.440   2.257
  172    H    ASN  28           H        ASN  28 -13.005  14.361  -1.407
  173    HA   ASN  28           HA       ASN  28 -12.123  16.035  -2.796
  174   1HB   ASN  28          2HB       ASN  28 -10.623  17.308  -1.605
  175   2HB   ASN  28          1HB       ASN  28 -11.007  16.154  -0.332
  176   1HD2  ASN  28          1HD2      ASN  28  -9.297  14.859   0.453
  177   2HD2  ASN  28          2HD2      ASN  28  -7.742  14.831  -0.226
  178    H    GLY  29           H        GLY  29 -11.448  13.054  -3.267
  179   1HA   GLY  29          2HA       GLY  29 -10.543  12.195  -5.327
  180   2HA   GLY  29          1HA       GLY  29  -9.481  13.597  -5.415
  181    H    PHE  30           H        PHE  30  -9.921  11.467  -2.586
  182    HA   PHE  30           HA       PHE  30  -7.236  10.288  -3.081
  183   1HB   PHE  30          2HB       PHE  30  -8.000  12.118  -0.813
  184   2HB   PHE  30          1HB       PHE  30  -6.587  11.053  -0.737
  185    HD1  PHE  30           HD1      PHE  30  -8.047  14.026  -2.236
  186    HD2  PHE  30           HD2      PHE  30  -4.745  11.301  -2.376
  187    HE1  PHE  30           HE1      PHE  30  -6.788  15.645  -3.611
  188    HE2  PHE  30           HE2      PHE  30  -3.462  12.928  -3.751
  189    HZ   PHE  30           HZ       PHE  30  -4.486  15.104  -4.371
  190    H    LEU  31           H        LEU  31  -6.848   8.392  -1.989
  191    HA   LEU  31           HA       LEU  31  -9.067   7.324  -0.266
  192   1HB   LEU  31          2HB       LEU  31  -7.272   6.068  -2.351
  193   2HB   LEU  31          1HB       LEU  31  -8.045   5.082  -1.112
  194    HG   LEU  31           HG       LEU  31  -9.361   6.740  -3.256
  195   1HD1  LEU  31          1HD1      LEU  31  -9.141   4.642  -4.148
  196   2HD1  LEU  31          2HD1      LEU  31 -10.564   4.308  -3.160
  197   3HD1  LEU  31          3HD1      LEU  31  -8.958   3.891  -2.561
  198   1HD2  LEU  31          1HD2      LEU  31 -10.632   7.242  -1.275
  199   2HD2  LEU  31          2HD2      LEU  31 -10.537   5.571  -0.719
  200   3HD2  LEU  31          3HD2      LEU  31 -11.516   5.978  -2.131
  201    H    SER  32           H        SER  32  -8.356   6.563   1.732
  202    HA   SER  32           HA       SER  32  -5.519   7.058   2.384
  203   1HB   SER  32          2HB       SER  32  -6.357   6.623   4.701
  204   2HB   SER  32          1HB       SER  32  -7.290   7.866   3.868
  205    HG   SER  32           HG       SER  32  -8.057   5.173   3.659
  206    H    GLY  33           H        GLY  33  -4.071   5.446   3.041
  207   1HA   GLY  33          2HA       GLY  33  -4.070   2.937   1.889
  208   2HA   GLY  33          1HA       GLY  33  -3.310   3.228   3.454
  209    H    ASP  34           H        ASP  34  -5.944   3.980   4.631
  210    HA   ASP  34           HA       ASP  34  -6.718   1.464   5.715
  211   1HB   ASP  34          2HB       ASP  34  -7.165   3.477   6.910
  212   2HB   ASP  34          1HB       ASP  34  -7.984   4.203   5.526
  213    H    LYS  35           H        LYS  35  -7.773   3.191   2.822
  214    HA   LYS  35           HA       LYS  35 -10.036   1.302   2.434
  215   1HB   LYS  35          2HB       LYS  35  -9.043   3.826   1.076
  216   2HB   LYS  35          1HB       LYS  35 -10.392   2.880   0.451
  217   1HG   LYS  35          2HG       LYS  35 -11.643   3.200   2.512
  218   2HG   LYS  35          1HG       LYS  35 -10.264   4.008   3.263
  219   1HD   LYS  35          2HD       LYS  35 -10.419   5.661   1.269
  220   2HD   LYS  35          1HD       LYS  35 -12.036   4.998   1.031
  221   1HE   LYS  35          2HE       LYS  35 -12.541   6.736   2.493
  222   2HE   LYS  35          1HE       LYS  35 -12.184   5.464   3.678
  223   1HZ   LYS  35          1HZ       LYS  35 -10.771   7.164   4.323
  224   2HZ   LYS  35          2HZ       LYS  35 -10.442   7.646   2.728
  225   3HZ   LYS  35          3HZ       LYS  35  -9.763   6.215   3.343
  226    H    VAL  36           H        VAL  36  -6.880   2.219   1.171
  227    HA   VAL  36           HA       VAL  36  -7.031   0.434  -1.153
  228    HB   VAL  36           HB       VAL  36  -4.739   1.851   0.238
  229   1HG1  VAL  36          1HG1      VAL  36  -3.416   1.382  -1.633
  230   2HG1  VAL  36          2HG1      VAL  36  -4.811   1.039  -2.656
  231   3HG1  VAL  36          3HG1      VAL  36  -4.312  -0.122  -1.422
  232   1HG2  VAL  36          1HG2      VAL  36  -5.851   2.839  -2.325
  233   2HG2  VAL  36          2HG2      VAL  36  -5.293   3.744  -0.918
  234   3HG2  VAL  36          3HG2      VAL  36  -6.903   3.023  -0.920
  235    H    LYS  37           H        LYS  37  -5.201   0.428   1.930
  236    HA   LYS  37           HA       LYS  37  -3.731  -1.867   1.805
  237   1HB   LYS  37          2HB       LYS  37  -3.791  -0.503   3.777
  238   2HB   LYS  37          1HB       LYS  37  -5.506  -0.821   4.023
  239   1HG   LYS  37          2HG       LYS  37  -4.183  -3.339   3.882
  240   2HG   LYS  37          1HG       LYS  37  -3.270  -2.321   4.996
  241   1HD   LYS  37          2HD       LYS  37  -6.168  -2.079   5.353
  242   2HD   LYS  37          1HD       LYS  37  -5.577  -3.717   5.631
  243   1HE   LYS  37          2HE       LYS  37  -5.473  -2.440   7.729
  244   2HE   LYS  37          1HE       LYS  37  -3.821  -2.760   7.161
  245   1HZ   LYS  37          1HZ       LYS  37  -4.269  -0.383   7.746
  246   2HZ   LYS  37          2HZ       LYS  37  -5.355  -0.323   6.443
  247   3HZ   LYS  37          3HZ       LYS  37  -3.707  -0.624   6.165
  248    HA   PRO  38           HA       PRO  38  -7.476  -4.709   2.835
  249   1HB   PRO  38          2HB       PRO  38  -9.974  -3.650   2.402
  250   2HB   PRO  38          1HB       PRO  38  -9.159  -3.605   3.980
  251   1HG   PRO  38          2HG       PRO  38  -9.355  -1.479   1.892
  252   2HG   PRO  38          1HG       PRO  38  -9.522  -1.348   3.652
  253   1HD   PRO  38          2HD       PRO  38  -7.258  -0.638   2.391
  254   2HD   PRO  38          1HD       PRO  38  -7.241  -1.381   4.007
  255    H    VAL  39           H        VAL  39  -7.909  -2.245   0.337
  256    HA   VAL  39           HA       VAL  39  -9.124  -3.898  -1.671
  257    HB   VAL  39           HB       VAL  39  -7.593  -1.320  -1.490
  258   1HG1  VAL  39          1HG1      VAL  39  -7.541  -2.995  -3.834
  259   2HG1  VAL  39          2HG1      VAL  39  -6.850  -1.389  -3.608
  260   3HG1  VAL  39          3HG1      VAL  39  -8.515  -1.567  -4.162
  261   1HG2  VAL  39          1HG2      VAL  39 -10.195  -1.731  -2.915
  262   2HG2  VAL  39          2HG2      VAL  39  -9.645  -0.356  -1.956
  263   3HG2  VAL  39          3HG2      VAL  39 -10.172  -1.834  -1.154
  264    H    LEU  40           H        LEU  40  -5.779  -3.352  -0.659
  265    HA   LEU  40           HA       LEU  40  -4.660  -4.891  -2.910
  266   1HB   LEU  40          2HB       LEU  40  -3.388  -3.818  -0.370
  267   2HB   LEU  40          1HB       LEU  40  -2.548  -4.289  -1.848
  268    HG   LEU  40           HG       LEU  40  -4.576  -2.047  -1.638
  269   1HD1  LEU  40          1HD1      LEU  40  -2.217  -0.909  -2.390
  270   2HD1  LEU  40          2HD1      LEU  40  -1.635  -2.189  -1.326
  271   3HD1  LEU  40          3HD1      LEU  40  -2.776  -0.989  -0.718
  272   1HD2  LEU  40          1HD2      LEU  40  -2.991  -3.268  -3.884
  273   2HD2  LEU  40          2HD2      LEU  40  -3.465  -1.571  -3.955
  274   3HD2  LEU  40          3HD2      LEU  40  -4.699  -2.828  -3.849
  275    H    LEU  41           H        LEU  41  -5.632  -5.381   0.416
  276    HA   LEU  41           HA       LEU  41  -4.179  -7.880   0.804
  277   1HB   LEU  41          2HB       LEU  41  -6.451  -6.433   2.184
  278   2HB   LEU  41          1HB       LEU  41  -5.806  -7.963   2.779
  279    HG   LEU  41           HG       LEU  41  -4.034  -5.581   2.228
  280   1HD1  LEU  41          1HD1      LEU  41  -5.386  -6.376   4.826
  281   2HD1  LEU  41          2HD1      LEU  41  -5.724  -4.919   3.891
  282   3HD1  LEU  41          3HD1      LEU  41  -4.150  -5.128   4.663
  283   1HD2  LEU  41          1HD2      LEU  41  -3.329  -7.461   4.347
  284   2HD2  LEU  41          2HD2      LEU  41  -2.383  -6.952   2.947
  285   3HD2  LEU  41          3HD2      LEU  41  -3.547  -8.271   2.796
  286    H    ASN  42           H        ASN  42  -6.975  -6.943  -0.904
  287    HA   ASN  42           HA       ASN  42  -8.388  -9.496  -0.581
  288   1HB   ASN  42          2HB       ASN  42  -9.497  -7.267  -0.815
  289   2HB   ASN  42          1HB       ASN  42  -8.836  -7.143  -2.446
  290   1HD2  ASN  42          1HD2      ASN  42 -11.543  -7.058  -2.419
  291   2HD2  ASN  42          2HD2      ASN  42 -12.228  -8.539  -2.885
  292    H    SER  43           H        SER  43  -5.816  -8.346  -2.457
  293    HA   SER  43           HA       SER  43  -6.383  -9.833  -4.917
  294   1HB   SER  43          2HB       SER  43  -3.641  -8.952  -4.212
  295   2HB   SER  43          1HB       SER  43  -4.579  -8.642  -5.672
  296    HG   SER  43           HG       SER  43  -5.580  -6.985  -4.686
  297    H    LYS  44           H        LYS  44  -5.725 -10.918  -1.903
  298    HA   LYS  44           HA       LYS  44  -4.895 -12.991  -1.109
  299   1HB   LYS  44          2HB       LYS  44  -5.744 -13.345  -3.746
  300   2HB   LYS  44          1HB       LYS  44  -4.110 -14.011  -3.739
  301   1HG   LYS  44          2HG       LYS  44  -5.635 -15.789  -3.134
  302   2HG   LYS  44          1HG       LYS  44  -4.738 -15.331  -1.686
  303   1HD   LYS  44          2HD       LYS  44  -6.608 -13.935  -0.937
  304   2HD   LYS  44          1HD       LYS  44  -7.502 -14.313  -2.411
  305   1HE   LYS  44          2HE       LYS  44  -7.970 -16.487  -1.733
  306   2HE   LYS  44          1HE       LYS  44  -6.524 -16.586  -0.708
  307   1HZ   LYS  44          1HZ       LYS  44  -7.731 -14.569   0.464
  308   2HZ   LYS  44          2HZ       LYS  44  -8.067 -16.179   0.895
  309   3HZ   LYS  44          3HZ       LYS  44  -9.111 -15.340  -0.150
  310    H    LEU  45           H        LEU  45  -3.161 -10.575  -2.308
  311    HA   LEU  45           HA       LEU  45  -0.548 -11.968  -2.549
  312   1HB   LEU  45          2HB       LEU  45  -1.697  -9.252  -3.112
  313   2HB   LEU  45          1HB       LEU  45   0.051  -9.409  -2.920
  314    HG   LEU  45           HG       LEU  45  -1.636 -11.051  -4.831
  315   1HD1  LEU  45          1HD1      LEU  45   0.341  -9.353  -6.071
  316   2HD1  LEU  45          2HD1      LEU  45  -0.728  -8.377  -5.062
  317   3HD1  LEU  45          3HD1      LEU  45  -1.403  -9.392  -6.336
  318   1HD2  LEU  45          1HD2      LEU  45   1.285 -10.843  -5.192
  319   2HD2  LEU  45          2HD2      LEU  45   0.241 -12.260  -5.276
  320   3HD2  LEU  45          3HD2      LEU  45   0.804 -11.673  -3.712
  321    HA   PRO  46           HA       PRO  46   0.551 -11.064   1.586
  322   1HB   PRO  46          2HB       PRO  46   3.275 -10.966   1.343
  323   2HB   PRO  46          1HB       PRO  46   2.345 -12.475   1.285
  324   1HG   PRO  46          2HG       PRO  46   3.537 -10.903  -0.923
  325   2HG   PRO  46          1HG       PRO  46   3.363 -12.653  -0.744
  326   1HD   PRO  46          2HD       PRO  46   1.740 -11.083  -2.306
  327   2HD   PRO  46          1HD       PRO  46   1.276 -12.666  -1.654
  328    H    VAL  47           H        VAL  47   1.820  -9.392   2.885
  329    HA   VAL  47           HA       VAL  47   1.198  -6.727   2.071
  330    HB   VAL  47           HB       VAL  47   2.764  -8.121   4.240
  331   1HG1  VAL  47          1HG1      VAL  47   2.254  -5.177   4.432
  332   2HG1  VAL  47          2HG1      VAL  47   3.689  -5.733   3.574
  333   3HG1  VAL  47          3HG1      VAL  47   3.456  -6.159   5.263
  334   1HG2  VAL  47          1HG2      VAL  47   0.097  -6.872   3.881
  335   2HG2  VAL  47          2HG2      VAL  47   0.854  -6.655   5.460
  336   3HG2  VAL  47          3HG2      VAL  47   0.565  -8.279   4.834
  337    H    ASP  48           H        ASP  48   3.755  -8.819   1.237
  338    HA   ASP  48           HA       ASP  48   5.843  -6.834   0.959
  339   1HB   ASP  48          2HB       ASP  48   5.356  -9.680   0.140
  340   2HB   ASP  48          1HB       ASP  48   6.747  -8.810  -0.506
  341    H    ILE  49           H        ILE  49   3.259  -8.139  -1.034
  342    HA   ILE  49           HA       ILE  49   4.235  -6.847  -3.483
  343    HB   ILE  49           HB       ILE  49   1.488  -7.974  -2.898
  344   1HG1  ILE  49          2HG1      ILE  49   3.041  -9.667  -2.171
  345   2HG1  ILE  49          1HG1      ILE  49   2.449 -10.145  -3.760
  346   1HG2  ILE  49          1HG2      ILE  49   1.184  -7.908  -5.147
  347   2HG2  ILE  49          2HG2      ILE  49   2.832  -8.440  -5.480
  348   3HG2  ILE  49          3HG2      ILE  49   2.507  -6.743  -5.122
  349   1HD1  ILE  49          1HD1      ILE  49   4.452  -9.278  -4.822
  350   2HD1  ILE  49          2HD1      ILE  49   4.921 -10.388  -3.532
  351   3HD1  ILE  49          3HD1      ILE  49   5.032  -8.643  -3.279
  352    H    LEU  50           H        LEU  50   1.735  -6.399  -1.044
  353    HA   LEU  50           HA       LEU  50   0.567  -4.026  -2.229
  354   1HB   LEU  50          2HB       LEU  50   0.544  -4.858   0.673
  355   2HB   LEU  50          1HB       LEU  50  -0.714  -4.014  -0.224
  356    HG   LEU  50           HG       LEU  50   0.110  -6.911  -0.497
  357   1HD1  LEU  50          1HD1      LEU  50  -2.442  -7.114  -0.143
  358   2HD1  LEU  50          2HD1      LEU  50  -2.353  -5.444   0.416
  359   3HD1  LEU  50          3HD1      LEU  50  -1.445  -6.704   1.254
  360   1HD2  LEU  50          1HD2      LEU  50  -0.986  -5.097  -2.482
  361   2HD2  LEU  50          2HD2      LEU  50  -2.112  -6.405  -2.131
  362   3HD2  LEU  50          3HD2      LEU  50  -0.475  -6.775  -2.673
  363    H    GLY  51           H        GLY  51   3.183  -4.721   0.020
  364   1HA   GLY  51          2HA       GLY  51   3.499  -1.997   0.970
  365   2HA   GLY  51          1HA       GLY  51   4.711  -3.277   1.101
  366    H    ARG  52           H        ARG  52   4.419  -3.794  -1.821
  367    HA   ARG  52           HA       ARG  52   6.265  -1.651  -2.745
  368   1HB   ARG  52          2HB       ARG  52   6.287  -4.414  -2.812
  369   2HB   ARG  52          1HB       ARG  52   5.767  -3.985  -4.442
  370   1HG   ARG  52          2HG       ARG  52   7.718  -2.291  -4.406
  371   2HG   ARG  52          1HG       ARG  52   8.311  -3.213  -3.024
  372   1HD   ARG  52          2HD       ARG  52   7.662  -4.407  -5.741
  373   2HD   ARG  52          1HD       ARG  52   9.296  -4.044  -5.151
  374    HE   ARG  52           HE       ARG  52   7.508  -5.829  -3.556
  375   1HH1  ARG  52          1HH2      ARG  52   9.984  -5.713  -5.879
  376   2HH1  ARG  52          2HH2      ARG  52  10.980  -6.901  -5.106
  377   1HH2  ARG  52          2HH1      ARG  52   8.968  -7.135  -2.290
  378   2HH2  ARG  52          1HH1      ARG  52  10.404  -7.707  -3.072
  379    H    VAL  53           H        VAL  53   3.148  -3.200  -3.465
  380    HA   VAL  53           HA       VAL  53   2.804  -1.868  -6.032
  381    HB   VAL  53           HB       VAL  53   1.007  -3.268  -4.033
  382   1HG1  VAL  53          1HG1      VAL  53  -0.175  -2.875  -6.660
  383   2HG1  VAL  53          2HG1      VAL  53   0.131  -1.333  -5.870
  384   3HG1  VAL  53          3HG1      VAL  53  -0.865  -2.548  -5.073
  385   1HG2  VAL  53          1HG2      VAL  53   1.529  -4.055  -6.896
  386   2HG2  VAL  53          2HG2      VAL  53   1.090  -5.076  -5.527
  387   3HG2  VAL  53          3HG2      VAL  53   2.723  -4.421  -5.648
  388    H    TRP  54           H        TRP  54   2.035  -1.161  -2.665
  389    HA   TRP  54           HA       TRP  54   0.411   1.175  -3.228
  390   1HB   TRP  54          2HB       TRP  54   0.082   0.156  -1.120
  391   2HB   TRP  54          1HB       TRP  54   1.816  -0.009  -0.832
  392    HD1  TRP  54           HD1      TRP  54   3.189   2.296  -0.414
  393    HE1  TRP  54           HE1      TRP  54   2.461   4.489   0.686
  394    HE3  TRP  54           HE3      TRP  54  -1.872   1.702  -0.602
  395    HZ2  TRP  54           HZ2      TRP  54   0.019   5.826   1.427
  396    HZ3  TRP  54           HZ3      TRP  54  -3.384   3.448   0.310
  397    HH2  TRP  54           HH2      TRP  54  -2.443   5.501   1.320
  398    H    GLU  55           H        GLU  55   3.795   0.769  -2.039
  399    HA   GLU  55           HA       GLU  55   4.502   3.479  -1.922
  400   1HB   GLU  55          2HB       GLU  55   6.028   0.994  -2.679
  401   2HB   GLU  55          1HB       GLU  55   6.816   2.555  -2.468
  402   1HG   GLU  55          2HG       GLU  55   5.007   1.924  -0.270
  403   2HG   GLU  55          1HG       GLU  55   6.291   0.729  -0.450
  404    H    LEU  56           H        LEU  56   5.097   1.335  -4.727
  405    HA   LEU  56           HA       LEU  56   5.850   3.440  -6.508
  406   1HB   LEU  56          2HB       LEU  56   4.543   0.748  -7.044
  407   2HB   LEU  56          1HB       LEU  56   5.404   1.716  -8.241
  408    HG   LEU  56           HG       LEU  56   6.862   1.117  -5.716
  409   1HD1  LEU  56          1HD1      LEU  56   5.587  -0.965  -7.147
  410   2HD1  LEU  56          2HD1      LEU  56   6.827  -1.123  -5.901
  411   3HD1  LEU  56          3HD1      LEU  56   7.291  -1.020  -7.601
  412   1HD2  LEU  56          1HD2      LEU  56   8.708   1.475  -7.051
  413   2HD2  LEU  56          2HD2      LEU  56   7.528   2.310  -8.057
  414   3HD2  LEU  56          3HD2      LEU  56   7.989   0.651  -8.436
  415    H    SER  57           H        SER  57   2.829   2.569  -5.161
  416    HA   SER  57           HA       SER  57   1.214   3.814  -7.318
  417   1HB   SER  57          2HB       SER  57   0.218   1.877  -6.456
  418   2HB   SER  57          1HB       SER  57   0.757   2.216  -4.812
  419    HG   SER  57           HG       SER  57  -1.222   3.625  -6.291
  420    H    ASP  58           H        ASP  58   2.339   4.399  -4.022
  421    HA   ASP  58           HA       ASP  58   0.659   6.697  -3.481
  422   1HB   ASP  58          2HB       ASP  58   2.296   5.001  -2.078
  423   2HB   ASP  58          1HB       ASP  58   3.286   6.460  -2.149
  424    H    ILE  59           H        ILE  59   0.980   8.024  -5.434
  425    HA   ILE  59           HA       ILE  59   3.563   8.924  -6.312
  426    HB   ILE  59           HB       ILE  59   0.816  10.199  -6.524
  427   1HG1  ILE  59          2HG1      ILE  59   1.030   7.800  -7.320
  428   2HG1  ILE  59          1HG1      ILE  59   0.563   8.950  -8.570
  429   1HG2  ILE  59          1HG2      ILE  59   2.311  10.710  -8.826
  430   2HG2  ILE  59          2HG2      ILE  59   3.457  10.940  -7.504
  431   3HG2  ILE  59          3HG2      ILE  59   1.953  11.861  -7.538
  432   1HD1  ILE  59          1HD1      ILE  59   2.843   9.047  -9.406
  433   2HD1  ILE  59          2HD1      ILE  59   2.345   7.357  -9.314
  434   3HD1  ILE  59          3HD1      ILE  59   3.410   8.033  -8.079
  435    H    ASP  60           H        ASP  60   1.341  10.063  -3.812
  436    HA   ASP  60           HA       ASP  60   3.040  12.462  -3.315
  437   1HB   ASP  60          2HB       ASP  60   0.505  11.644  -1.888
  438   2HB   ASP  60          1HB       ASP  60   1.157  13.267  -2.108
  439    H    HIS  61           H        HIS  61   2.490   9.269  -2.161
  440    HA   HIS  61           HA       HIS  61   3.345   8.097  -0.295
  441   1HB   HIS  61          2HB       HIS  61   5.233  10.476  -0.348
  442   2HB   HIS  61          1HB       HIS  61   5.555   8.922   0.419
  443    HD1  HIS  61           HD1      HIS  61   5.706   6.811  -1.227
  444    HD2  HIS  61           HD2      HIS  61   5.757  10.539  -3.095
  445    HE1  HIS  61           HE1      HIS  61   6.531   6.417  -3.589
  446    H    ASP  62           H        ASP  62   1.099   9.658   0.369
  447    HA   ASP  62           HA       ASP  62   1.892  10.783   3.037
  448   1HB   ASP  62          2HB       ASP  62  -0.259  12.163   2.647
  449   2HB   ASP  62          1HB       ASP  62   1.145  12.579   1.663
  450    H    GLY  63           H        GLY  63   1.025   7.999   2.167
  451   1HA   GLY  63          2HA       GLY  63  -0.257   6.313   3.200
  452   2HA   GLY  63          1HA       GLY  63  -0.821   7.525   4.353
  453    H    MET  64           H        MET  64  -1.130   7.879   0.852
  454    HA   MET  64           HA       MET  64  -4.006   7.158   0.977
  455   1HB   MET  64          2HB       MET  64  -2.848   9.902   0.567
  456   2HB   MET  64          1HB       MET  64  -4.433   9.483  -0.076
  457   1HG   MET  64          2HG       MET  64  -5.219   8.890   2.145
  458   2HG   MET  64          1HG       MET  64  -3.615   9.199   2.820
  459   1HE   MET  64          1HE       MET  64  -6.983  10.988   1.418
  460   2HE   MET  64          2HE       MET  64  -6.955  11.849   2.955
  461   3HE   MET  64          3HE       MET  64  -6.747  10.100   2.930
  462    H    LEU  65           H        LEU  65  -4.998   7.156  -1.200
  463    HA   LEU  65           HA       LEU  65  -3.041   7.148  -3.465
  464   1HB   LEU  65          2HB       LEU  65  -4.876   4.989  -2.445
  465   2HB   LEU  65          1HB       LEU  65  -4.459   5.044  -4.159
  466    HG   LEU  65           HG       LEU  65  -2.526   4.851  -1.832
  467   1HD1  LEU  65          1HD1      LEU  65  -2.639   2.920  -4.105
  468   2HD1  LEU  65          2HD1      LEU  65  -3.934   2.843  -2.910
  469   3HD1  LEU  65          3HD1      LEU  65  -2.255   2.634  -2.408
  470   1HD2  LEU  65          1HD2      LEU  65  -2.117   5.309  -4.792
  471   2HD2  LEU  65          2HD2      LEU  65  -0.863   4.581  -3.790
  472   3HD2  LEU  65          3HD2      LEU  65  -1.429   6.214  -3.444
  473    H    ASP  66           H        ASP  66  -3.959   9.015  -4.460
  474    HA   ASP  66           HA       ASP  66  -6.813   9.450  -4.636
  475   1HB   ASP  66          2HB       ASP  66  -6.156  11.320  -6.037
  476   2HB   ASP  66          1HB       ASP  66  -4.996  11.186  -4.719
  477    H    ARG  67           H        ARG  67  -7.918   9.635  -6.819
  478    HA   ARG  67           HA       ARG  67  -8.365   7.277  -8.112
  479   1HB   ARG  67          2HB       ARG  67  -8.969   8.711 -10.088
  480   2HB   ARG  67          1HB       ARG  67  -9.593   9.317  -8.554
  481   1HG   ARG  67          2HG       ARG  67  -7.318  10.649  -8.495
  482   2HG   ARG  67          1HG       ARG  67  -7.350  10.381 -10.238
  483   1HD   ARG  67          2HD       ARG  67  -9.518  11.472 -10.429
  484   2HD   ARG  67          1HD       ARG  67  -9.636  11.619  -8.664
  485    HE   ARG  67           HE       ARG  67  -7.202  12.785  -9.823
  486   1HH1  ARG  67          1HH2      ARG  67  -8.520  13.636  -7.243
  487   2HH1  ARG  67          2HH2      ARG  67  -9.215  15.157  -7.690
  488   1HH2  ARG  67          2HH1      ARG  67  -8.937  14.580 -11.100
  489   2HH2  ARG  67          1HH1      ARG  67  -9.452  15.692  -9.875
  490    H    ASP  68           H        ASP  68  -5.801   9.568  -9.079
  491    HA   ASP  68           HA       ASP  68  -4.807   7.861 -11.212
  492   1HB   ASP  68          2HB       ASP  68  -4.127  10.419  -9.856
  493   2HB   ASP  68          1HB       ASP  68  -2.793   9.596 -10.666
  494    H    GLU  69           H        GLU  69  -3.923   8.388  -7.815
  495    HA   GLU  69           HA       GLU  69  -1.503   6.763  -7.949
  496   1HB   GLU  69          2HB       GLU  69  -3.261   7.735  -5.676
  497   2HB   GLU  69          1HB       GLU  69  -1.665   7.013  -5.465
  498   1HG   GLU  69          2HG       GLU  69  -0.651   8.787  -6.786
  499   2HG   GLU  69          1HG       GLU  69  -2.232   9.484  -7.115
  500    H    PHE  70           H        PHE  70  -4.842   6.270  -6.842
  501    HA   PHE  70           HA       PHE  70  -4.488   3.577  -5.917
  502   1HB   PHE  70          2HB       PHE  70  -6.374   5.314  -5.546
  503   2HB   PHE  70          1HB       PHE  70  -7.002   4.763  -7.102
  504    HD1  PHE  70           HD1      PHE  70  -6.897   4.136  -3.595
  505    HD2  PHE  70           HD2      PHE  70  -7.284   2.194  -7.406
  506    HE1  PHE  70           HE1      PHE  70  -7.907   2.161  -2.488
  507    HE2  PHE  70           HE2      PHE  70  -8.293   0.222  -6.297
  508    HZ   PHE  70           HZ       PHE  70  -8.605   0.213  -3.839
  509    H    ALA  71           H        ALA  71  -4.745   4.998  -9.077
  510    HA   ALA  71           HA       ALA  71  -5.706   2.610 -10.450
  511   1HB   ALA  71          1HB       ALA  71  -4.110   4.894 -11.624
  512   2HB   ALA  71          2HB       ALA  71  -5.786   5.118 -11.114
  513   3HB   ALA  71          3HB       ALA  71  -5.398   3.958 -12.386
  514    H    VAL  72           H        VAL  72  -2.543   4.181 -10.052
  515    HA   VAL  72           HA       VAL  72  -0.954   2.346 -11.528
  516    HB   VAL  72           HB       VAL  72  -0.360   3.991  -9.042
  517   1HG1  VAL  72          1HG1      VAL  72   1.930   3.759  -9.524
  518   2HG1  VAL  72          2HG1      VAL  72   1.618   3.211 -11.168
  519   3HG1  VAL  72          3HG1      VAL  72   1.297   2.137  -9.808
  520   1HG2  VAL  72          1HG2      VAL  72   0.054   4.672 -11.973
  521   2HG2  VAL  72          2HG2      VAL  72   0.327   5.739 -10.593
  522   3HG2  VAL  72          3HG2      VAL  72  -1.315   5.239 -11.014
  523    H    ALA  73           H        ALA  73  -2.302   2.184  -8.285
  524    HA   ALA  73           HA       ALA  73  -0.697  -0.184  -7.542
  525   1HB   ALA  73          1HB       ALA  73  -2.779   0.355  -5.704
  526   2HB   ALA  73          2HB       ALA  73  -2.235   1.921  -6.310
  527   3HB   ALA  73          3HB       ALA  73  -1.081   0.816  -5.561
  528    H    MET  74           H        MET  74  -3.515   0.312  -9.339
  529    HA   MET  74           HA       MET  74  -5.002  -2.032  -8.333
  530   1HB   MET  74          2HB       MET  74  -5.290   0.047 -10.497
  531   2HB   MET  74          1HB       MET  74  -6.334  -1.373 -10.486
  532   1HG   MET  74          2HG       MET  74  -5.994   0.209  -7.963
  533   2HG   MET  74          1HG       MET  74  -7.091   0.799  -9.213
  534   1HE   MET  74          1HE       MET  74  -6.472  -2.949  -7.283
  535   2HE   MET  74          2HE       MET  74  -7.525  -2.197  -6.088
  536   3HE   MET  74          3HE       MET  74  -6.093  -1.339  -6.654
  537    H    PHE  75           H        PHE  75  -3.270  -1.157 -11.335
  538    HA   PHE  75           HA       PHE  75  -3.532  -3.837 -12.434
  539   1HB   PHE  75          2HB       PHE  75  -2.443  -2.895 -14.274
  540   2HB   PHE  75          1HB       PHE  75  -3.095  -1.444 -13.516
  541    HD1  PHE  75           HD1      PHE  75  -0.073  -3.375 -14.252
  542    HD2  PHE  75           HD2      PHE  75  -1.657   0.028 -12.169
  543    HE1  PHE  75           HE1      PHE  75   2.223  -2.490 -13.955
  544    HE2  PHE  75           HE2      PHE  75   0.628   0.917 -11.878
  545    HZ   PHE  75           HZ       PHE  75   2.579  -0.347 -12.766
  546    H    LEU  76           H        LEU  76  -1.238  -2.059 -10.465
  547    HA   LEU  76           HA       LEU  76   0.973  -3.868 -10.581
  548   1HB   LEU  76          2HB       LEU  76  -0.028  -1.624  -8.948
  549   2HB   LEU  76          1HB       LEU  76   1.014  -2.740  -8.070
  550    HG   LEU  76           HG       LEU  76   1.679  -1.320 -10.657
  551   1HD1  LEU  76          1HD1      LEU  76   2.355   0.285  -9.217
  552   2HD1  LEU  76          2HD1      LEU  76   3.644  -0.827  -8.758
  553   3HD1  LEU  76          3HD1      LEU  76   2.150  -0.775  -7.824
  554   1HD2  LEU  76          1HD2      LEU  76   3.038  -3.094 -11.028
  555   2HD2  LEU  76          2HD2      LEU  76   2.741  -3.749  -9.418
  556   3HD2  LEU  76          3HD2      LEU  76   3.982  -2.519  -9.654
  557    H    VAL  77           H        VAL  77  -2.109  -3.950  -8.981
  558    HA   VAL  77           HA       VAL  77  -1.352  -6.171  -7.167
  559    HB   VAL  77           HB       VAL  77  -3.877  -4.563  -7.734
  560   1HG1  VAL  77          1HG1      VAL  77  -3.509  -7.119  -6.343
  561   2HG1  VAL  77          2HG1      VAL  77  -5.001  -6.303  -6.806
  562   3HG1  VAL  77          3HG1      VAL  77  -4.196  -5.876  -5.298
  563   1HG2  VAL  77          1HG2      VAL  77  -3.417  -3.483  -5.670
  564   2HG2  VAL  77          2HG2      VAL  77  -1.865  -3.554  -6.501
  565   3HG2  VAL  77          3HG2      VAL  77  -2.222  -4.696  -5.204
  566    H    TYR  78           H        TYR  78  -3.606  -5.540  -9.868
  567    HA   TYR  78           HA       TYR  78  -4.526  -8.246 -10.106
  568   1HB   TYR  78          2HB       TYR  78  -4.671  -5.676 -11.554
  569   2HB   TYR  78          1HB       TYR  78  -4.924  -7.111 -12.551
  570    HD1  TYR  78           HD1      TYR  78  -6.637  -4.743 -10.752
  571    HD2  TYR  78           HD2      TYR  78  -6.337  -9.012 -11.110
  572    HE1  TYR  78           HE1      TYR  78  -8.917  -4.975  -9.817
  573    HE2  TYR  78           HE2      TYR  78  -8.627  -9.249 -10.179
  574    HH   TYR  78           HH       TYR  78 -10.604  -6.392  -9.405
  575    H    CYS  79           H        CYS  79  -1.801  -6.494 -11.512
  576    HA   CYS  79           HA       CYS  79  -1.178  -8.649 -13.402
  577   1HB   CYS  79          2HB       CYS  79   0.226  -6.112 -12.505
  578   2HB   CYS  79          1HB       CYS  79   0.817  -7.152 -13.801
  579    HG   CYS  79           HG       CYS  79  -2.074  -6.043 -14.070
  580    H    ALA  80           H        ALA  80  -0.627  -8.060 -10.082
  581    HA   ALA  80           HA       ALA  80   1.960  -9.470  -9.966
  582   1HB   ALA  80          1HB       ALA  80   1.627  -9.114  -7.524
  583   2HB   ALA  80          2HB       ALA  80  -0.010  -8.539  -7.845
  584   3HB   ALA  80          3HB       ALA  80   1.378  -7.621  -8.429
  585    H    LEU  81           H        LEU  81  -1.360 -10.238 -10.072
  586    HA   LEU  81           HA       LEU  81  -1.104 -12.806  -8.646
  587   1HB   LEU  81          2HB       LEU  81  -3.451 -11.687 -10.184
  588   2HB   LEU  81          1HB       LEU  81  -3.485 -12.836  -8.847
  589    HG   LEU  81           HG       LEU  81  -2.252 -10.166  -8.323
  590   1HD1  LEU  81          1HD1      LEU  81  -4.228  -8.975  -8.294
  591   2HD1  LEU  81          2HD1      LEU  81  -5.218 -10.417  -8.071
  592   3HD1  LEU  81          3HD1      LEU  81  -4.545 -10.045  -9.659
  593   1HD2  LEU  81          1HD2      LEU  81  -4.166 -11.899  -6.739
  594   2HD2  LEU  81          2HD2      LEU  81  -3.201 -10.554  -6.130
  595   3HD2  LEU  81          3HD2      LEU  81  -2.410 -12.041  -6.652
  596    H    GLU  82           H        GLU  82  -2.064 -11.687 -11.906
  597    HA   GLU  82           HA       GLU  82  -1.402 -14.431 -12.912
  598   1HB   GLU  82          2HB       GLU  82  -3.070 -12.533 -14.495
  599   2HB   GLU  82          1HB       GLU  82  -3.245 -14.273 -14.290
  600   1HG   GLU  82          2HG       GLU  82  -3.849 -13.639 -11.810
  601   2HG   GLU  82          1HG       GLU  82  -4.188 -12.051 -12.504
  602    H    LYS  83           H        LYS  83   0.326 -11.768 -12.729
  603    HA   LYS  83           HA       LYS  83   1.152 -11.911 -15.608
  604   1HB   LYS  83          2HB       LYS  83   0.025  -9.777 -14.280
  605   2HB   LYS  83          1HB       LYS  83   1.747  -9.405 -14.246
  606   1HG   LYS  83          2HG       LYS  83   1.429 -10.309 -16.817
  607   2HG   LYS  83          1HG       LYS  83  -0.108  -9.489 -16.534
  608   1HD   LYS  83          2HD       LYS  83   1.583  -7.661 -15.474
  609   2HD   LYS  83          1HD       LYS  83   2.636  -8.365 -16.703
  610   1HE   LYS  83          2HE       LYS  83  -0.141  -7.224 -17.192
  611   2HE   LYS  83          1HE       LYS  83   1.396  -6.485 -17.686
  612   1HZ   LYS  83          1HZ       LYS  83   0.220  -9.045 -18.600
  613   2HZ   LYS  83          2HZ       LYS  83   1.870  -8.693 -18.799
  614   3HZ   LYS  83          3HZ       LYS  83   0.695  -7.716 -19.540
  615    H    GLU  84           H        GLU  84   2.630 -10.214 -12.846
  616    HA   GLU  84           HA       GLU  84   4.882 -12.125 -12.772
  617   1HB   GLU  84          2HB       GLU  84   4.782  -9.771 -14.453
  618   2HB   GLU  84          1HB       GLU  84   6.085  -9.616 -13.274
  619   1HG   GLU  84          2HG       GLU  84   6.816 -11.956 -13.924
  620   2HG   GLU  84          1HG       GLU  84   5.655 -11.871 -15.250
  621    HA   PRO  85           HA       PRO  85   5.624 -10.391  -8.801
  622   1HB   PRO  85          2HB       PRO  85   8.298  -9.811  -8.714
  623   2HB   PRO  85          1HB       PRO  85   7.668 -11.469  -8.692
  624   1HG   PRO  85          2HG       PRO  85   8.824  -9.914 -10.950
  625   2HG   PRO  85          1HG       PRO  85   9.010 -11.629 -10.547
  626   1HD   PRO  85          2HD       PRO  85   7.346 -10.715 -12.501
  627   2HD   PRO  85          1HD       PRO  85   7.069 -12.222 -11.603
  628    H    VAL  86           H        VAL  86   6.460  -8.369  -7.588
  629    HA   VAL  86           HA       VAL  86   6.194  -5.967  -9.370
  630    HB   VAL  86           HB       VAL  86   5.487  -6.249  -6.438
  631   1HG1  VAL  86          1HG1      VAL  86   3.834  -4.380  -7.598
  632   2HG1  VAL  86          2HG1      VAL  86   5.341  -4.132  -8.478
  633   3HG1  VAL  86          3HG1      VAL  86   5.316  -4.003  -6.720
  634   1HG2  VAL  86          1HG2      VAL  86   3.147  -6.539  -7.237
  635   2HG2  VAL  86          2HG2      VAL  86   4.185  -7.879  -7.724
  636   3HG2  VAL  86          3HG2      VAL  86   3.745  -6.633  -8.894
  637    HA   PRO  87           HA       PRO  87  10.211  -5.081  -7.622
  638   1HB   PRO  87          2HB       PRO  87  10.805  -3.036  -9.333
  639   2HB   PRO  87          1HB       PRO  87  10.916  -4.743  -9.802
  640   1HG   PRO  87          2HG       PRO  87   8.923  -2.720 -10.551
  641   2HG   PRO  87          1HG       PRO  87   9.401  -4.199 -11.388
  642   1HD   PRO  87          2HD       PRO  87   7.086  -3.788  -9.799
  643   2HD   PRO  87          1HD       PRO  87   7.638  -5.310 -10.527
  644    H    MET  88           H        MET  88  11.261  -2.727  -7.077
  645    HA   MET  88           HA       MET  88   9.107  -1.189  -5.660
  646   1HB   MET  88          2HB       MET  88  12.079  -1.165  -5.140
  647   2HB   MET  88          1HB       MET  88  10.791  -0.653  -4.056
  648   1HG   MET  88          2HG       MET  88  10.018  -2.957  -3.821
  649   2HG   MET  88          1HG       MET  88  11.214  -3.505  -4.996
  650   1HE   MET  88          1HE       MET  88  13.451  -2.823  -4.955
  651   2HE   MET  88          2HE       MET  88  13.979  -4.181  -3.966
  652   3HE   MET  88          3HE       MET  88  14.500  -2.549  -3.556
  653    H    SER  89           H        SER  89  10.502  -0.923  -8.513
  654    HA   SER  89           HA       SER  89  11.480   1.869  -8.137
  655   1HB   SER  89          2HB       SER  89  11.805  -0.194 -10.313
  656   2HB   SER  89          1HB       SER  89  12.426   1.448 -10.430
  657    HG   SER  89           HG       SER  89  13.840  -0.329  -9.544
  658    H    LEU  90           H        LEU  90   9.766   3.207  -8.320
  659    HA   LEU  90           HA       LEU  90   7.421   2.886  -9.881
  660   1HB   LEU  90          2HB       LEU  90   8.713   4.857  -8.294
  661   2HB   LEU  90          1HB       LEU  90   8.308   5.634  -9.824
  662    HG   LEU  90           HG       LEU  90   6.355   4.023  -8.164
  663   1HD1  LEU  90          1HD1      LEU  90   5.353   6.314  -7.724
  664   2HD1  LEU  90          2HD1      LEU  90   6.839   7.004  -8.375
  665   3HD1  LEU  90          3HD1      LEU  90   6.893   6.011  -6.920
  666   1HD2  LEU  90          1HD2      LEU  90   5.225   5.942 -10.001
  667   2HD2  LEU  90          2HD2      LEU  90   4.981   4.197  -9.942
  668   3HD2  LEU  90          3HD2      LEU  90   6.326   4.869 -10.864
  669    HA   PRO  91           HA       PRO  91   9.652   3.046 -13.802
  670   1HB   PRO  91          2HB       PRO  91   7.499   2.251 -15.314
  671   2HB   PRO  91          1HB       PRO  91   8.563   1.121 -14.450
  672   1HG   PRO  91          2HG       PRO  91   5.885   2.173 -13.668
  673   2HG   PRO  91          1HG       PRO  91   6.549   0.541 -13.500
  674   1HD   PRO  91          2HD       PRO  91   6.411   2.277 -11.427
  675   2HD   PRO  91          1HD       PRO  91   7.701   1.060 -11.576
  676    HA   PRO  92           HA       PRO  92   8.359   7.102 -14.910
  677   1HB   PRO  92          2HB       PRO  92   9.635   7.269 -17.322
  678   2HB   PRO  92          1HB       PRO  92  10.487   7.370 -15.768
  679   1HG   PRO  92          2HG       PRO  92  10.203   5.058 -17.628
  680   2HG   PRO  92          1HG       PRO  92  11.615   5.592 -16.702
  681   1HD   PRO  92          2HD       PRO  92  10.048   3.512 -15.938
  682   2HD   PRO  92          1HD       PRO  92  10.915   4.547 -14.780
  683    H    ALA  93           H        ALA  93   7.436   4.290 -16.573
  684    HA   ALA  93           HA       ALA  93   5.785   5.759 -18.573
  685   1HB   ALA  93          1HB       ALA  93   5.535   2.858 -18.482
  686   2HB   ALA  93          2HB       ALA  93   7.232   3.345 -18.516
  687   3HB   ALA  93          3HB       ALA  93   6.137   3.876 -19.794
  688    H    LEU  94           H        LEU  94   5.384   5.595 -15.555
  689    HA   LEU  94           HA       LEU  94   2.508   4.890 -15.648
  690   1HB   LEU  94          2HB       LEU  94   3.405   2.797 -15.088
  691   2HB   LEU  94          1HB       LEU  94   4.724   3.508 -14.170
  692    HG   LEU  94           HG       LEU  94   1.969   4.021 -13.174
  693   1HD1  LEU  94          1HD1      LEU  94   2.438   1.714 -11.900
  694   2HD1  LEU  94          2HD1      LEU  94   3.245   1.340 -13.423
  695   3HD1  LEU  94          3HD1      LEU  94   1.537   1.776 -13.414
  696   1HD2  LEU  94          1HD2      LEU  94   4.665   4.262 -12.295
  697   2HD2  LEU  94          2HD2      LEU  94   3.905   3.035 -11.280
  698   3HD2  LEU  94          3HD2      LEU  94   3.202   4.649 -11.386
  699    H    VAL  95           H        VAL  95   4.488   7.234 -15.098
  700    HA   VAL  95           HA       VAL  95   3.373   8.009 -12.420
  701    HB   VAL  95           HB       VAL  95   5.847   7.631 -12.616
  702   1HG1  VAL  95          1HG1      VAL  95   5.747   8.612 -15.057
  703   2HG1  VAL  95          2HG1      VAL  95   7.185   8.875 -14.070
  704   3HG1  VAL  95          3HG1      VAL  95   5.984  10.156 -14.238
  705   1HG2  VAL  95          1HG2      VAL  95   6.209  10.325 -12.046
  706   2HG2  VAL  95          2HG2      VAL  95   5.718   9.090 -10.887
  707   3HG2  VAL  95          3HG2      VAL  95   4.499  10.068 -11.704
  708    HA   PRO  96           HA       PRO  96   1.278  11.152 -14.751
  709   1HB   PRO  96          2HB       PRO  96   0.384  12.605 -12.605
  710   2HB   PRO  96          1HB       PRO  96  -0.364  11.077 -13.118
  711   1HG   PRO  96          2HG       PRO  96   1.580  11.588 -10.917
  712   2HG   PRO  96          1HG       PRO  96   0.164  10.525 -10.946
  713   1HD   PRO  96          2HD       PRO  96   2.700   9.606 -11.233
  714   2HD   PRO  96          1HD       PRO  96   1.296   8.819 -11.992
  715    HA   PRO  97           HA       PRO  97   4.358  14.305 -14.852
  716   1HB   PRO  97          2HB       PRO  97   2.968  16.222 -16.222
  717   2HB   PRO  97          1HB       PRO  97   3.615  14.762 -16.996
  718   1HG   PRO  97          2HG       PRO  97   0.839  15.356 -16.101
  719   2HG   PRO  97          1HG       PRO  97   1.401  14.512 -17.552
  720   1HD   PRO  97          2HD       PRO  97   0.438  13.227 -15.351
  721   2HD   PRO  97          1HD       PRO  97   1.627  12.511 -16.462
  722    H    SER  98           H        SER  98   1.574  14.446 -13.002
  723    HA   SER  98           HA       SER  98   1.733  17.253 -12.185
  724   1HB   SER  98          2HB       SER  98   0.399  15.155 -10.534
  725   2HB   SER  98          1HB       SER  98  -0.207  16.730 -11.038
  726    HG   SER  98           HG       SER  98  -0.575  15.893 -13.082
  727    H    LYS  99           H        LYS  99   3.336  14.319 -11.370
  728    HA   LYS  99           HA       LYS  99   4.152  15.242  -8.679
  729   1HB   LYS  99          2HB       LYS  99   3.581  12.838  -9.527
  730   2HB   LYS  99          1HB       LYS  99   5.207  12.864 -10.209
  731   1HG   LYS  99          2HG       LYS  99   5.959  13.621  -7.843
  732   2HG   LYS  99          1HG       LYS  99   4.382  13.031  -7.316
  733   1HD   LYS  99          2HD       LYS  99   5.394  11.007  -7.157
  734   2HD   LYS  99          1HD       LYS  99   5.270  10.970  -8.917
  735   1HE   LYS  99          2HE       LYS  99   7.581  10.540  -8.433
  736   2HE   LYS  99          1HE       LYS  99   7.524  12.246  -8.922
  737   1HZ   LYS  99          1HZ       LYS  99   8.721  11.898  -6.803
  738   2HZ   LYS  99          2HZ       LYS  99   7.290  11.291  -6.118
  739   3HZ   LYS  99          3HZ       LYS  99   7.367  12.906  -6.636
  740    H    ARG 100           H        ARG 100   5.056  15.962 -11.797
  741    HA   ARG 100           HA       ARG 100   7.676  16.987 -10.931
  742   1HB   ARG 100          2HB       ARG 100   8.888  15.663 -12.637
  743   2HB   ARG 100          1HB       ARG 100   8.091  14.615 -11.463
  744   1HG   ARG 100          2HG       ARG 100   6.337  14.075 -12.975
  745   2HG   ARG 100          1HG       ARG 100   6.773  15.389 -14.070
  746   1HD   ARG 100          2HD       ARG 100   7.685  13.474 -15.131
  747   2HD   ARG 100          1HD       ARG 100   9.074  14.136 -14.247
  748    HE   ARG 100           HE       ARG 100   7.428  12.251 -12.706
  749   1HH1  ARG 100          1HH2      ARG 100   9.923  12.550 -15.051
  750   2HH1  ARG 100          2HH2      ARG 100  10.848  11.220 -14.439
  751   1HH2  ARG 100          2HH1      ARG 100   8.708  10.609 -11.782
  752   2HH2  ARG 100          1HH1      ARG 100  10.161  10.122 -12.590
  753    H    SER 107           1H       SER 107   4.902   6.358   8.932
  754    HA   SER 107           HA       SER 107   2.786   6.259   8.216
  755   1HB   SER 107          2HB       SER 107   3.058   8.331   9.641
  756   2HB   SER 107          1HB       SER 107   3.174   9.268   8.154
  757    HG   SER 107           HG       SER 107   0.995   7.907   9.271
  758    H    THR 108           H        THR 108   2.732   5.375   6.101
  759    HA   THR 108           HA       THR 108   1.825   7.046   3.963
  760    HB   THR 108           HB       THR 108   4.059   7.935   3.941
  761    HG1  THR 108           HG1      THR 108   4.853   6.703   1.934
  762   1HG2  THR 108          1HG2      THR 108   5.038   5.067   3.851
  763   2HG2  THR 108          2HG2      THR 108   5.073   6.097   5.283
  764   3HG2  THR 108          3HG2      THR 108   6.045   6.515   3.872
  765    H    ASN 109           H        ASN 109   3.392   4.043   4.959
  766    HA   ASN 109           HA       ASN 109   1.975   2.641   2.713
  767   1HB   ASN 109          2HB       ASN 109   4.474   2.735   2.611
  768   2HB   ASN 109          1HB       ASN 109   4.534   1.882   4.154
  769   1HD2  ASN 109          1HD2      ASN 109   5.487   0.919   1.476
  770   2HD2  ASN 109          2HD2      ASN 109   4.632  -0.517   1.178
  771    HA   PRO 110           HA       PRO 110  -0.033   0.743   6.226
  772   1HB   PRO 110          2HB       PRO 110  -1.915  -0.604   4.777
  773   2HB   PRO 110          1HB       PRO 110  -2.028   1.132   5.128
  774   1HG   PRO 110          2HG       PRO 110  -1.234  -0.243   2.629
  775   2HG   PRO 110          1HG       PRO 110  -2.092   1.287   2.858
  776   1HD   PRO 110          2HD       PRO 110   0.591   1.039   2.212
  777   2HD   PRO 110          1HD       PRO 110  -0.167   2.485   2.910
  778    H    PHE 111           H        PHE 111   2.071  -0.599   4.082
  779    HA   PHE 111           HA       PHE 111   1.663  -3.355   5.204
  780   1HB   PHE 111          2HB       PHE 111   2.483  -2.462   2.424
  781   2HB   PHE 111          1HB       PHE 111   2.547  -4.138   2.965
  782    HD1  PHE 111           HD1      PHE 111   0.558  -1.753   1.333
  783    HD2  PHE 111           HD2      PHE 111   0.304  -4.968   4.170
  784    HE1  PHE 111           HE1      PHE 111  -1.852  -2.016   0.819
  785    HE2  PHE 111           HE2      PHE 111  -2.107  -5.231   3.657
  786    HZ   PHE 111           HZ       PHE 111  -3.180  -3.756   1.982
  787    H    LEU 112           HN       LEU 112   3.489  -0.909   5.835
  788    HA   LEU 112           HA       LEU 112   6.083  -2.413   5.700
  789   1HB   LEU 112          2HB       LEU 112   5.315   0.109   4.653
  790   2HB   LEU 112          1HB       LEU 112   6.382   0.441   6.019
  791    HG   LEU 112           HG       LEU 112   8.027  -1.188   5.073
  792   1HD1  LEU 112          1HD1      LEU 112   5.802  -1.866   3.443
  793   2HD1  LEU 112          2HD1      LEU 112   7.420  -2.567   3.402
  794   3HD1  LEU 112          3HD1      LEU 112   7.030  -1.189   2.374
  795   1HD2  LEU 112          1HD2      LEU 112   8.885   0.737   4.267
  796   2HD2  LEU 112          2HD2      LEU 112   7.274   1.406   4.009
  797   3HD2  LEU 112          3HD2      LEU 112   8.028   0.416   2.759
  Start of MODEL    2
    1    HA   PRO   6           HA       PRO   6   0.858   7.881 -22.689
    2   1HB   PRO   6          2HB       PRO   6   0.345   5.206 -22.962
    3   2HB   PRO   6          1HB       PRO   6   0.371   6.332 -24.335
    4   1HG   PRO   6          2HG       PRO   6   2.451   4.410 -23.424
    5   2HG   PRO   6          1HG       PRO   6   1.969   4.859 -25.067
    6   1HD   PRO   6          2HD       PRO   6   4.205   5.820 -23.825
    7   2HD   PRO   6          1HD       PRO   6   3.334   6.689 -25.106
    8    H    TRP   7           H        TRP   7  -0.407   6.632 -20.946
    9    HA   TRP   7           HA       TRP   7   1.360   6.203 -18.604
   10   1HB   TRP   7          2HB       TRP   7  -0.584   7.727 -18.514
   11   2HB   TRP   7          1HB       TRP   7  -1.652   6.396 -18.952
   12    HD1  TRP   7           HD1      TRP   7   1.097   5.370 -16.678
   13    HE1  TRP   7           HE1      TRP   7   0.197   5.031 -14.284
   14    HE3  TRP   7           HE3      TRP   7  -3.535   7.452 -17.180
   15    HZ2  TRP   7           HZ2      TRP   7  -2.178   5.575 -12.783
   16    HZ3  TRP   7           HZ3      TRP   7  -5.094   7.531 -15.256
   17    HH2  TRP   7           HH2      TRP   7  -4.423   6.597 -13.060
   18    H    ALA   8           H        ALA   8   1.820   4.152 -17.901
   19    HA   ALA   8           HA       ALA   8   1.347   1.767 -19.176
   20   1HB   ALA   8          1HB       ALA   8   1.652   2.583 -16.320
   21   2HB   ALA   8          2HB       ALA   8   2.765   1.673 -17.340
   22   3HB   ALA   8          3HB       ALA   8   1.331   0.887 -16.677
   23    H    VAL   9           H        VAL   9  -0.904   3.474 -17.062
   24    HA   VAL   9           HA       VAL   9  -2.888   1.283 -17.210
   25    HB   VAL   9           HB       VAL   9  -2.671   3.971 -15.842
   26   1HG1  VAL   9          1HG1      VAL   9  -5.007   3.725 -16.491
   27   2HG1  VAL   9          2HG1      VAL   9  -4.855   3.413 -14.761
   28   3HG1  VAL   9          3HG1      VAL   9  -5.032   2.067 -15.886
   29   1HG2  VAL   9          1HG2      VAL   9  -1.430   2.239 -14.742
   30   2HG2  VAL   9          2HG2      VAL   9  -2.742   1.079 -14.950
   31   3HG2  VAL   9          3HG2      VAL   9  -2.926   2.424 -13.825
   32    H    LYS  10           H        LYS  10  -4.664   1.339 -18.571
   33    HA   LYS  10           HA       LYS  10  -4.805   3.583 -20.520
   34   1HB   LYS  10          2HB       LYS  10  -5.298   0.715 -20.443
   35   2HB   LYS  10          1HB       LYS  10  -6.669   1.575 -21.141
   36   1HG   LYS  10          2HG       LYS  10  -5.432   2.382 -22.929
   37   2HG   LYS  10          1HG       LYS  10  -3.916   2.348 -22.027
   38   1HD   LYS  10          2HD       LYS  10  -4.219  -0.231 -22.035
   39   2HD   LYS  10          1HD       LYS  10  -5.374   0.059 -23.337
   40   1HE   LYS  10          2HE       LYS  10  -3.498  -0.077 -24.662
   41   2HE   LYS  10          1HE       LYS  10  -3.267   1.610 -24.159
   42   1HZ   LYS  10          1HZ       LYS  10  -2.228  -0.783 -22.732
   43   2HZ   LYS  10          2HZ       LYS  10  -2.031   0.829 -22.231
   44   3HZ   LYS  10          3HZ       LYS  10  -1.298   0.285 -23.665
   45    HA   PRO  11           HA       PRO  11  -8.615   5.202 -19.066
   46   1HB   PRO  11          2HB       PRO  11 -10.356   5.056 -21.180
   47   2HB   PRO  11          1HB       PRO  11  -9.013   6.215 -21.107
   48   1HG   PRO  11          2HG       PRO  11  -9.187   3.609 -22.544
   49   2HG   PRO  11          1HG       PRO  11  -8.479   5.143 -23.073
   50   1HD   PRO  11          2HD       PRO  11  -6.980   3.083 -22.165
   51   2HD   PRO  11          1HD       PRO  11  -6.511   4.782 -21.938
   52    H    GLU  12           H        GLU  12  -9.043   2.124 -20.794
   53    HA   GLU  12           HA       GLU  12 -11.567   1.466 -19.504
   54   1HB   GLU  12          2HB       GLU  12 -11.008  -0.789 -20.521
   55   2HB   GLU  12          1HB       GLU  12 -10.975   0.551 -21.667
   56   1HG   GLU  12          2HG       GLU  12  -8.648   0.561 -21.799
   57   2HG   GLU  12          1HG       GLU  12  -8.455  -0.203 -20.220
   58    H    ASP  13           H        ASP  13  -8.162   0.969 -18.771
   59    HA   ASP  13           HA       ASP  13  -8.675  -0.991 -16.645
   60   1HB   ASP  13          2HB       ASP  13  -6.353   0.457 -17.876
   61   2HB   ASP  13          1HB       ASP  13  -6.134  -0.265 -16.283
   62    H    LYS  14           H        LYS  14  -8.008   2.464 -16.970
   63    HA   LYS  14           HA       LYS  14  -7.814   2.967 -14.111
   64   1HB   LYS  14          2HB       LYS  14  -7.105   4.283 -16.373
   65   2HB   LYS  14          1HB       LYS  14  -8.629   5.097 -16.017
   66   1HG   LYS  14          2HG       LYS  14  -7.211   4.830 -13.560
   67   2HG   LYS  14          1HG       LYS  14  -6.085   5.475 -14.756
   68   1HD   LYS  14          2HD       LYS  14  -7.314   7.407 -15.077
   69   2HD   LYS  14          1HD       LYS  14  -8.842   6.630 -14.661
   70   1HE   LYS  14          2HE       LYS  14  -7.488   6.422 -12.284
   71   2HE   LYS  14          1HE       LYS  14  -6.892   7.976 -12.898
   72   1HZ   LYS  14          1HZ       LYS  14  -9.592   7.198 -12.150
   73   2HZ   LYS  14          2HZ       LYS  14  -9.461   8.130 -13.565
   74   3HZ   LYS  14          3HZ       LYS  14  -8.851   8.723 -12.096
   75    H    ALA  15           H        ALA  15 -10.358   2.423 -16.335
   76    HA   ALA  15           HA       ALA  15 -12.419   3.979 -14.969
   77   1HB   ALA  15          1HB       ALA  15 -12.039   2.456 -17.376
   78   2HB   ALA  15          2HB       ALA  15 -13.354   3.563 -16.987
   79   3HB   ALA  15          3HB       ALA  15 -13.481   1.858 -16.556
   80    H    LYS  16           H        LYS  16 -11.364   0.577 -15.057
   81    HA   LYS  16           HA       LYS  16 -13.427  -0.319 -13.208
   82   1HB   LYS  16          2HB       LYS  16 -12.517  -2.395 -13.668
   83   2HB   LYS  16          1HB       LYS  16 -11.882  -1.504 -15.048
   84   1HG   LYS  16          2HG       LYS  16  -9.785  -1.100 -13.842
   85   2HG   LYS  16          1HG       LYS  16 -10.419  -1.965 -12.441
   86   1HD   LYS  16          2HD       LYS  16  -8.920  -3.334 -14.001
   87   2HD   LYS  16          1HD       LYS  16 -10.492  -4.039 -13.632
   88   1HE   LYS  16          2HE       LYS  16 -11.398  -3.195 -15.760
   89   2HE   LYS  16          1HE       LYS  16  -9.838  -2.436 -16.131
   90   1HZ   LYS  16          1HZ       LYS  16  -8.765  -4.557 -16.041
   91   2HZ   LYS  16          2HZ       LYS  16 -10.083  -4.686 -17.106
   92   3HZ   LYS  16          3HZ       LYS  16 -10.190  -5.324 -15.535
   93    H    TYR  17           H        TYR  17 -10.319   1.177 -12.995
   94    HA   TYR  17           HA       TYR  17  -9.706   0.416 -10.245
   95   1HB   TYR  17          2HB       TYR  17  -8.785   2.656 -12.087
   96   2HB   TYR  17          1HB       TYR  17  -8.038   2.281 -10.537
   97    HD1  TYR  17           HD1      TYR  17  -9.155  -0.769 -11.793
   98    HD2  TYR  17           HD2      TYR  17  -6.098   2.177 -12.450
   99    HE1  TYR  17           HE1      TYR  17  -7.738  -2.478 -12.894
  100    HE2  TYR  17           HE2      TYR  17  -4.676   0.464 -13.547
  101    HH   TYR  17           HH       TYR  17  -4.946  -1.680 -14.690
  102    H    ASP  18           H        ASP  18 -11.353   3.053 -11.912
  103    HA   ASP  18           HA       ASP  18 -11.675   4.763  -9.582
  104   1HB   ASP  18          2HB       ASP  18 -12.174   4.758 -12.397
  105   2HB   ASP  18          1HB       ASP  18 -13.689   5.158 -11.588
  106    H    ALA  19           H        ALA  19 -13.150   1.851 -10.560
  107    HA   ALA  19           HA       ALA  19 -15.733   2.415  -9.204
  108   1HB   ALA  19          1HB       ALA  19 -16.304   0.962 -10.865
  109   2HB   ALA  19          2HB       ALA  19 -15.538  -0.296  -9.893
  110   3HB   ALA  19          3HB       ALA  19 -14.618   0.532 -11.150
  111    H    ILE  20           H        ILE  20 -12.683   0.810  -8.825
  112    HA   ILE  20           HA       ILE  20 -13.407  -0.582  -6.338
  113    HB   ILE  20           HB       ILE  20 -10.959  -0.159  -8.067
  114   1HG1  ILE  20          2HG1      ILE  20 -12.257  -2.754  -7.231
  115   2HG1  ILE  20          1HG1      ILE  20 -12.854  -1.829  -8.609
  116   1HG2  ILE  20          1HG2      ILE  20  -9.677  -1.525  -6.557
  117   2HG2  ILE  20          2HG2      ILE  20 -11.080  -1.773  -5.517
  118   3HG2  ILE  20          3HG2      ILE  20 -10.346  -0.174  -5.644
  119   1HD1  ILE  20          1HD1      ILE  20 -10.615  -1.906  -9.645
  120   2HD1  ILE  20          2HD1      ILE  20 -11.216  -3.536  -9.329
  121   3HD1  ILE  20          3HD1      ILE  20 -10.007  -2.819  -8.264
  122    H    PHE  21           H        PHE  21 -11.730   2.300  -7.472
  123    HA   PHE  21           HA       PHE  21 -10.644   3.116  -4.908
  124   1HB   PHE  21          2HB       PHE  21  -9.502   4.119  -6.633
  125   2HB   PHE  21          1HB       PHE  21 -10.896   4.070  -7.704
  126    HD1  PHE  21           HD1      PHE  21  -8.825   6.154  -5.694
  127    HD2  PHE  21           HD2      PHE  21 -12.849   5.731  -7.139
  128    HE1  PHE  21           HE1      PHE  21  -9.229   8.567  -5.277
  129    HE2  PHE  21           HE2      PHE  21 -13.252   8.138  -6.718
  130    HZ   PHE  21           HZ       PHE  21 -11.447   9.555  -5.787
  131    H    ASP  22           H        ASP  22 -13.612   3.679  -6.711
  132    HA   ASP  22           HA       ASP  22 -14.622   5.638  -4.751
  133   1HB   ASP  22          2HB       ASP  22 -15.126   6.099  -7.025
  134   2HB   ASP  22          1HB       ASP  22 -15.574   4.422  -7.346
  135    H    SER  23           H        SER  23 -14.474   2.281  -5.002
  136    HA   SER  23           HA       SER  23 -17.109   1.685  -3.832
  137   1HB   SER  23          2HB       SER  23 -16.528  -0.285  -4.796
  138   2HB   SER  23          1HB       SER  23 -14.911   0.329  -5.119
  139    HG   SER  23           HG       SER  23 -15.858  -0.859  -2.717
  140    H    LEU  24           H        LEU  24 -14.158   2.869  -2.755
  141    HA   LEU  24           HA       LEU  24 -14.422   1.749  -0.002
  142   1HB   LEU  24          2HB       LEU  24 -12.198   3.503  -1.023
  143   2HB   LEU  24          1HB       LEU  24 -12.126   2.213   0.174
  144    HG   LEU  24           HG       LEU  24 -12.740   1.670  -2.731
  145   1HD1  LEU  24          1HD1      LEU  24 -10.101   0.859  -2.101
  146   2HD1  LEU  24          2HD1      LEU  24 -10.248   2.534  -1.573
  147   3HD1  LEU  24          3HD1      LEU  24 -10.593   2.101  -3.249
  148   1HD2  LEU  24          1HD2      LEU  24 -13.220  -0.004  -0.844
  149   2HD2  LEU  24          2HD2      LEU  24 -11.471  -0.099  -0.638
  150   3HD2  LEU  24          3HD2      LEU  24 -12.206  -0.586  -2.165
  151    H    SER  25           H        SER  25 -14.965   4.507  -1.937
  152    HA   SER  25           HA       SER  25 -16.111   6.521  -1.332
  153   1HB   SER  25          2HB       SER  25 -15.344   6.036   1.538
  154   2HB   SER  25          1HB       SER  25 -16.761   6.863   0.898
  155    HG   SER  25           HG       SER  25 -17.583   4.940   1.364
  156    HA   PRO  26           HA       PRO  26 -11.936   8.289  -1.299
  157   1HB   PRO  26          2HB       PRO  26 -12.343   9.865  -3.481
  158   2HB   PRO  26          1HB       PRO  26 -11.894   8.153  -3.602
  159   1HG   PRO  26          2HG       PRO  26 -14.516   9.450  -4.021
  160   2HG   PRO  26          1HG       PRO  26 -13.832   8.008  -4.780
  161   1HD   PRO  26          2HD       PRO  26 -15.726   8.031  -2.738
  162   2HD   PRO  26          1HD       PRO  26 -14.741   6.639  -3.227
  163    H    VAL  27           H        VAL  27 -11.257  10.470  -0.872
  164    HA   VAL  27           HA       VAL  27 -13.466  12.350  -0.113
  165    HB   VAL  27           HB       VAL  27 -10.805  11.890   1.275
  166   1HG1  VAL  27          1HG1      VAL  27 -11.561  13.380   2.922
  167   2HG1  VAL  27          2HG1      VAL  27 -13.249  13.209   2.438
  168   3HG1  VAL  27          3HG1      VAL  27 -12.132  14.135   1.434
  169   1HG2  VAL  27          1HG2      VAL  27 -12.524   9.958   1.301
  170   2HG2  VAL  27          2HG2      VAL  27 -13.522  11.031   2.283
  171   3HG2  VAL  27          3HG2      VAL  27 -11.933  10.531   2.861
  172    H    ASN  28           H        ASN  28 -13.301  13.944  -1.670
  173    HA   ASN  28           HA       ASN  28 -12.321  15.709  -2.902
  174   1HB   ASN  28          2HB       ASN  28 -11.219  15.967  -0.588
  175   2HB   ASN  28          1HB       ASN  28  -9.829  15.133  -1.283
  176   1HD2  ASN  28          1HD2      ASN  28  -9.146  16.149  -3.541
  177   2HD2  ASN  28          2HD2      ASN  28  -9.114  17.845  -3.592
  178    H    GLY  29           H        GLY  29 -11.826  12.619  -3.280
  179   1HA   GLY  29          2HA       GLY  29 -11.065  11.566  -5.295
  180   2HA   GLY  29          1HA       GLY  29 -10.037  12.964  -5.612
  181    H    PHE  30           H        PHE  30 -10.199  11.173  -2.551
  182    HA   PHE  30           HA       PHE  30  -7.485  10.053  -3.109
  183   1HB   PHE  30          2HB       PHE  30  -8.368  11.843  -0.842
  184   2HB   PHE  30          1HB       PHE  30  -6.893  10.870  -0.757
  185    HD1  PHE  30           HD1      PHE  30  -8.471  13.831  -2.137
  186    HD2  PHE  30           HD2      PHE  30  -5.105  11.190  -2.487
  187    HE1  PHE  30           HE1      PHE  30  -7.284  15.533  -3.478
  188    HE2  PHE  30           HE2      PHE  30  -3.903  12.903  -3.827
  189    HZ   PHE  30           HZ       PHE  30  -4.993  15.078  -4.324
  190    H    LEU  31           H        LEU  31  -7.020   8.163  -2.006
  191    HA   LEU  31           HA       LEU  31  -9.198   7.041  -0.270
  192   1HB   LEU  31          2HB       LEU  31  -7.359   5.801  -2.326
  193   2HB   LEU  31          1HB       LEU  31  -8.105   4.817  -1.068
  194    HG   LEU  31           HG       LEU  31  -9.456   6.373  -3.264
  195   1HD1  LEU  31          1HD1      LEU  31  -9.221   4.247  -4.079
  196   2HD1  LEU  31          2HD1      LEU  31 -10.628   3.934  -3.063
  197   3HD1  LEU  31          3HD1      LEU  31  -9.010   3.556  -2.466
  198   1HD2  LEU  31          1HD2      LEU  31 -10.728   6.928  -1.293
  199   2HD2  LEU  31          2HD2      LEU  31 -10.633   5.272  -0.698
  200   3HD2  LEU  31          3HD2      LEU  31 -11.602   5.643  -2.125
  201    H    SER  32           H        SER  32  -8.495   6.385   1.738
  202    HA   SER  32           HA       SER  32  -5.706   7.013   2.438
  203   1HB   SER  32          2HB       SER  32  -6.936   6.000   4.680
  204   2HB   SER  32          1HB       SER  32  -6.990   7.693   4.196
  205    HG   SER  32           HG       SER  32  -8.953   5.807   4.203
  206    H    GLY  33           H        GLY  33  -4.177   5.492   3.124
  207   1HA   GLY  33          2HA       GLY  33  -4.034   2.969   1.985
  208   2HA   GLY  33          1HA       GLY  33  -3.274   3.333   3.536
  209    H    ASP  34           H        ASP  34  -5.966   3.959   4.697
  210    HA   ASP  34           HA       ASP  34  -6.577   1.376   5.804
  211   1HB   ASP  34          2HB       ASP  34  -6.909   3.662   6.828
  212   2HB   ASP  34          1HB       ASP  34  -8.272   3.892   5.732
  213    H    LYS  35           H        LYS  35  -7.664   3.025   2.922
  214    HA   LYS  35           HA       LYS  35  -9.995   1.195   2.638
  215   1HB   LYS  35          2HB       LYS  35  -9.011   3.627   1.100
  216   2HB   LYS  35          1HB       LYS  35 -10.510   2.768   0.762
  217   1HG   LYS  35          2HG       LYS  35 -10.852   3.201   3.400
  218   2HG   LYS  35          1HG       LYS  35  -9.843   4.595   3.010
  219   1HD   LYS  35          2HD       LYS  35 -11.490   4.886   0.993
  220   2HD   LYS  35          1HD       LYS  35 -12.568   3.881   1.962
  221   1HE   LYS  35          2HE       LYS  35 -13.106   6.110   2.610
  222   2HE   LYS  35          1HE       LYS  35 -12.020   5.545   3.896
  223   1HZ   LYS  35          1HZ       LYS  35 -11.353   7.718   2.955
  224   2HZ   LYS  35          2HZ       LYS  35 -11.125   6.970   1.446
  225   3HZ   LYS  35          3HZ       LYS  35 -10.160   6.525   2.772
  226    H    VAL  36           H        VAL  36  -6.925   2.165   1.207
  227    HA   VAL  36           HA       VAL  36  -7.085   0.360  -1.076
  228    HB   VAL  36           HB       VAL  36  -4.815   1.814   0.303
  229   1HG1  VAL  36          1HG1      VAL  36  -3.412   1.169  -1.391
  230   2HG1  VAL  36          2HG1      VAL  36  -4.712   1.079  -2.577
  231   3HG1  VAL  36          3HG1      VAL  36  -4.484  -0.229  -1.414
  232   1HG2  VAL  36          1HG2      VAL  36  -5.907   2.712  -2.305
  233   2HG2  VAL  36          2HG2      VAL  36  -5.379   3.664  -0.917
  234   3HG2  VAL  36          3HG2      VAL  36  -6.976   2.918  -0.916
  235    H    LYS  37           H        LYS  37  -5.330   0.325   2.038
  236    HA   LYS  37           HA       LYS  37  -3.782  -1.920   1.916
  237   1HB   LYS  37          2HB       LYS  37  -3.872  -0.717   3.942
  238   2HB   LYS  37          1HB       LYS  37  -5.626  -0.848   4.049
  239   1HG   LYS  37          2HG       LYS  37  -5.454  -3.246   4.506
  240   2HG   LYS  37          1HG       LYS  37  -3.705  -3.183   4.301
  241   1HD   LYS  37          2HD       LYS  37  -3.362  -2.161   6.333
  242   2HD   LYS  37          1HD       LYS  37  -4.901  -1.300   6.278
  243   1HE   LYS  37          2HE       LYS  37  -5.951  -2.943   7.443
  244   2HE   LYS  37          1HE       LYS  37  -5.268  -4.206   6.398
  245   1HZ   LYS  37          1HZ       LYS  37  -3.079  -3.633   7.580
  246   2HZ   LYS  37          2HZ       LYS  37  -4.216  -4.574   8.421
  247   3HZ   LYS  37          3HZ       LYS  37  -4.058  -2.918   8.766
  248    HA   PRO  38           HA       PRO  38  -7.471  -4.895   2.730
  249   1HB   PRO  38          2HB       PRO  38  -9.992  -3.892   2.305
  250   2HB   PRO  38          1HB       PRO  38  -9.196  -3.875   3.892
  251   1HG   PRO  38          2HG       PRO  38  -9.447  -1.688   1.880
  252   2HG   PRO  38          1HG       PRO  38  -9.609  -1.621   3.644
  253   1HD   PRO  38          2HD       PRO  38  -7.373  -0.812   2.374
  254   2HD   PRO  38          1HD       PRO  38  -7.330  -1.561   3.986
  255    H    VAL  39           H        VAL  39  -7.975  -2.361   0.312
  256    HA   VAL  39           HA       VAL  39  -9.136  -3.943  -1.762
  257    HB   VAL  39           HB       VAL  39  -7.558  -1.401  -1.486
  258   1HG1  VAL  39          1HG1      VAL  39  -8.588  -1.902  -4.198
  259   2HG1  VAL  39          2HG1      VAL  39  -7.188  -2.880  -3.780
  260   3HG1  VAL  39          3HG1      VAL  39  -7.092  -1.126  -3.687
  261   1HG2  VAL  39          1HG2      VAL  39 -10.321  -2.264  -1.788
  262   2HG2  VAL  39          2HG2      VAL  39  -9.898  -1.010  -2.954
  263   3HG2  VAL  39          3HG2      VAL  39  -9.688  -0.719  -1.227
  264    H    LEU  40           H        LEU  40  -5.797  -3.414  -0.723
  265    HA   LEU  40           HA       LEU  40  -4.680  -4.976  -2.963
  266   1HB   LEU  40          2HB       LEU  40  -3.400  -3.880  -0.438
  267   2HB   LEU  40          1HB       LEU  40  -2.575  -4.335  -1.930
  268    HG   LEU  40           HG       LEU  40  -4.646  -2.141  -1.702
  269   1HD1  LEU  40          1HD1      LEU  40  -1.623  -2.096  -1.827
  270   2HD1  LEU  40          2HD1      LEU  40  -2.660  -1.398  -0.581
  271   3HD1  LEU  40          3HD1      LEU  40  -2.615  -0.685  -2.195
  272   1HD2  LEU  40          1HD2      LEU  40  -4.464  -3.364  -3.900
  273   2HD2  LEU  40          2HD2      LEU  40  -2.780  -2.844  -3.983
  274   3HD2  LEU  40          3HD2      LEU  40  -4.074  -1.646  -3.998
  275    H    LEU  41           H        LEU  41  -5.627  -5.415   0.376
  276    HA   LEU  41           HA       LEU  41  -4.187  -7.909   0.800
  277   1HB   LEU  41          2HB       LEU  41  -6.420  -6.383   2.141
  278   2HB   LEU  41          1HB       LEU  41  -5.912  -7.965   2.730
  279    HG   LEU  41           HG       LEU  41  -3.948  -5.718   2.278
  280   1HD1  LEU  41          1HD1      LEU  41  -5.112  -6.456   4.961
  281   2HD1  LEU  41          2HD1      LEU  41  -5.868  -5.221   3.953
  282   3HD1  LEU  41          3HD1      LEU  41  -4.208  -5.008   4.516
  283   1HD2  LEU  41          1HD2      LEU  41  -2.426  -7.215   3.032
  284   2HD2  LEU  41          2HD2      LEU  41  -3.675  -8.446   2.825
  285   3HD2  LEU  41          3HD2      LEU  41  -3.453  -7.670   4.393
  286    H    ASN  42           H        ASN  42  -7.070  -6.945  -0.810
  287    HA   ASN  42           HA       ASN  42  -8.380  -9.563  -0.591
  288   1HB   ASN  42          2HB       ASN  42  -9.033  -6.858  -1.274
  289   2HB   ASN  42          1HB       ASN  42  -9.490  -7.894  -2.628
  290   1HD2  ASN  42          1HD2      ASN  42 -10.949  -6.548  -0.095
  291   2HD2  ASN  42          2HD2      ASN  42 -11.990  -7.796   0.394
  292    H    SER  43           H        SER  43  -5.881  -8.265  -2.434
  293    HA   SER  43           HA       SER  43  -6.489  -9.613  -4.971
  294   1HB   SER  43          2HB       SER  43  -4.642  -8.422  -5.713
  295   2HB   SER  43          1HB       SER  43  -5.092  -7.439  -4.322
  296    HG   SER  43           HG       SER  43  -3.568  -8.593  -3.101
  297    H    LYS  44           H        LYS  44  -5.858 -10.939  -2.113
  298    HA   LYS  44           HA       LYS  44  -4.963 -13.027  -1.465
  299   1HB   LYS  44          2HB       LYS  44  -5.984 -13.492  -3.795
  300   2HB   LYS  44          1HB       LYS  44  -4.329 -13.397  -4.398
  301   1HG   LYS  44          2HG       LYS  44  -3.757 -15.405  -3.497
  302   2HG   LYS  44          1HG       LYS  44  -4.641 -15.088  -2.004
  303   1HD   LYS  44          2HD       LYS  44  -6.724 -15.738  -2.992
  304   2HD   LYS  44          1HD       LYS  44  -6.022 -15.761  -4.611
  305   1HE   LYS  44          2HE       LYS  44  -6.047 -18.052  -4.015
  306   2HE   LYS  44          1HE       LYS  44  -4.395 -17.560  -3.591
  307   1HZ   LYS  44          1HZ       LYS  44  -6.671 -18.110  -1.846
  308   2HZ   LYS  44          2HZ       LYS  44  -5.652 -16.828  -1.393
  309   3HZ   LYS  44          3HZ       LYS  44  -5.020 -18.393  -1.588
  310    H    LEU  45           H        LEU  45  -3.252 -10.473  -2.257
  311    HA   LEU  45           HA       LEU  45  -0.601 -11.808  -2.567
  312   1HB   LEU  45          2HB       LEU  45  -1.756  -9.067  -2.965
  313   2HB   LEU  45          1HB       LEU  45  -0.014  -9.251  -2.764
  314    HG   LEU  45           HG       LEU  45  -1.650 -10.812  -4.772
  315   1HD1  LEU  45          1HD1      LEU  45  -0.981  -9.274  -6.436
  316   2HD1  LEU  45          2HD1      LEU  45   0.231  -8.536  -5.391
  317   3HD1  LEU  45          3HD1      LEU  45  -1.483  -8.253  -5.091
  318   1HD2  LEU  45          1HD2      LEU  45   0.774 -11.434  -3.716
  319   2HD2  LEU  45          2HD2      LEU  45   1.278 -10.377  -5.037
  320   3HD2  LEU  45          3HD2      LEU  45   0.319 -11.819  -5.378
  321    HA   PRO  46           HA       PRO  46   0.384 -11.068   1.632
  322   1HB   PRO  46          2HB       PRO  46   3.113 -11.001   1.440
  323   2HB   PRO  46          1HB       PRO  46   2.170 -12.496   1.311
  324   1HG   PRO  46          2HG       PRO  46   3.446 -10.880  -0.806
  325   2HG   PRO  46          1HG       PRO  46   3.201 -12.626  -0.707
  326   1HD   PRO  46          2HD       PRO  46   1.668 -10.895  -2.221
  327   2HD   PRO  46          1HD       PRO  46   1.168 -12.517  -1.709
  328    H    VAL  47           H        VAL  47   1.679  -9.435   2.989
  329    HA   VAL  47           HA       VAL  47   1.105  -6.746   2.167
  330    HB   VAL  47           HB       VAL  47   2.442  -8.204   4.432
  331   1HG1  VAL  47          1HG1      VAL  47   3.130  -6.258   5.547
  332   2HG1  VAL  47          2HG1      VAL  47   2.194  -5.206   4.492
  333   3HG1  VAL  47          3HG1      VAL  47   3.669  -5.967   3.897
  334   1HG2  VAL  47          1HG2      VAL  47   0.238  -8.158   4.963
  335   2HG2  VAL  47          2HG2      VAL  47  -0.097  -6.834   3.846
  336   3HG2  VAL  47          3HG2      VAL  47   0.559  -6.493   5.447
  337    H    ASP  48           H        ASP  48   3.617  -8.846   1.337
  338    HA   ASP  48           HA       ASP  48   5.776  -6.896   1.253
  339   1HB   ASP  48          2HB       ASP  48   5.279  -9.720   0.362
  340   2HB   ASP  48          1HB       ASP  48   6.710  -8.866  -0.212
  341    H    ILE  49           H        ILE  49   3.303  -8.136  -0.920
  342    HA   ILE  49           HA       ILE  49   4.431  -6.801  -3.279
  343    HB   ILE  49           HB       ILE  49   1.630  -7.876  -2.920
  344   1HG1  ILE  49          2HG1      ILE  49   3.089  -9.594  -2.032
  345   2HG1  ILE  49          1HG1      ILE  49   2.570 -10.086  -3.643
  346   1HG2  ILE  49          1HG2      ILE  49   1.980  -6.817  -5.032
  347   2HG2  ILE  49          2HG2      ILE  49   2.095  -8.551  -5.334
  348   3HG2  ILE  49          3HG2      ILE  49   3.560  -7.577  -5.227
  349   1HD1  ILE  49          1HD1      ILE  49   4.965 -10.466  -3.407
  350   2HD1  ILE  49          2HD1      ILE  49   5.209  -8.782  -2.934
  351   3HD1  ILE  49          3HD1      ILE  49   4.684  -9.174  -4.575
  352    H    LEU  50           H        LEU  50   1.800  -6.362  -0.972
  353    HA   LEU  50           HA       LEU  50   0.678  -3.988  -2.178
  354   1HB   LEU  50          2HB       LEU  50   0.632  -4.848   0.720
  355   2HB   LEU  50          1HB       LEU  50  -0.599  -3.935  -0.151
  356    HG   LEU  50           HG       LEU  50   0.115  -6.852  -0.453
  357   1HD1  LEU  50          1HD1      LEU  50  -1.512  -6.477   1.248
  358   2HD1  LEU  50          2HD1      LEU  50  -2.411  -7.017  -0.171
  359   3HD1  LEU  50          3HD1      LEU  50  -2.381  -5.306   0.254
  360   1HD2  LEU  50          1HD2      LEU  50  -0.275  -6.601  -2.672
  361   2HD2  LEU  50          2HD2      LEU  50  -0.904  -4.968  -2.455
  362   3HD2  LEU  50          3HD2      LEU  50  -1.961  -6.360  -2.212
  363    H    GLY  51           H        GLY  51   3.301  -4.651   0.069
  364   1HA   GLY  51          2HA       GLY  51   3.574  -1.912   1.011
  365   2HA   GLY  51          1HA       GLY  51   4.791  -3.185   1.174
  366    H    ARG  52           H        ARG  52   4.532  -3.729  -1.756
  367    HA   ARG  52           HA       ARG  52   6.391  -1.598  -2.672
  368   1HB   ARG  52          2HB       ARG  52   6.435  -4.355  -2.688
  369   2HB   ARG  52          1HB       ARG  52   5.927  -3.970  -4.331
  370   1HG   ARG  52          2HG       ARG  52   7.878  -2.219  -4.233
  371   2HG   ARG  52          1HG       ARG  52   8.476  -3.242  -2.925
  372   1HD   ARG  52          2HD       ARG  52   7.605  -4.555  -5.476
  373   2HD   ARG  52          1HD       ARG  52   9.187  -3.764  -5.415
  374    HE   ARG  52           HE       ARG  52   8.415  -5.708  -3.286
  375   1HH1  ARG  52          1HH2      ARG  52   9.665  -6.280  -6.192
  376   2HH1  ARG  52          2HH2      ARG  52  11.277  -6.676  -5.693
  377   1HH2  ARG  52          2HH1      ARG  52  10.853  -5.493  -2.463
  378   2HH2  ARG  52          1HH1      ARG  52  11.948  -6.230  -3.585
  379    H    VAL  53           H        VAL  53   3.297  -3.169  -3.432
  380    HA   VAL  53           HA       VAL  53   3.001  -1.871  -6.024
  381    HB   VAL  53           HB       VAL  53   1.273  -3.365  -4.057
  382   1HG1  VAL  53          1HG1      VAL  53   0.102  -1.357  -5.449
  383   2HG1  VAL  53          2HG1      VAL  53  -0.705  -2.878  -5.104
  384   3HG1  VAL  53          3HG1      VAL  53   0.061  -2.626  -6.670
  385   1HG2  VAL  53          1HG2      VAL  53   1.235  -5.027  -5.762
  386   2HG2  VAL  53          2HG2      VAL  53   2.897  -4.431  -5.733
  387   3HG2  VAL  53          3HG2      VAL  53   1.783  -3.885  -6.993
  388    H    TRP  54           H        TRP  54   2.072  -1.155  -2.696
  389    HA   TRP  54           HA       TRP  54   0.435   1.140  -3.293
  390   1HB   TRP  54          2HB       TRP  54   0.154   0.164  -1.165
  391   2HB   TRP  54          1HB       TRP  54   1.895   0.028  -0.899
  392    HD1  TRP  54           HD1      TRP  54   3.237   2.378  -0.567
  393    HE1  TRP  54           HE1      TRP  54   2.485   4.565   0.528
  394    HE3  TRP  54           HE3      TRP  54  -1.806   1.649  -0.584
  395    HZ2  TRP  54           HZ2      TRP  54   0.036   5.846   1.336
  396    HZ3  TRP  54           HZ3      TRP  54  -3.337   3.364   0.365
  397    HH2  TRP  54           HH2      TRP  54  -2.418   5.453   1.318
  398    H    GLU  55           H        GLU  55   3.860   0.837  -2.200
  399    HA   GLU  55           HA       GLU  55   4.496   3.568  -2.096
  400   1HB   GLU  55          2HB       GLU  55   6.026   1.089  -2.830
  401   2HB   GLU  55          1HB       GLU  55   6.815   2.663  -2.760
  402   1HG   GLU  55          2HG       GLU  55   5.637   2.831  -0.421
  403   2HG   GLU  55          1HG       GLU  55   5.581   1.074  -0.549
  404    H    LEU  56           H        LEU  56   5.038   1.431  -4.912
  405    HA   LEU  56           HA       LEU  56   5.723   3.540  -6.717
  406   1HB   LEU  56          2HB       LEU  56   4.438   0.828  -7.193
  407   2HB   LEU  56          1HB       LEU  56   5.243   1.798  -8.427
  408    HG   LEU  56           HG       LEU  56   6.856   1.365  -5.998
  409   1HD1  LEU  56          1HD1      LEU  56   5.411  -0.828  -6.760
  410   2HD1  LEU  56          2HD1      LEU  56   6.994  -0.903  -5.987
  411   3HD1  LEU  56          3HD1      LEU  56   6.861  -1.012  -7.743
  412   1HD2  LEU  56          1HD2      LEU  56   7.795   0.480  -8.666
  413   2HD2  LEU  56          2HD2      LEU  56   8.573   1.559  -7.507
  414   3HD2  LEU  56          3HD2      LEU  56   7.312   2.172  -8.577
  415    H    SER  57           H        SER  57   2.751   2.642  -5.276
  416    HA   SER  57           HA       SER  57   1.053   3.857  -7.383
  417   1HB   SER  57          2HB       SER  57   0.619   2.400  -4.773
  418   2HB   SER  57          1HB       SER  57  -0.708   3.195  -5.611
  419    HG   SER  57           HG       SER  57   0.432   0.832  -6.119
  420    H    ASP  58           H        ASP  58   2.125   4.428  -4.036
  421    HA   ASP  58           HA       ASP  58   0.555   6.814  -3.598
  422   1HB   ASP  58          2HB       ASP  58   1.926   5.109  -2.049
  423   2HB   ASP  58          1HB       ASP  58   3.166   6.352  -2.230
  424    H    ILE  59           H        ILE  59   1.004   8.046  -5.588
  425    HA   ILE  59           HA       ILE  59   3.594   8.817  -6.477
  426    HB   ILE  59           HB       ILE  59   0.917  10.234  -6.613
  427   1HG1  ILE  59          2HG1      ILE  59   1.019   7.844  -7.453
  428   2HG1  ILE  59          1HG1      ILE  59   0.576   9.033  -8.676
  429   1HG2  ILE  59          1HG2      ILE  59   3.069  11.536  -7.188
  430   2HG2  ILE  59          2HG2      ILE  59   1.787  11.511  -8.400
  431   3HG2  ILE  59          3HG2      ILE  59   3.193  10.461  -8.582
  432   1HD1  ILE  59          1HD1      ILE  59   2.972   9.105  -9.398
  433   2HD1  ILE  59          2HD1      ILE  59   2.229   7.519  -9.619
  434   3HD1  ILE  59          3HD1      ILE  59   3.315   7.805  -8.258
  435    H    ASP  60           H        ASP  60   1.577  10.083  -3.864
  436    HA   ASP  60           HA       ASP  60   3.535  12.311  -3.478
  437   1HB   ASP  60          2HB       ASP  60   1.702  13.365  -2.225
  438   2HB   ASP  60          1HB       ASP  60   1.142  12.867  -3.819
  439    H    HIS  61           H        HIS  61   2.557   9.307  -2.166
  440    HA   HIS  61           HA       HIS  61   3.295   8.168  -0.221
  441   1HB   HIS  61          2HB       HIS  61   5.132  10.494   0.301
  442   2HB   HIS  61          1HB       HIS  61   5.437   8.774   0.526
  443    HD1  HIS  61           HD1      HIS  61   6.702  11.261  -1.479
  444    HD2  HIS  61           HD2      HIS  61   4.975   7.592  -2.432
  445    HE1  HIS  61           HE1      HIS  61   7.503  10.677  -3.809
  446    H    ASP  62           H        ASP  62   0.977   9.818   0.081
  447    HA   ASP  62           HA       ASP  62   1.424  11.081   2.764
  448   1HB   ASP  62          2HB       ASP  62  -0.466  12.471   2.200
  449   2HB   ASP  62          1HB       ASP  62   0.584  12.436   0.783
  450    H    GLY  63           H        GLY  63   0.982   8.164   2.166
  451   1HA   GLY  63          2HA       GLY  63  -0.277   6.402   3.072
  452   2HA   GLY  63          1HA       GLY  63  -0.866   7.571   4.254
  453    H    MET  64           H        MET  64  -1.272   7.903   0.761
  454    HA   MET  64           HA       MET  64  -4.127   7.104   0.962
  455   1HB   MET  64          2HB       MET  64  -3.066   9.869   0.381
  456   2HB   MET  64          1HB       MET  64  -4.694   9.373  -0.064
  457   1HG   MET  64          2HG       MET  64  -5.279   8.963   2.217
  458   2HG   MET  64          1HG       MET  64  -3.604   9.168   2.742
  459   1HE   MET  64          1HE       MET  64  -6.332  10.601   3.794
  460   2HE   MET  64          2HE       MET  64  -6.957  10.661   2.148
  461   3HE   MET  64          3HE       MET  64  -6.713  12.158   3.045
  462    H    LEU  65           H        LEU  65  -5.159   7.015  -1.190
  463    HA   LEU  65           HA       LEU  65  -3.213   6.957  -3.470
  464   1HB   LEU  65          2HB       LEU  65  -5.256   4.965  -2.498
  465   2HB   LEU  65          1HB       LEU  65  -4.843   5.014  -4.209
  466    HG   LEU  65           HG       LEU  65  -3.057   4.366  -1.864
  467   1HD1  LEU  65          1HD1      LEU  65  -2.971   2.284  -2.798
  468   2HD1  LEU  65          2HD1      LEU  65  -2.955   2.914  -4.444
  469   3HD1  LEU  65          3HD1      LEU  65  -4.478   2.785  -3.565
  470   1HD2  LEU  65          1HD2      LEU  65  -1.306   4.272  -3.878
  471   2HD2  LEU  65          2HD2      LEU  65  -1.551   5.753  -2.952
  472   3HD2  LEU  65          3HD2      LEU  65  -2.338   5.550  -4.518
  473    H    ASP  66           H        ASP  66  -3.894   8.798  -4.577
  474    HA   ASP  66           HA       ASP  66  -6.622   9.718  -4.693
  475   1HB   ASP  66          2HB       ASP  66  -4.352  10.911  -5.079
  476   2HB   ASP  66          1HB       ASP  66  -4.470  10.281  -6.722
  477    H    ARG  67           H        ARG  67  -7.812   9.911  -6.815
  478    HA   ARG  67           HA       ARG  67  -8.603   7.484  -7.914
  479   1HB   ARG  67          2HB       ARG  67  -9.107   9.050  -9.994
  480   2HB   ARG  67          1HB       ARG  67  -9.942   9.312  -8.464
  481   1HG   ARG  67          2HG       ARG  67  -8.754  11.230  -7.982
  482   2HG   ARG  67          1HG       ARG  67  -7.326  10.698  -8.866
  483   1HD   ARG  67          2HD       ARG  67  -8.004  12.014 -10.587
  484   2HD   ARG  67          1HD       ARG  67  -9.387  10.921 -10.797
  485    HE   ARG  67           HE       ARG  67  -9.856  12.713  -8.589
  486   1HH1  ARG  67          1HH2      ARG  67  -8.849  14.172 -11.225
  487   2HH1  ARG  67          2HH2      ARG  67 -10.378  14.716 -11.829
  488   1HH2  ARG  67          2HH1      ARG  67 -12.235  12.699  -9.705
  489   2HH2  ARG  67          1HH1      ARG  67 -12.295  13.883 -10.968
  490    H    ASP  68           H        ASP  68  -5.954   9.560  -9.067
  491    HA   ASP  68           HA       ASP  68  -5.274   7.718 -11.259
  492   1HB   ASP  68          2HB       ASP  68  -4.795  10.424 -10.466
  493   2HB   ASP  68          1HB       ASP  68  -3.227   9.632 -10.628
  494    H    GLU  69           H        GLU  69  -4.362   8.337  -7.960
  495    HA   GLU  69           HA       GLU  69  -1.839   6.879  -8.015
  496   1HB   GLU  69          2HB       GLU  69  -3.173   8.663  -6.374
  497   2HB   GLU  69          1HB       GLU  69  -3.305   7.147  -5.480
  498   1HG   GLU  69          2HG       GLU  69  -1.058   7.010  -5.110
  499   2HG   GLU  69          1HG       GLU  69  -0.658   7.739  -6.665
  500    H    PHE  70           H        PHE  70  -5.144   6.226  -6.870
  501    HA   PHE  70           HA       PHE  70  -4.676   3.544  -5.970
  502   1HB   PHE  70          2HB       PHE  70  -6.609   5.156  -5.513
  503   2HB   PHE  70          1HB       PHE  70  -7.220   4.728  -7.112
  504    HD1  PHE  70           HD1      PHE  70  -6.868   3.682  -3.656
  505    HD2  PHE  70           HD2      PHE  70  -7.767   2.337  -7.633
  506    HE1  PHE  70           HE1      PHE  70  -7.898   1.625  -2.727
  507    HE2  PHE  70           HE2      PHE  70  -8.792   0.284  -6.707
  508    HZ   PHE  70           HZ       PHE  70  -8.864  -0.072  -4.255
  509    H    ALA  71           H        ALA  71  -4.896   4.960  -9.098
  510    HA   ALA  71           HA       ALA  71  -5.832   2.594 -10.535
  511   1HB   ALA  71          1HB       ALA  71  -4.279   5.014 -11.507
  512   2HB   ALA  71          2HB       ALA  71  -6.024   5.012 -11.252
  513   3HB   ALA  71          3HB       ALA  71  -5.311   3.963 -12.478
  514    H    VAL  72           H        VAL  72  -2.687   4.188 -10.066
  515    HA   VAL  72           HA       VAL  72  -1.088   2.346 -11.529
  516    HB   VAL  72           HB       VAL  72  -0.473   3.997  -9.051
  517   1HG1  VAL  72          1HG1      VAL  72   1.507   3.331 -11.203
  518   2HG1  VAL  72          2HG1      VAL  72   1.162   2.131  -9.959
  519   3HG1  VAL  72          3HG1      VAL  72   1.790   3.715  -9.505
  520   1HG2  VAL  72          1HG2      VAL  72  -0.103   4.704 -11.979
  521   2HG2  VAL  72          2HG2      VAL  72   0.162   5.758 -10.590
  522   3HG2  VAL  72          3HG2      VAL  72  -1.473   5.243 -11.008
  523    H    ALA  73           H        ALA  73  -2.555   2.162  -8.361
  524    HA   ALA  73           HA       ALA  73  -0.898  -0.134  -7.510
  525   1HB   ALA  73          1HB       ALA  73  -1.920   0.253  -5.426
  526   2HB   ALA  73          2HB       ALA  73  -3.368   0.939  -6.163
  527   3HB   ALA  73          3HB       ALA  73  -1.867   1.865  -6.143
  528    H    MET  74           H        MET  74  -3.675   0.282  -9.424
  529    HA   MET  74           HA       MET  74  -5.065  -2.158  -8.522
  530   1HB   MET  74          2HB       MET  74  -5.404  -0.103 -10.716
  531   2HB   MET  74          1HB       MET  74  -6.430  -1.534 -10.635
  532   1HG   MET  74          2HG       MET  74  -6.081   0.087  -8.147
  533   2HG   MET  74          1HG       MET  74  -7.133   0.723  -9.412
  534   1HE   MET  74          1HE       MET  74  -6.710  -1.064  -6.479
  535   2HE   MET  74          2HE       MET  74  -6.479  -2.650  -7.211
  536   3HE   MET  74          3HE       MET  74  -7.952  -2.312  -6.306
  537    H    PHE  75           H        PHE  75  -3.297  -1.121 -11.445
  538    HA   PHE  75           HA       PHE  75  -3.373  -3.805 -12.590
  539   1HB   PHE  75          2HB       PHE  75  -2.368  -2.752 -14.421
  540   2HB   PHE  75          1HB       PHE  75  -3.155  -1.378 -13.648
  541    HD1  PHE  75           HD1      PHE  75   0.075  -3.168 -14.038
  542    HD2  PHE  75           HD2      PHE  75  -1.894   0.393 -12.671
  543    HE1  PHE  75           HE1      PHE  75   2.277  -2.059 -13.760
  544    HE2  PHE  75           HE2      PHE  75   0.299   1.501 -12.393
  545    HZ   PHE  75           HZ       PHE  75   2.391   0.278 -12.936
  546    H    LEU  76           H        LEU  76  -1.387  -2.032 -10.381
  547    HA   LEU  76           HA       LEU  76   1.016  -3.653 -10.633
  548   1HB   LEU  76          2HB       LEU  76  -0.120  -1.536  -8.858
  549   2HB   LEU  76          1HB       LEU  76   1.179  -2.526  -8.190
  550    HG   LEU  76           HG       LEU  76   1.294  -0.987 -10.801
  551   1HD1  LEU  76          1HD1      LEU  76   2.966  -0.532  -8.330
  552   2HD1  LEU  76          2HD1      LEU  76   1.409   0.269  -8.539
  553   3HD1  LEU  76          3HD1      LEU  76   2.708   0.553  -9.697
  554   1HD2  LEU  76          1HD2      LEU  76   2.798  -2.659 -11.247
  555   2HD2  LEU  76          2HD2      LEU  76   2.994  -3.073  -9.545
  556   3HD2  LEU  76          3HD2      LEU  76   3.849  -1.686 -10.218
  557    H    VAL  77           H        VAL  77  -2.049  -3.901  -9.039
  558    HA   VAL  77           HA       VAL  77  -1.158  -6.045  -7.200
  559    HB   VAL  77           HB       VAL  77  -3.754  -4.550  -7.741
  560   1HG1  VAL  77          1HG1      VAL  77  -4.802  -5.787  -5.992
  561   2HG1  VAL  77          2HG1      VAL  77  -3.278  -6.509  -5.477
  562   3HG1  VAL  77          3HG1      VAL  77  -4.023  -7.010  -6.996
  563   1HG2  VAL  77          1HG2      VAL  77  -2.168  -4.628  -5.181
  564   2HG2  VAL  77          2HG2      VAL  77  -3.267  -3.379  -5.769
  565   3HG2  VAL  77          3HG2      VAL  77  -1.675  -3.570  -6.502
  566    H    TYR  78           H        TYR  78  -3.772  -5.644  -9.612
  567    HA   TYR  78           HA       TYR  78  -4.473  -8.329  -9.919
  568   1HB   TYR  78          2HB       TYR  78  -4.570  -5.831 -11.513
  569   2HB   TYR  78          1HB       TYR  78  -4.818  -7.324 -12.419
  570    HD1  TYR  78           HD1      TYR  78  -6.619  -4.830 -11.030
  571    HD2  TYR  78           HD2      TYR  78  -6.235  -9.096 -10.689
  572    HE1  TYR  78           HE1      TYR  78  -8.940  -4.968 -10.168
  573    HE2  TYR  78           HE2      TYR  78  -8.558  -9.234  -9.827
  574    HH   TYR  78           HH       TYR  78 -10.267  -7.984  -8.935
  575    H    CYS  79           H        CYS  79  -1.548  -6.759 -10.927
  576    HA   CYS  79           HA       CYS  79  -0.874  -8.766 -12.967
  577   1HB   CYS  79          2HB       CYS  79   0.306  -6.288 -11.763
  578   2HB   CYS  79          1HB       CYS  79   1.380  -7.389 -12.624
  579    HG   CYS  79           HG       CYS  79  -0.842  -7.043 -14.474
  580    H    ALA  80           H        ALA  80  -0.515  -8.400  -9.534
  581    HA   ALA  80           HA       ALA  80   1.799 -10.223  -9.375
  582   1HB   ALA  80          1HB       ALA  80   0.879  -9.875  -6.831
  583   2HB   ALA  80          2HB       ALA  80   0.215  -8.441  -7.614
  584   3HB   ALA  80          3HB       ALA  80   1.954  -8.735  -7.639
  585    H    LEU  81           H        LEU  81  -1.584 -10.440  -9.616
  586    HA   LEU  81           HA       LEU  81  -1.808 -12.982  -8.129
  587   1HB   LEU  81          2HB       LEU  81  -3.687 -11.184  -9.674
  588   2HB   LEU  81          1HB       LEU  81  -4.205 -12.728  -8.992
  589    HG   LEU  81           HG       LEU  81  -3.117 -11.815  -6.795
  590   1HD1  LEU  81          1HD1      LEU  81  -3.315  -9.343  -6.647
  591   2HD1  LEU  81          2HD1      LEU  81  -3.642  -9.294  -8.379
  592   3HD1  LEU  81          3HD1      LEU  81  -2.081  -9.861  -7.793
  593   1HD2  LEU  81          1HD2      LEU  81  -5.372 -12.068  -6.502
  594   2HD2  LEU  81          2HD2      LEU  81  -5.756 -11.309  -8.047
  595   3HD2  LEU  81          3HD2      LEU  81  -5.381 -10.310  -6.643
  596    H    GLU  82           H        GLU  82  -1.976 -11.739 -11.438
  597    HA   GLU  82           HA       GLU  82  -2.496 -14.295 -12.688
  598   1HB   GLU  82          2HB       GLU  82  -3.122 -12.345 -13.871
  599   2HB   GLU  82          1HB       GLU  82  -1.580 -11.554 -13.551
  600   1HG   GLU  82          2HG       GLU  82  -0.474 -12.723 -15.215
  601   2HG   GLU  82          1HG       GLU  82  -1.560 -14.109 -15.110
  602    H    LYS  83           H        LYS  83   0.433 -12.253 -12.497
  603    HA   LYS  83           HA       LYS  83   2.227 -14.422 -11.984
  604   1HB   LYS  83          2HB       LYS  83   1.244 -14.108 -14.689
  605   2HB   LYS  83          1HB       LYS  83   2.999 -13.969 -14.631
  606   1HG   LYS  83          2HG       LYS  83   3.289 -16.134 -13.867
  607   2HG   LYS  83          1HG       LYS  83   1.707 -16.182 -13.089
  608   1HD   LYS  83          2HD       LYS  83   0.589 -16.645 -15.084
  609   2HD   LYS  83          1HD       LYS  83   1.866 -15.946 -16.077
  610   1HE   LYS  83          2HE       LYS  83   3.092 -18.066 -14.670
  611   2HE   LYS  83          1HE       LYS  83   1.540 -18.698 -15.252
  612   1HZ   LYS  83          1HZ       LYS  83   3.349 -17.075 -16.949
  613   2HZ   LYS  83          2HZ       LYS  83   2.005 -17.993 -17.437
  614   3HZ   LYS  83          3HZ       LYS  83   3.420 -18.770 -16.905
  615    H    GLU  84           H        GLU  84   1.717 -11.219 -13.332
  616    HA   GLU  84           HA       GLU  84   4.480 -10.426 -13.490
  617   1HB   GLU  84          2HB       GLU  84   1.781  -9.269 -13.688
  618   2HB   GLU  84          1HB       GLU  84   3.012  -8.130 -13.140
  619   1HG   GLU  84          2HG       GLU  84   3.908  -9.823 -15.364
  620   2HG   GLU  84          1HG       GLU  84   2.534  -8.796 -15.776
  621    HA   PRO  85           HA       PRO  85   4.932  -9.989  -9.038
  622   1HB   PRO  85          2HB       PRO  85   7.632  -9.533  -9.117
  623   2HB   PRO  85          1HB       PRO  85   6.928 -11.159  -9.221
  624   1HG   PRO  85          2HG       PRO  85   7.985  -9.413 -11.384
  625   2HG   PRO  85          1HG       PRO  85   8.101 -11.169 -11.191
  626   1HD   PRO  85          2HD       PRO  85   6.340  -9.939 -12.882
  627   2HD   PRO  85          1HD       PRO  85   6.066 -11.539 -12.160
  628    H    VAL  86           H        VAL  86   6.225  -8.083  -7.781
  629    HA   VAL  86           HA       VAL  86   5.772  -5.566  -9.359
  630    HB   VAL  86           HB       VAL  86   5.280  -6.161  -6.425
  631   1HG1  VAL  86          1HG1      VAL  86   5.215  -3.930  -6.138
  632   2HG1  VAL  86          2HG1      VAL  86   3.960  -3.813  -7.371
  633   3HG1  VAL  86          3HG1      VAL  86   5.658  -3.695  -7.829
  634   1HG2  VAL  86          1HG2      VAL  86   3.755  -6.934  -8.574
  635   2HG2  VAL  86          2HG2      VAL  86   3.059  -5.359  -8.196
  636   3HG2  VAL  86          3HG2      VAL  86   3.114  -6.617  -6.962
  637    HA   PRO  87           HA       PRO  87   9.975  -4.861  -8.015
  638   1HB   PRO  87          2HB       PRO  87  10.453  -2.794  -9.741
  639   2HB   PRO  87          1HB       PRO  87  10.473  -4.494 -10.248
  640   1HG   PRO  87          2HG       PRO  87   8.490  -2.408 -10.794
  641   2HG   PRO  87          1HG       PRO  87   8.813  -3.915 -11.658
  642   1HD   PRO  87          2HD       PRO  87   6.714  -3.374  -9.803
  643   2HD   PRO  87          1HD       PRO  87   7.068  -4.904 -10.633
  644    H    MET  88           H        MET  88  11.114  -2.489  -7.548
  645    HA   MET  88           HA       MET  88   9.094  -0.980  -5.913
  646   1HB   MET  88          2HB       MET  88  12.078  -0.977  -5.543
  647   2HB   MET  88          1HB       MET  88  10.832  -0.592  -4.363
  648   1HG   MET  88          2HG       MET  88  10.206  -2.882  -4.124
  649   2HG   MET  88          1HG       MET  88  11.107  -3.355  -5.563
  650   1HE   MET  88          1HE       MET  88  12.896  -0.646  -3.401
  651   2HE   MET  88          2HE       MET  88  13.157  -1.527  -1.898
  652   3HE   MET  88          3HE       MET  88  11.515  -1.228  -2.462
  653    H    SER  89           H        SER  89  10.354  -0.634  -8.831
  654    HA   SER  89           HA       SER  89  11.294   2.169  -8.372
  655   1HB   SER  89          2HB       SER  89  11.799   0.130 -10.530
  656   2HB   SER  89          1HB       SER  89  12.325   1.807 -10.646
  657    HG   SER  89           HG       SER  89  14.006   1.025  -9.617
  658    H    LEU  90           H        LEU  90   9.444   3.353  -8.537
  659    HA   LEU  90           HA       LEU  90   7.243   2.983 -10.285
  660   1HB   LEU  90          2HB       LEU  90   8.229   4.886  -8.447
  661   2HB   LEU  90          1HB       LEU  90   7.957   5.776  -9.946
  662    HG   LEU  90           HG       LEU  90   5.956   4.037  -8.484
  663   1HD1  LEU  90          1HD1      LEU  90   5.799   6.049  -7.377
  664   2HD1  LEU  90          2HD1      LEU  90   4.776   6.440  -8.760
  665   3HD1  LEU  90          3HD1      LEU  90   6.461   6.964  -8.732
  666   1HD2  LEU  90          1HD2      LEU  90   6.157   4.571 -11.253
  667   2HD2  LEU  90          2HD2      LEU  90   4.879   5.625 -10.647
  668   3HD2  LEU  90          3HD2      LEU  90   4.777   3.881 -10.400
  669    HA   PRO  91           HA       PRO  91   9.693   3.600 -14.033
  670   1HB   PRO  91          2HB       PRO  91   7.685   2.802 -15.729
  671   2HB   PRO  91          1HB       PRO  91   8.754   1.666 -14.878
  672   1HG   PRO  91          2HG       PRO  91   5.991   2.546 -14.178
  673   2HG   PRO  91          1HG       PRO  91   6.702   0.925 -14.116
  674   1HD   PRO  91          2HD       PRO  91   6.392   2.437 -11.907
  675   2HD   PRO  91          1HD       PRO  91   7.769   1.325 -12.103
  676    HA   PRO  92           HA       PRO  92   8.196   7.555 -15.181
  677   1HB   PRO  92          2HB       PRO  92   9.116   7.737 -17.752
  678   2HB   PRO  92          1HB       PRO  92  10.177   7.839 -16.333
  679   1HG   PRO  92          2HG       PRO  92   9.679   5.548 -18.163
  680   2HG   PRO  92          1HG       PRO  92  11.183   6.070 -17.388
  681   1HD   PRO  92          2HD       PRO  92   9.664   3.974 -16.505
  682   2HD   PRO  92          1HD       PRO  92  10.732   4.934 -15.457
  683    H    ALA  93           H        ALA  93   7.177   4.741 -16.924
  684    HA   ALA  93           HA       ALA  93   5.223   6.195 -18.598
  685   1HB   ALA  93          1HB       ALA  93   4.811   3.361 -18.495
  686   2HB   ALA  93          2HB       ALA  93   6.550   3.658 -18.526
  687   3HB   ALA  93          3HB       ALA  93   5.521   4.306 -19.805
  688    H    LEU  94           H        LEU  94   5.367   5.389 -15.390
  689    HA   LEU  94           HA       LEU  94   2.462   4.699 -15.195
  690   1HB   LEU  94          2HB       LEU  94   4.934   4.266 -13.534
  691   2HB   LEU  94          1HB       LEU  94   3.353   4.218 -12.755
  692    HG   LEU  94           HG       LEU  94   4.251   1.982 -13.597
  693   1HD1  LEU  94          1HD1      LEU  94   1.996   1.411 -14.679
  694   2HD1  LEU  94          2HD1      LEU  94   1.587   3.114 -14.468
  695   3HD1  LEU  94          3HD1      LEU  94   1.938   2.109 -13.062
  696   1HD2  LEU  94          1HD2      LEU  94   3.440   3.128 -16.281
  697   2HD2  LEU  94          2HD2      LEU  94   4.140   1.541 -15.969
  698   3HD2  LEU  94          3HD2      LEU  94   5.115   2.995 -15.754
  699    H    VAL  95           H        VAL  95   4.572   7.323 -14.940
  700    HA   VAL  95           HA       VAL  95   3.161   8.635 -12.689
  701    HB   VAL  95           HB       VAL  95   5.367   9.630 -14.517
  702   1HG1  VAL  95          1HG1      VAL  95   4.754  11.508 -13.331
  703   2HG1  VAL  95          2HG1      VAL  95   5.825  10.778 -12.135
  704   3HG1  VAL  95          3HG1      VAL  95   4.079  10.572 -11.996
  705   1HG2  VAL  95          1HG2      VAL  95   5.945   7.467 -13.429
  706   2HG2  VAL  95          2HG2      VAL  95   5.573   8.179 -11.859
  707   3HG2  VAL  95          3HG2      VAL  95   6.922   8.798 -12.812
  708    HA   PRO  96           HA       PRO  96   0.512  10.431 -15.870
  709   1HB   PRO  96          2HB       PRO  96  -1.462  11.178 -14.127
  710   2HB   PRO  96          1HB       PRO  96  -1.304   9.524 -14.751
  711   1HG   PRO  96          2HG       PRO  96  -0.565  10.630 -12.105
  712   2HG   PRO  96          1HG       PRO  96  -1.164   9.022 -12.532
  713   1HD   PRO  96          2HD       PRO  96   1.477   9.643 -11.986
  714   2HD   PRO  96          1HD       PRO  96   0.924   8.213 -12.880
  715    HA   PRO  97           HA       PRO  97   1.332  14.720 -15.288
  716   1HB   PRO  97          2HB       PRO  97  -1.018  15.982 -15.911
  717   2HB   PRO  97          1HB       PRO  97   0.022  15.219 -17.131
  718   1HG   PRO  97          2HG       PRO  97  -2.471  14.197 -15.864
  719   2HG   PRO  97          1HG       PRO  97  -1.918  14.060 -17.540
  720   1HD   PRO  97          2HD       PRO  97  -1.727  12.032 -15.737
  721   2HD   PRO  97          1HD       PRO  97  -0.603  12.236 -17.098
  722    H    SER  98           H        SER  98  -0.995  13.173 -13.348
  723    HA   SER  98           HA       SER  98  -1.876  15.390 -11.718
  724   1HB   SER  98          2HB       SER  98  -1.875  12.415 -11.671
  725   2HB   SER  98          1HB       SER  98  -2.078  13.214 -10.115
  726    HG   SER  98           HG       SER  98  -3.802  12.989 -12.209
  727    H    LYS  99           H        LYS  99   1.091  13.663 -11.957
  728    HA   LYS  99           HA       LYS  99   1.969  14.313  -9.209
  729   1HB   LYS  99          2HB       LYS  99   2.659  12.201 -10.127
  730   2HB   LYS  99          1HB       LYS  99   3.184  12.956 -11.632
  731   1HG   LYS  99          2HG       LYS  99   5.082  12.382 -10.091
  732   2HG   LYS  99          1HG       LYS  99   4.998  14.099 -10.492
  733   1HD   LYS  99          2HD       LYS  99   4.580  14.687  -8.348
  734   2HD   LYS  99          1HD       LYS  99   3.389  13.402  -8.145
  735   1HE   LYS  99          2HE       LYS  99   5.247  12.959  -6.627
  736   2HE   LYS  99          1HE       LYS  99   5.324  11.767  -7.940
  737   1HZ   LYS  99          1HZ       LYS  99   6.622  14.226  -8.622
  738   2HZ   LYS  99          2HZ       LYS  99   7.216  12.636  -8.698
  739   3HZ   LYS  99          3HZ       LYS  99   7.314  13.515  -7.247
  740    H    ARG 100           H        ARG 100   1.609  16.030 -12.022
  741    HA   ARG 100           HA       ARG 100   4.153  17.559 -11.792
  742   1HB   ARG 100          2HB       ARG 100   1.952  17.154 -13.770
  743   2HB   ARG 100          1HB       ARG 100   2.812  18.694 -13.825
  744   1HG   ARG 100          2HG       ARG 100   4.392  17.631 -15.034
  745   2HG   ARG 100          1HG       ARG 100   4.841  16.804 -13.543
  746   1HD   ARG 100          2HD       ARG 100   2.832  15.199 -14.196
  747   2HD   ARG 100          1HD       ARG 100   3.173  15.806 -15.829
  748    HE   ARG 100           HE       ARG 100   5.271  14.570 -14.081
  749   1HH1  ARG 100          1HH2      ARG 100   5.872  16.202 -16.639
  750   2HH1  ARG 100          2HH2      ARG 100   6.130  14.918 -17.773
  751   1HH2  ARG 100          2HH1      ARG 100   4.711  12.488 -15.745
  752   2HH2  ARG 100          1HH1      ARG 100   5.472  12.816 -17.266
  753    H    SER 107           1H       SER 107   9.974   3.649   5.391
  754    HA   SER 107           HA       SER 107   7.774   2.183   5.347
  755   1HB   SER 107          2HB       SER 107   9.247   3.785   7.408
  756   2HB   SER 107          1HB       SER 107   7.820   2.885   7.915
  757    HG   SER 107           HG       SER 107   9.725   1.614   6.301
  758    H    THR 108           H        THR 108   6.524   4.055   3.913
  759    HA   THR 108           HA       THR 108   4.746   5.569   5.788
  760    HB   THR 108           HB       THR 108   4.410   7.065   3.932
  761    HG1  THR 108           HG1      THR 108   4.256   6.044   2.104
  762   1HG2  THR 108          1HG2      THR 108   7.292   6.304   3.561
  763   2HG2  THR 108          2HG2      THR 108   6.740   6.913   5.122
  764   3HG2  THR 108          3HG2      THR 108   6.572   7.910   3.677
  765    H    ASN 109           H        ASN 109   4.827   3.146   3.243
  766    HA   ASN 109           HA       ASN 109   2.029   3.093   2.610
  767   1HB   ASN 109          2HB       ASN 109   2.641   0.866   1.685
  768   2HB   ASN 109          1HB       ASN 109   3.819   2.104   1.251
  769   1HD2  ASN 109          1HD2      ASN 109   5.301   0.145   1.004
  770   2HD2  ASN 109          2HD2      ASN 109   6.091  -0.434   2.389
  771    HA   PRO 110           HA       PRO 110   0.357   0.947   6.061
  772   1HB   PRO 110          2HB       PRO 110  -1.689  -0.420   4.876
  773   2HB   PRO 110          1HB       PRO 110  -1.709   1.341   5.096
  774   1HG   PRO 110          2HG       PRO 110  -1.188  -0.252   2.657
  775   2HG   PRO 110          1HG       PRO 110  -1.949   1.334   2.833
  776   1HD   PRO 110          2HD       PRO 110   0.663   0.883   2.001
  777   2HD   PRO 110          1HD       PRO 110   0.025   2.425   2.610
  778    H    PHE 111           H        PHE 111   2.310  -0.597   3.973
  779    HA   PHE 111           HA       PHE 111   1.850  -3.266   5.260
  780   1HB   PHE 111          2HB       PHE 111   2.491  -2.569   2.378
  781   2HB   PHE 111          1HB       PHE 111   2.547  -4.216   3.015
  782    HD1  PHE 111           HD1      PHE 111   0.541  -2.046   1.230
  783    HD2  PHE 111           HD2      PHE 111   0.341  -4.711   4.592
  784    HE1  PHE 111           HE1      PHE 111  -1.910  -2.251   0.920
  785    HE2  PHE 111           HE2      PHE 111  -2.111  -4.918   4.282
  786    HZ   PHE 111           HZ       PHE 111  -3.237  -3.687   2.446
  787    H    LEU 112           HN       LEU 112   3.674  -1.298   6.221
  788    HA   LEU 112           HA       LEU 112   6.133  -2.810   6.270
  789   1HB   LEU 112          2HB       LEU 112   5.744  -1.345   3.972
  790   2HB   LEU 112          1HB       LEU 112   6.684  -0.228   4.961
  791    HG   LEU 112           HG       LEU 112   8.107  -2.447   5.426
  792   1HD1  LEU 112          1HD1      LEU 112   6.423  -3.026   3.068
  793   2HD1  LEU 112          2HD1      LEU 112   7.269  -4.135   4.147
  794   3HD1  LEU 112          3HD1      LEU 112   8.144  -3.341   2.838
  795   1HD2  LEU 112          1HD2      LEU 112   9.457  -1.750   3.315
  796   2HD2  LEU 112          2HD2      LEU 112   9.209  -0.541   4.575
  797   3HD2  LEU 112          3HD2      LEU 112   8.219  -0.510   3.116
  Start of MODEL    3
    1    HA   PRO   6           HA       PRO   6   0.812   7.688 -22.787
    2   1HB   PRO   6          2HB       PRO   6  -0.571   5.330 -22.924
    3   2HB   PRO   6          1HB       PRO   6  -0.284   6.363 -24.339
    4   1HG   PRO   6          2HG       PRO   6   1.132   3.886 -23.486
    5   2HG   PRO   6          1HG       PRO   6   0.671   4.420 -25.110
    6   1HD   PRO   6          2HD       PRO   6   3.199   4.641 -24.126
    7   2HD   PRO   6          1HD       PRO   6   2.524   5.746 -25.345
    8    H    TRP   7           H        TRP   7  -0.805   6.428 -21.059
    9    HA   TRP   7           HA       TRP   7   0.882   6.007 -18.676
   10   1HB   TRP   7          2HB       TRP   7  -1.133   7.450 -18.693
   11   2HB   TRP   7          1HB       TRP   7  -2.124   6.056 -19.120
   12    HD1  TRP   7           HD1      TRP   7   0.621   5.232 -16.766
   13    HE1  TRP   7           HE1      TRP   7  -0.313   4.898 -14.384
   14    HE3  TRP   7           HE3      TRP   7  -4.100   7.053 -17.414
   15    HZ2  TRP   7           HZ2      TRP   7  -2.744   5.347 -12.948
   16    HZ3  TRP   7           HZ3      TRP   7  -5.705   7.090 -15.526
   17    HH2  TRP   7           HH2      TRP   7  -5.033   6.240 -13.295
   18    H    ALA   8           H        ALA   8   1.414   3.974 -17.953
   19    HA   ALA   8           HA       ALA   8   1.006   1.563 -19.236
   20   1HB   ALA   8          1HB       ALA   8   2.468   1.487 -17.439
   21   2HB   ALA   8          2HB       ALA   8   1.059   0.712 -16.709
   22   3HB   ALA   8          3HB       ALA   8   1.387   2.416 -16.403
   23    H    VAL   9           H        VAL   9  -1.271   3.266 -17.166
   24    HA   VAL   9           HA       VAL   9  -3.167   0.993 -17.164
   25    HB   VAL   9           HB       VAL   9  -3.083   3.767 -15.957
   26   1HG1  VAL   9          1HG1      VAL   9  -5.414   3.243 -16.564
   27   2HG1  VAL   9          2HG1      VAL   9  -5.199   3.174 -14.815
   28   3HG1  VAL   9          3HG1      VAL   9  -5.280   1.683 -15.754
   29   1HG2  VAL   9          1HG2      VAL   9  -3.061   2.440 -13.846
   30   2HG2  VAL   9          2HG2      VAL   9  -1.681   2.069 -14.881
   31   3HG2  VAL   9          3HG2      VAL   9  -3.049   0.959 -14.804
   32    H    LYS  10           H        LYS  10  -4.979   0.906 -18.454
   33    HA   LYS  10           HA       LYS  10  -5.262   2.959 -20.581
   34   1HB   LYS  10          2HB       LYS  10  -5.927   0.107 -20.090
   35   2HB   LYS  10          1HB       LYS  10  -7.074   0.988 -21.098
   36   1HG   LYS  10          2HG       LYS  10  -5.489   1.424 -22.755
   37   2HG   LYS  10          1HG       LYS  10  -4.132   1.249 -21.641
   38   1HD   LYS  10          2HD       LYS  10  -5.210  -1.245 -21.493
   39   2HD   LYS  10          1HD       LYS  10  -5.604  -0.824 -23.160
   40   1HE   LYS  10          2HE       LYS  10  -3.414  -0.896 -23.820
   41   2HE   LYS  10          1HE       LYS  10  -2.843  -0.139 -22.320
   42   1HZ   LYS  10          1HZ       LYS  10  -4.022  -2.835 -22.239
   43   2HZ   LYS  10          2HZ       LYS  10  -2.898  -2.122 -21.183
   44   3HZ   LYS  10          3HZ       LYS  10  -2.404  -2.653 -22.719
   45    HA   PRO  11           HA       PRO  11  -8.996   4.726 -19.068
   46   1HB   PRO  11          2HB       PRO  11 -10.793   4.430 -21.125
   47   2HB   PRO  11          1HB       PRO  11  -9.467   5.611 -21.156
   48   1HG   PRO  11          2HG       PRO  11  -9.623   2.908 -22.410
   49   2HG   PRO  11          1HG       PRO  11  -8.981   4.420 -23.074
   50   1HD   PRO  11          2HD       PRO  11  -7.369   2.502 -22.102
   51   2HD   PRO  11          1HD       PRO  11  -6.980   4.228 -21.933
   52    H    GLU  12           H        GLU  12  -9.336   1.537 -20.520
   53    HA   GLU  12           HA       GLU  12 -11.855   0.886 -19.204
   54   1HB   GLU  12          2HB       GLU  12  -9.834  -1.104 -20.232
   55   2HB   GLU  12          1HB       GLU  12 -11.592  -1.180 -20.317
   56   1HG   GLU  12          2HG       GLU  12  -9.710   0.506 -21.967
   57   2HG   GLU  12          1HG       GLU  12 -10.921  -0.646 -22.524
   58    H    ASP  13           H        ASP  13  -8.423   0.441 -18.517
   59    HA   ASP  13           HA       ASP  13  -8.870  -1.296 -16.202
   60   1HB   ASP  13          2HB       ASP  13  -6.532   0.228 -17.385
   61   2HB   ASP  13          1HB       ASP  13  -6.375  -0.724 -15.908
   62    H    LYS  14           H        LYS  14  -8.138   2.114 -16.813
   63    HA   LYS  14           HA       LYS  14  -7.971   2.888 -14.042
   64   1HB   LYS  14          2HB       LYS  14  -6.968   4.295 -15.675
   65   2HB   LYS  14          1HB       LYS  14  -8.418   4.291 -16.678
   66   1HG   LYS  14          2HG       LYS  14  -8.122   6.432 -15.427
   67   2HG   LYS  14          1HG       LYS  14  -9.623   5.603 -15.014
   68   1HD   LYS  14          2HD       LYS  14  -8.978   5.281 -12.869
   69   2HD   LYS  14          1HD       LYS  14  -7.363   4.760 -13.350
   70   1HE   LYS  14          2HE       LYS  14  -6.944   6.779 -12.190
   71   2HE   LYS  14          1HE       LYS  14  -6.989   7.308 -13.884
   72   1HZ   LYS  14          1HZ       LYS  14  -8.968   8.312 -13.617
   73   2HZ   LYS  14          2HZ       LYS  14  -8.557   8.333 -11.969
   74   3HZ   LYS  14          3HZ       LYS  14  -9.568   7.112 -12.579
   75    H    ALA  15           H        ALA  15 -10.560   2.145 -16.180
   76    HA   ALA  15           HA       ALA  15 -12.637   3.740 -14.917
   77   1HB   ALA  15          1HB       ALA  15 -13.580   1.320 -16.181
   78   2HB   ALA  15          2HB       ALA  15 -12.279   2.015 -17.150
   79   3HB   ALA  15          3HB       ALA  15 -13.705   2.980 -16.764
   80    H    LYS  16           H        LYS  16 -11.464   0.395 -14.628
   81    HA   LYS  16           HA       LYS  16 -13.380  -0.274 -12.523
   82   1HB   LYS  16          2HB       LYS  16 -12.588  -2.400 -12.910
   83   2HB   LYS  16          1HB       LYS  16 -11.959  -1.655 -14.377
   84   1HG   LYS  16          2HG       LYS  16  -9.808  -1.279 -13.315
   85   2HG   LYS  16          1HG       LYS  16 -10.423  -1.899 -11.783
   86   1HD   LYS  16          2HD       LYS  16 -10.980  -3.850 -13.789
   87   2HD   LYS  16          1HD       LYS  16  -9.290  -3.376 -13.961
   88   1HE   LYS  16          2HE       LYS  16  -8.886  -4.829 -12.252
   89   2HE   LYS  16          1HE       LYS  16  -9.618  -3.601 -11.200
   90   1HZ   LYS  16          1HZ       LYS  16 -10.997  -5.389 -10.830
   91   2HZ   LYS  16          2HZ       LYS  16 -10.854  -5.980 -12.417
   92   3HZ   LYS  16          3HZ       LYS  16 -11.817  -4.617 -12.098
   93    H    TYR  17           H        TYR  17 -10.277   1.204 -12.795
   94    HA   TYR  17           HA       TYR  17  -9.383   0.728 -10.049
   95   1HB   TYR  17          2HB       TYR  17  -8.601   2.655 -12.267
   96   2HB   TYR  17          1HB       TYR  17  -7.733   2.523 -10.744
   97    HD1  TYR  17           HD1      TYR  17  -9.048  -0.647 -11.604
   98    HD2  TYR  17           HD2      TYR  17  -5.856   2.058 -12.555
   99    HE1  TYR  17           HE1      TYR  17  -7.730  -2.528 -12.526
  100    HE2  TYR  17           HE2      TYR  17  -4.525   0.178 -13.469
  101    HH   TYR  17           HH       TYR  17  -5.153  -2.179 -14.498
  102    H    ASP  18           H        ASP  18 -11.112   3.196 -11.866
  103    HA   ASP  18           HA       ASP  18 -11.172   5.140  -9.674
  104   1HB   ASP  18          2HB       ASP  18 -11.194   5.953 -11.917
  105   2HB   ASP  18          1HB       ASP  18 -12.469   4.830 -12.390
  106    H    ALA  19           H        ALA  19 -12.937   2.318 -10.444
  107    HA   ALA  19           HA       ALA  19 -15.388   3.234  -9.016
  108   1HB   ALA  19          1HB       ALA  19 -14.795   1.469 -11.144
  109   2HB   ALA  19          2HB       ALA  19 -16.364   1.675 -10.364
  110   3HB   ALA  19          3HB       ALA  19 -15.254   0.427  -9.797
  111    H    ILE  20           H        ILE  20 -12.586   1.162  -8.784
  112    HA   ILE  20           HA       ILE  20 -13.334  -0.098  -6.258
  113    HB   ILE  20           HB       ILE  20 -10.895   0.156  -8.030
  114   1HG1  ILE  20          2HG1      ILE  20 -12.241  -2.379  -7.119
  115   2HG1  ILE  20          1HG1      ILE  20 -12.945  -1.423  -8.424
  116   1HG2  ILE  20          1HG2      ILE  20 -11.011  -1.471  -5.490
  117   2HG2  ILE  20          2HG2      ILE  20 -10.284   0.132  -5.571
  118   3HG2  ILE  20          3HG2      ILE  20  -9.617  -1.186  -6.530
  119   1HD1  ILE  20          1HD1      ILE  20 -11.540  -2.618  -9.758
  120   2HD1  ILE  20          2HD1      ILE  20 -10.497  -3.071  -8.411
  121   3HD1  ILE  20          3HD1      ILE  20 -10.312  -1.493  -9.176
  122    H    PHE  21           H        PHE  21 -11.582   2.699  -7.428
  123    HA   PHE  21           HA       PHE  21 -10.314   3.457  -4.946
  124   1HB   PHE  21          2HB       PHE  21  -9.300   4.400  -6.793
  125   2HB   PHE  21          1HB       PHE  21 -10.814   4.526  -7.680
  126    HD1  PHE  21           HD1      PHE  21  -8.531   6.181  -5.343
  127    HD2  PHE  21           HD2      PHE  21 -12.360   6.414  -7.278
  128    HE1  PHE  21           HE1      PHE  21  -8.686   8.585  -4.748
  129    HE2  PHE  21           HE2      PHE  21 -12.515   8.815  -6.683
  130    HZ   PHE  21           HZ       PHE  21 -10.679   9.900  -5.419
  131    H    ASP  22           H        ASP  22 -13.353   4.276  -6.564
  132    HA   ASP  22           HA       ASP  22 -14.152   6.105  -4.377
  133   1HB   ASP  22          2HB       ASP  22 -14.688   6.836  -6.560
  134   2HB   ASP  22          1HB       ASP  22 -15.255   5.236  -7.049
  135    H    SER  23           H        SER  23 -14.229   2.796  -4.928
  136    HA   SER  23           HA       SER  23 -16.891   2.230  -3.846
  137   1HB   SER  23          2HB       SER  23 -16.036   0.588  -5.304
  138   2HB   SER  23          1HB       SER  23 -14.414   0.704  -4.628
  139    HG   SER  23           HG       SER  23 -16.636  -0.196  -3.126
  140    H    LEU  24           H        LEU  24 -13.883   3.156  -2.610
  141    HA   LEU  24           HA       LEU  24 -14.295   1.898   0.048
  142   1HB   LEU  24          2HB       LEU  24 -12.094   3.757  -0.858
  143   2HB   LEU  24          1HB       LEU  24 -12.023   2.520   0.395
  144    HG   LEU  24           HG       LEU  24 -12.517   1.817  -2.499
  145   1HD1  LEU  24          1HD1      LEU  24  -9.818   1.302  -1.579
  146   2HD1  LEU  24          2HD1      LEU  24 -10.185   3.021  -1.497
  147   3HD1  LEU  24          3HD1      LEU  24 -10.352   2.157  -3.028
  148   1HD2  LEU  24          1HD2      LEU  24 -12.889   0.244  -0.447
  149   2HD2  LEU  24          2HD2      LEU  24 -11.126   0.193  -0.380
  150   3HD2  LEU  24          3HD2      LEU  24 -11.972  -0.371  -1.823
  151    H    SER  25           H        SER  25 -13.538   5.061  -1.343
  152    HA   SER  25           HA       SER  25 -15.355   6.866  -0.603
  153   1HB   SER  25          2HB       SER  25 -15.811   6.178   1.574
  154   2HB   SER  25          1HB       SER  25 -14.140   5.718   1.889
  155    HG   SER  25           HG       SER  25 -15.060   7.776   2.830
  156    HA   PRO  26           HA       PRO  26 -11.358   8.696  -1.687
  157   1HB   PRO  26          2HB       PRO  26 -12.417  10.519  -3.419
  158   2HB   PRO  26          1HB       PRO  26 -12.083   8.836  -3.876
  159   1HG   PRO  26          2HG       PRO  26 -14.661  10.117  -3.144
  160   2HG   PRO  26          1HG       PRO  26 -14.321   8.886  -4.370
  161   1HD   PRO  26          2HD       PRO  26 -15.422   8.336  -1.919
  162   2HD   PRO  26          1HD       PRO  26 -14.477   7.168  -2.869
  163    H    VAL  27           H        VAL  27 -10.463  10.651  -0.964
  164    HA   VAL  27           HA       VAL  27 -12.301  12.477   0.549
  165    HB   VAL  27           HB       VAL  27  -9.403  11.702   1.040
  166   1HG1  VAL  27          1HG1      VAL  27  -9.445  13.082   2.936
  167   2HG1  VAL  27          2HG1      VAL  27 -11.207  13.137   2.975
  168   3HG1  VAL  27          3HG1      VAL  27 -10.323  14.046   1.749
  169   1HG2  VAL  27          1HG2      VAL  27 -10.348   9.859   1.954
  170   2HG2  VAL  27          2HG2      VAL  27 -11.971  10.538   1.828
  171   3HG2  VAL  27          3HG2      VAL  27 -10.956  10.935   3.214
  172    H    ASN  28           H        ASN  28 -12.547  14.084  -1.057
  173    HA   ASN  28           HA       ASN  28 -11.911  15.908  -2.419
  174   1HB   ASN  28          2HB       ASN  28 -10.921  16.711  -0.367
  175   2HB   ASN  28          1HB       ASN  28  -9.557  15.607  -0.530
  176   1HD2  ASN  28          1HD2      ASN  28  -7.769  16.317  -1.755
  177   2HD2  ASN  28          2HD2      ASN  28  -7.734  17.773  -2.626
  178    H    GLY  29           H        GLY  29 -10.934  12.959  -2.897
  179   1HA   GLY  29          2HA       GLY  29 -10.124  12.275  -5.108
  180   2HA   GLY  29          1HA       GLY  29  -9.066  13.688  -5.106
  181    H    PHE  30           H        PHE  30  -9.494  11.538  -2.335
  182    HA   PHE  30           HA       PHE  30  -6.865  10.264  -2.855
  183   1HB   PHE  30          2HB       PHE  30  -7.525  12.095  -0.541
  184   2HB   PHE  30          1HB       PHE  30  -6.085  11.068  -0.599
  185    HD1  PHE  30           HD1      PHE  30  -7.465  14.214  -1.514
  186    HD2  PHE  30           HD2      PHE  30  -4.642  11.229  -2.750
  187    HE1  PHE  30           HE1      PHE  30  -6.336  15.886  -2.941
  188    HE2  PHE  30           HE2      PHE  30  -3.497  12.908  -4.182
  189    HZ   PHE  30           HZ       PHE  30  -4.344  15.239  -4.278
  190    H    LEU  31           H        LEU  31  -6.643   8.298  -1.892
  191    HA   LEU  31           HA       LEU  31  -8.889   7.355  -0.130
  192   1HB   LEU  31          2HB       LEU  31  -7.074   6.050  -2.162
  193   2HB   LEU  31          1HB       LEU  31  -7.839   5.073  -0.911
  194    HG   LEU  31           HG       LEU  31  -9.184   6.710  -3.062
  195   1HD1  LEU  31          1HD1      LEU  31 -10.335   4.251  -2.983
  196   2HD1  LEU  31          2HD1      LEU  31  -8.719   3.858  -2.395
  197   3HD1  LEU  31          3HD1      LEU  31  -8.925   4.624  -3.975
  198   1HD2  LEU  31          1HD2      LEU  31 -11.317   5.878  -1.919
  199   2HD2  LEU  31          2HD2      LEU  31 -10.467   7.179  -1.085
  200   3HD2  LEU  31          3HD2      LEU  31 -10.313   5.517  -0.515
  201    H    SER  32           H        SER  32  -8.264   6.474   1.892
  202    HA   SER  32           HA       SER  32  -5.461   7.012   2.670
  203   1HB   SER  32          2HB       SER  32  -6.346   6.627   4.928
  204   2HB   SER  32          1HB       SER  32  -7.419   7.712   4.046
  205    HG   SER  32           HG       SER  32  -8.843   6.264   4.673
  206    H    GLY  33           H        GLY  33  -4.038   5.411   3.408
  207   1HA   GLY  33          2HA       GLY  33  -3.903   2.954   2.147
  208   2HA   GLY  33          1HA       GLY  33  -3.224   3.210   3.756
  209    H    ASP  34           H        ASP  34  -5.935   3.849   4.841
  210    HA   ASP  34           HA       ASP  34  -6.676   1.219   5.732
  211   1HB   ASP  34          2HB       ASP  34  -7.013   3.316   6.992
  212   2HB   ASP  34          1HB       ASP  34  -8.159   3.870   5.769
  213    H    LYS  35           H        LYS  35  -7.687   3.193   3.002
  214    HA   LYS  35           HA       LYS  35 -10.005   1.427   2.440
  215   1HB   LYS  35          2HB       LYS  35  -8.841   3.934   1.176
  216   2HB   LYS  35          1HB       LYS  35 -10.294   3.128   0.589
  217   1HG   LYS  35          2HG       LYS  35 -11.364   3.444   2.792
  218   2HG   LYS  35          1HG       LYS  35  -9.911   4.254   3.379
  219   1HD   LYS  35          2HD       LYS  35 -10.242   5.830   1.332
  220   2HD   LYS  35          1HD       LYS  35 -11.891   5.203   1.316
  221   1HE   LYS  35          2HE       LYS  35 -12.457   6.269   3.279
  222   2HE   LYS  35          1HE       LYS  35 -10.826   6.099   3.958
  223   1HZ   LYS  35          1HZ       LYS  35 -11.681   8.392   2.994
  224   2HZ   LYS  35          2HZ       LYS  35 -11.127   7.712   1.539
  225   3HZ   LYS  35          3HZ       LYS  35 -10.062   7.912   2.847
  226    H    VAL  36           H        VAL  36  -6.781   2.262   1.312
  227    HA   VAL  36           HA       VAL  36  -6.930   0.598  -1.104
  228    HB   VAL  36           HB       VAL  36  -4.665   1.943   0.396
  229   1HG1  VAL  36          1HG1      VAL  36  -3.350   0.758  -0.991
  230   2HG1  VAL  36          2HG1      VAL  36  -4.014   1.735  -2.301
  231   3HG1  VAL  36          3HG1      VAL  36  -4.735   0.173  -1.915
  232   1HG2  VAL  36          1HG2      VAL  36  -5.059   3.838  -0.877
  233   2HG2  VAL  36          2HG2      VAL  36  -6.708   3.246  -0.686
  234   3HG2  VAL  36          3HG2      VAL  36  -5.825   2.932  -2.181
  235    H    LYS  37           H        LYS  37  -5.207   0.438   2.027
  236    HA   LYS  37           HA       LYS  37  -3.715  -1.840   1.829
  237   1HB   LYS  37          2HB       LYS  37  -3.852  -0.563   3.858
  238   2HB   LYS  37          1HB       LYS  37  -5.570  -0.904   4.035
  239   1HG   LYS  37          2HG       LYS  37  -4.567  -3.438   3.955
  240   2HG   LYS  37          1HG       LYS  37  -3.229  -2.582   4.721
  241   1HD   LYS  37          2HD       LYS  37  -5.866  -1.814   5.770
  242   2HD   LYS  37          1HD       LYS  37  -5.461  -3.510   6.045
  243   1HE   LYS  37          2HE       LYS  37  -3.118  -1.944   6.581
  244   2HE   LYS  37          1HE       LYS  37  -4.483  -1.243   7.475
  245   1HZ   LYS  37          1HZ       LYS  37  -3.738  -4.120   7.413
  246   2HZ   LYS  37          2HZ       LYS  37  -5.075  -3.468   8.232
  247   3HZ   LYS  37          3HZ       LYS  37  -3.499  -3.066   8.721
  248    HA   PRO  38           HA       PRO  38  -7.495  -4.735   2.567
  249   1HB   PRO  38          2HB       PRO  38  -9.975  -3.652   2.111
  250   2HB   PRO  38          1HB       PRO  38  -9.217  -3.694   3.717
  251   1HG   PRO  38          2HG       PRO  38  -9.342  -1.459   1.742
  252   2HG   PRO  38          1HG       PRO  38  -9.570  -1.422   3.498
  253   1HD   PRO  38          2HD       PRO  38  -7.266  -0.647   2.359
  254   2HD   PRO  38          1HD       PRO  38  -7.303  -1.476   3.932
  255    H    VAL  39           H        VAL  39  -7.828  -2.136   0.199
  256    HA   VAL  39           HA       VAL  39  -9.033  -3.613  -1.929
  257    HB   VAL  39           HB       VAL  39  -7.413  -1.134  -1.534
  258   1HG1  VAL  39          1HG1      VAL  39  -6.439  -2.200  -3.582
  259   2HG1  VAL  39          2HG1      VAL  39  -7.252  -0.671  -3.906
  260   3HG1  VAL  39          3HG1      VAL  39  -8.051  -2.195  -4.298
  261   1HG2  VAL  39          1HG2      VAL  39  -9.381  -0.142  -2.652
  262   2HG2  VAL  39          2HG2      VAL  39  -9.846  -1.124  -1.265
  263   3HG2  VAL  39          3HG2      VAL  39 -10.043  -1.757  -2.901
  264    H    LEU  40           H        LEU  40  -5.759  -3.479  -0.687
  265    HA   LEU  40           HA       LEU  40  -4.679  -4.960  -3.026
  266   1HB   LEU  40          2HB       LEU  40  -3.319  -4.002  -0.491
  267   2HB   LEU  40          1HB       LEU  40  -2.547  -4.422  -2.020
  268    HG   LEU  40           HG       LEU  40  -4.528  -2.163  -1.667
  269   1HD1  LEU  40          1HD1      LEU  40  -2.763  -1.085  -0.739
  270   2HD1  LEU  40          2HD1      LEU  40  -2.072  -1.088  -2.363
  271   3HD1  LEU  40          3HD1      LEU  40  -1.638  -2.356  -1.216
  272   1HD2  LEU  40          1HD2      LEU  40  -2.647  -2.737  -3.963
  273   2HD2  LEU  40          2HD2      LEU  40  -3.971  -1.573  -3.919
  274   3HD2  LEU  40          3HD2      LEU  40  -4.318  -3.302  -3.932
  275    H    LEU  41           H        LEU  41  -5.571  -5.408   0.342
  276    HA   LEU  41           HA       LEU  41  -4.243  -7.950   0.733
  277   1HB   LEU  41          2HB       LEU  41  -6.557  -6.496   2.039
  278   2HB   LEU  41          1HB       LEU  41  -5.920  -8.022   2.652
  279    HG   LEU  41           HG       LEU  41  -4.191  -5.586   2.184
  280   1HD1  LEU  41          1HD1      LEU  41  -5.719  -6.501   4.623
  281   2HD1  LEU  41          2HD1      LEU  41  -5.723  -4.905   3.873
  282   3HD1  LEU  41          3HD1      LEU  41  -4.296  -5.468   4.748
  283   1HD2  LEU  41          1HD2      LEU  41  -2.483  -6.894   2.914
  284   2HD2  LEU  41          2HD2      LEU  41  -3.558  -8.253   2.573
  285   3HD2  LEU  41          3HD2      LEU  41  -3.463  -7.590   4.205
  286    H    ASN  42           H        ASN  42  -7.019  -6.926  -0.994
  287    HA   ASN  42           HA       ASN  42  -8.446  -9.466  -0.789
  288   1HB   ASN  42          2HB       ASN  42  -9.562  -7.268  -1.044
  289   2HB   ASN  42          1HB       ASN  42  -8.776  -7.058  -2.609
  290   1HD2  ASN  42          1HD2      ASN  42 -11.229  -6.951  -3.254
  291   2HD2  ASN  42          2HD2      ASN  42 -11.966  -8.428  -3.650
  292    H    SER  43           H        SER  43  -5.810  -8.283  -2.581
  293    HA   SER  43           HA       SER  43  -6.285  -9.818  -5.034
  294   1HB   SER  43          2HB       SER  43  -4.423  -8.660  -5.775
  295   2HB   SER  43          1HB       SER  43  -4.891  -7.605  -4.444
  296    HG   SER  43           HG       SER  43  -2.832  -8.025  -3.982
  297    H    LYS  44           H        LYS  44  -5.707 -10.863  -2.019
  298    HA   LYS  44           HA       LYS  44  -4.846 -12.882  -1.152
  299   1HB   LYS  44          2HB       LYS  44  -5.308 -13.223  -4.028
  300   2HB   LYS  44          1HB       LYS  44  -4.079 -14.319  -3.399
  301   1HG   LYS  44          2HG       LYS  44  -5.672 -15.592  -2.454
  302   2HG   LYS  44          1HG       LYS  44  -6.237 -14.208  -1.519
  303   1HD   LYS  44          2HD       LYS  44  -8.117 -14.208  -2.752
  304   2HD   LYS  44          1HD       LYS  44  -7.140 -13.775  -4.157
  305   1HE   LYS  44          2HE       LYS  44  -6.844 -16.076  -4.777
  306   2HE   LYS  44          1HE       LYS  44  -7.508 -16.641  -3.230
  307   1HZ   LYS  44          1HZ       LYS  44  -8.949 -15.099  -5.323
  308   2HZ   LYS  44          2HZ       LYS  44  -9.582 -15.453  -3.786
  309   3HZ   LYS  44          3HZ       LYS  44  -9.238 -16.709  -4.877
  310    H    LEU  45           H        LEU  45  -3.051 -10.529  -2.375
  311    HA   LEU  45           HA       LEU  45  -0.470 -11.941  -2.696
  312   1HB   LEU  45          2HB       LEU  45  -1.556  -9.158  -2.941
  313   2HB   LEU  45          1HB       LEU  45   0.182  -9.364  -2.733
  314    HG   LEU  45           HG       LEU  45  -1.486 -10.696  -4.887
  315   1HD1  LEU  45          1HD1      LEU  45   0.660  -8.712  -5.471
  316   2HD1  LEU  45          2HD1      LEU  45  -0.861  -8.082  -4.836
  317   3HD1  LEU  45          3HD1      LEU  45  -0.849  -9.017  -6.329
  318   1HD2  LEU  45          1HD2      LEU  45   1.458 -10.517  -5.105
  319   2HD2  LEU  45          2HD2      LEU  45   0.385 -11.860  -5.490
  320   3HD2  LEU  45          3HD2      LEU  45   0.884 -11.579  -3.823
  321    HA   PRO  46           HA       PRO  46   0.705 -11.408   1.498
  322   1HB   PRO  46          2HB       PRO  46   3.424 -11.213   1.229
  323   2HB   PRO  46          1HB       PRO  46   2.540 -12.739   1.039
  324   1HG   PRO  46          2HG       PRO  46   3.654 -10.933  -1.023
  325   2HG   PRO  46          1HG       PRO  46   3.527 -12.696  -1.012
  326   1HD   PRO  46          2HD       PRO  46   1.837 -11.022  -2.397
  327   2HD   PRO  46          1HD       PRO  46   1.429 -12.675  -1.898
  328    H    VAL  47           H        VAL  47   1.866  -9.765   2.914
  329    HA   VAL  47           HA       VAL  47   1.176  -7.082   2.221
  330    HB   VAL  47           HB       VAL  47   2.636  -8.571   4.387
  331   1HG1  VAL  47          1HG1      VAL  47   2.233  -5.606   4.636
  332   2HG1  VAL  47          2HG1      VAL  47   3.715  -6.225   3.912
  333   3HG1  VAL  47          3HG1      VAL  47   3.291  -6.662   5.561
  334   1HG2  VAL  47          1HG2      VAL  47   0.706  -7.054   5.554
  335   2HG2  VAL  47          2HG2      VAL  47   0.422  -8.670   4.911
  336   3HG2  VAL  47          3HG2      VAL  47   0.026  -7.254   3.939
  337    H    ASP  48           H        ASP  48   3.789  -9.016   1.266
  338    HA   ASP  48           HA       ASP  48   5.835  -6.961   1.223
  339   1HB   ASP  48          2HB       ASP  48   5.456  -9.768   0.252
  340   2HB   ASP  48          1HB       ASP  48   6.809  -8.827  -0.374
  341    H    ILE  49           H        ILE  49   3.390  -8.221  -0.986
  342    HA   ILE  49           HA       ILE  49   4.432  -6.691  -3.268
  343    HB   ILE  49           HB       ILE  49   1.670  -7.873  -3.042
  344   1HG1  ILE  49          2HG1      ILE  49   3.109  -9.606  -2.134
  345   2HG1  ILE  49          1HG1      ILE  49   2.669 -10.052  -3.778
  346   1HG2  ILE  49          1HG2      ILE  49   1.820  -7.057  -5.166
  347   2HG2  ILE  49          2HG2      ILE  49   2.697  -8.558  -5.469
  348   3HG2  ILE  49          3HG2      ILE  49   3.584  -7.065  -5.151
  349   1HD1  ILE  49          1HD1      ILE  49   4.992 -10.438  -3.685
  350   2HD1  ILE  49          2HD1      ILE  49   5.288  -8.953  -2.780
  351   3HD1  ILE  49          3HD1      ILE  49   4.847  -8.874  -4.488
  352    H    LEU  50           H        LEU  50   1.754  -6.564  -0.973
  353    HA   LEU  50           HA       LEU  50   0.517  -4.177  -2.007
  354   1HB   LEU  50          2HB       LEU  50   0.563  -5.164   0.848
  355   2HB   LEU  50          1HB       LEU  50  -0.733  -4.298   0.026
  356    HG   LEU  50           HG       LEU  50   0.150  -7.157  -0.394
  357   1HD1  LEU  50          1HD1      LEU  50  -2.313  -7.528  -0.024
  358   2HD1  LEU  50          2HD1      LEU  50  -2.450  -5.812   0.365
  359   3HD1  LEU  50          3HD1      LEU  50  -1.456  -6.870   1.370
  360   1HD2  LEU  50          1HD2      LEU  50  -0.358  -6.918  -2.582
  361   2HD2  LEU  50          2HD2      LEU  50  -0.945  -5.275  -2.328
  362   3HD2  LEU  50          3HD2      LEU  50  -2.025  -6.645  -2.076
  363    H    GLY  51           H        GLY  51   3.170  -4.858   0.192
  364   1HA   GLY  51          2HA       GLY  51   3.371  -2.175   1.265
  365   2HA   GLY  51          1HA       GLY  51   4.634  -3.405   1.337
  366    H    ARG  52           H        ARG  52   4.324  -3.776  -1.618
  367    HA   ARG  52           HA       ARG  52   6.116  -1.549  -2.435
  368   1HB   ARG  52          2HB       ARG  52   6.797  -3.952  -2.535
  369   2HB   ARG  52          1HB       ARG  52   5.510  -4.222  -3.708
  370   1HG   ARG  52          2HG       ARG  52   6.535  -2.811  -5.320
  371   2HG   ARG  52          1HG       ARG  52   7.633  -2.117  -4.124
  372   1HD   ARG  52          2HD       ARG  52   8.628  -3.906  -5.698
  373   2HD   ARG  52          1HD       ARG  52   8.891  -4.157  -3.962
  374    HE   ARG  52           HE       ARG  52   6.486  -5.381  -5.211
  375   1HH1  ARG  52          1HH2      ARG  52   8.911  -6.928  -5.958
  376   2HH1  ARG  52          2HH2      ARG  52   9.067  -8.042  -4.641
  377   1HH2  ARG  52          2HH1      ARG  52   6.963  -6.259  -2.538
  378   2HH2  ARG  52          1HH1      ARG  52   7.964  -7.663  -2.703
  379    H    VAL  53           H        VAL  53   3.053  -3.170  -3.322
  380    HA   VAL  53           HA       VAL  53   2.761  -1.791  -5.850
  381    HB   VAL  53           HB       VAL  53   0.924  -3.202  -3.907
  382   1HG1  VAL  53          1HG1      VAL  53   0.008  -1.177  -5.572
  383   2HG1  VAL  53          2HG1      VAL  53  -0.964  -2.514  -4.967
  384   3HG1  VAL  53          3HG1      VAL  53  -0.206  -2.621  -6.554
  385   1HG2  VAL  53          1HG2      VAL  53   2.623  -4.314  -5.539
  386   2HG2  VAL  53          2HG2      VAL  53   1.478  -3.855  -6.806
  387   3HG2  VAL  53          3HG2      VAL  53   0.972  -4.936  -5.504
  388    H    TRP  54           H        TRP  54   1.698  -1.075  -2.530
  389    HA   TRP  54           HA       TRP  54   0.201   1.283  -3.145
  390   1HB   TRP  54          2HB       TRP  54  -0.059   0.377  -0.977
  391   2HB   TRP  54          1HB       TRP  54   1.683   0.205  -0.748
  392    HD1  TRP  54           HD1      TRP  54   3.097   2.527  -0.492
  393    HE1  TRP  54           HE1      TRP  54   2.411   4.777   0.532
  394    HE3  TRP  54           HE3      TRP  54  -1.975   1.955  -0.442
  395    HZ2  TRP  54           HZ2      TRP  54   0.023   6.148   1.319
  396    HZ3  TRP  54           HZ3      TRP  54  -3.426   3.757   0.464
  397    HH2  TRP  54           HH2      TRP  54  -2.438   5.826   1.335
  398    H    GLU  55           H        GLU  55   3.611   0.891  -2.069
  399    HA   GLU  55           HA       GLU  55   4.367   3.585  -2.062
  400   1HB   GLU  55          2HB       GLU  55   5.825   1.053  -2.811
  401   2HB   GLU  55          1HB       GLU  55   6.642   2.606  -2.634
  402   1HG   GLU  55          2HG       GLU  55   5.389   2.683  -0.330
  403   2HG   GLU  55          1HG       GLU  55   5.299   0.937  -0.545
  404    H    LEU  56           H        LEU  56   4.847   1.364  -4.838
  405    HA   LEU  56           HA       LEU  56   5.547   3.444  -6.680
  406   1HB   LEU  56          2HB       LEU  56   4.244   0.735  -7.136
  407   2HB   LEU  56          1HB       LEU  56   5.061   1.693  -8.371
  408    HG   LEU  56           HG       LEU  56   6.675   1.265  -5.945
  409   1HD1  LEU  56          1HD1      LEU  56   6.949  -1.036  -6.056
  410   2HD1  LEU  56          2HD1      LEU  56   6.423  -1.119  -7.738
  411   3HD1  LEU  56          3HD1      LEU  56   5.236  -0.908  -6.453
  412   1HD2  LEU  56          1HD2      LEU  56   7.680   0.289  -8.520
  413   2HD2  LEU  56          2HD2      LEU  56   8.337   1.548  -7.474
  414   3HD2  LEU  56          3HD2      LEU  56   7.058   1.933  -8.623
  415    H    SER  57           H        SER  57   2.570   2.566  -5.233
  416    HA   SER  57           HA       SER  57   0.869   3.748  -7.354
  417   1HB   SER  57          2HB       SER  57   0.421   2.405  -4.679
  418   2HB   SER  57          1HB       SER  57  -0.899   3.113  -5.606
  419    HG   SER  57           HG       SER  57   0.775   0.934  -6.219
  420    H    ASP  58           H        ASP  58   2.197   4.486  -4.181
  421    HA   ASP  58           HA       ASP  58   0.587   6.875  -3.718
  422   1HB   ASP  58          2HB       ASP  58   2.050   5.166  -2.202
  423   2HB   ASP  58          1HB       ASP  58   3.220   6.472  -2.401
  424    H    ILE  59           H        ILE  59   0.914   8.314  -5.486
  425    HA   ILE  59           HA       ILE  59   3.511   8.891  -6.617
  426    HB   ILE  59           HB       ILE  59   0.928  10.482  -6.618
  427   1HG1  ILE  59          2HG1      ILE  59   0.735   8.056  -7.324
  428   2HG1  ILE  59          1HG1      ILE  59   0.316   9.218  -8.584
  429   1HG2  ILE  59          1HG2      ILE  59   3.389  10.485  -8.374
  430   2HG2  ILE  59          2HG2      ILE  59   2.679  11.842  -7.499
  431   3HG2  ILE  59          3HG2      ILE  59   1.850  11.166  -8.901
  432   1HD1  ILE  59          1HD1      ILE  59   3.096   8.061  -8.311
  433   2HD1  ILE  59          2HD1      ILE  59   2.408   8.926  -9.687
  434   3HD1  ILE  59          3HD1      ILE  59   1.845   7.301  -9.298
  435    H    ASP  60           H        ASP  60   1.505  10.464  -4.127
  436    HA   ASP  60           HA       ASP  60   3.627  12.513  -3.702
  437   1HB   ASP  60          2HB       ASP  60   1.841  13.568  -2.322
  438   2HB   ASP  60          1HB       ASP  60   1.283  13.218  -3.959
  439    H    HIS  61           H        HIS  61   2.524   9.527  -2.416
  440    HA   HIS  61           HA       HIS  61   3.194   8.325  -0.494
  441   1HB   HIS  61          2HB       HIS  61   5.279  10.340  -1.077
  442   2HB   HIS  61          1HB       HIS  61   5.317   9.653   0.545
  443    HD1  HIS  61           HD1      HIS  61   6.333   7.377   0.778
  444    HD2  HIS  61           HD2      HIS  61   5.321   8.230  -3.175
  445    HE1  HIS  61           HE1      HIS  61   7.222   5.461  -0.618
  446    H    ASP  62           H        ASP  62   1.098  10.263  -0.183
  447    HA   ASP  62           HA       ASP  62   1.682  11.610   2.403
  448   1HB   ASP  62          2HB       ASP  62  -0.316  12.844   1.918
  449   2HB   ASP  62          1HB       ASP  62   0.524  12.677   0.377
  450    H    GLY  63           H        GLY  63   1.054   8.576   1.681
  451   1HA   GLY  63          2HA       GLY  63   0.209   6.838   3.043
  452   2HA   GLY  63          1HA       GLY  63  -0.397   8.058   4.164
  453    H    MET  64           H        MET  64  -1.191   8.387   0.807
  454    HA   MET  64           HA       MET  64  -3.825   7.059   1.135
  455   1HB   MET  64          2HB       MET  64  -3.543   9.980   0.348
  456   2HB   MET  64          1HB       MET  64  -5.043   9.083   0.521
  457   1HG   MET  64          2HG       MET  64  -3.462   8.968   2.958
  458   2HG   MET  64          1HG       MET  64  -3.791  10.624   2.480
  459   1HE   MET  64          1HE       MET  64  -6.851   9.594   0.859
  460   2HE   MET  64          2HE       MET  64  -6.009  11.083   1.279
  461   3HE   MET  64          3HE       MET  64  -7.564  10.722   2.021
  462    H    LEU  65           H        LEU  65  -4.963   6.918  -0.998
  463    HA   LEU  65           HA       LEU  65  -3.060   7.197  -3.299
  464   1HB   LEU  65          2HB       LEU  65  -4.779   5.015  -2.280
  465   2HB   LEU  65          1HB       LEU  65  -4.847   5.246  -4.023
  466    HG   LEU  65           HG       LEU  65  -2.426   4.622  -2.324
  467   1HD1  LEU  65          1HD1      LEU  65  -4.223   3.043  -3.750
  468   2HD1  LEU  65          2HD1      LEU  65  -2.610   2.556  -3.226
  469   3HD1  LEU  65          3HD1      LEU  65  -2.850   3.209  -4.846
  470   1HD2  LEU  65          1HD2      LEU  65  -1.287   4.755  -4.687
  471   2HD2  LEU  65          2HD2      LEU  65  -1.510   6.236  -3.754
  472   3HD2  LEU  65          3HD2      LEU  65  -2.622   5.844  -5.068
  473    H    ASP  66           H        ASP  66  -3.795   8.827  -4.632
  474    HA   ASP  66           HA       ASP  66  -6.565   9.728  -4.585
  475   1HB   ASP  66          2HB       ASP  66  -4.935  11.374  -4.974
  476   2HB   ASP  66          1HB       ASP  66  -4.054  10.364  -6.114
  477    H    ARG  67           H        ARG  67  -7.705   9.974  -6.782
  478    HA   ARG  67           HA       ARG  67  -8.476   7.479  -7.818
  479   1HB   ARG  67          2HB       ARG  67  -9.324   8.901  -9.739
  480   2HB   ARG  67          1HB       ARG  67  -9.784   9.474  -8.137
  481   1HG   ARG  67          2HG       ARG  67  -8.135  11.194  -8.168
  482   2HG   ARG  67          1HG       ARG  67  -7.318  10.485  -9.562
  483   1HD   ARG  67          2HD       ARG  67  -9.957  10.879 -10.434
  484   2HD   ARG  67          1HD       ARG  67  -9.554  12.347  -9.522
  485    HE   ARG  67           HE       ARG  67  -7.273  11.897 -11.002
  486   1HH1  ARG  67          1HH2      ARG  67  -8.781  10.537 -13.106
  487   2HH1  ARG  67          2HH2      ARG  67  -9.355  11.838 -14.096
  488   1HH2  ARG  67          2HH1      ARG  67  -8.816  14.268 -11.682
  489   2HH2  ARG  67          1HH1      ARG  67  -9.374  13.950 -13.290
  490    H    ASP  68           H        ASP  68  -5.845   9.596  -8.890
  491    HA   ASP  68           HA       ASP  68  -5.252   7.892 -11.225
  492   1HB   ASP  68          2HB       ASP  68  -4.323  10.467 -10.017
  493   2HB   ASP  68          1HB       ASP  68  -3.226   9.635 -11.120
  494    H    GLU  69           H        GLU  69  -4.040   8.462  -7.970
  495    HA   GLU  69           HA       GLU  69  -1.598   6.882  -8.333
  496   1HB   GLU  69          2HB       GLU  69  -3.021   7.636  -5.772
  497   2HB   GLU  69          1HB       GLU  69  -1.300   7.333  -5.990
  498   1HG   GLU  69          2HG       GLU  69  -1.094   9.323  -7.391
  499   2HG   GLU  69          1HG       GLU  69  -2.826   9.615  -7.272
  500    H    PHE  70           H        PHE  70  -4.831   6.426  -6.981
  501    HA   PHE  70           HA       PHE  70  -4.462   3.794  -5.926
  502   1HB   PHE  70          2HB       PHE  70  -6.346   5.431  -5.517
  503   2HB   PHE  70          1HB       PHE  70  -6.942   5.062  -7.136
  504    HD1  PHE  70           HD1      PHE  70  -6.621   3.886  -3.699
  505    HD2  PHE  70           HD2      PHE  70  -7.718   2.761  -7.698
  506    HE1  PHE  70           HE1      PHE  70  -7.759   1.871  -2.819
  507    HE2  PHE  70           HE2      PHE  70  -8.856   0.743  -6.814
  508    HZ   PHE  70           HZ       PHE  70  -8.871   0.301  -4.375
  509    H    ALA  71           H        ALA  71  -5.075   5.053  -9.144
  510    HA   ALA  71           HA       ALA  71  -5.930   2.623 -10.413
  511   1HB   ALA  71          1HB       ALA  71  -6.038   5.043 -11.215
  512   2HB   ALA  71          2HB       ALA  71  -5.512   3.876 -12.427
  513   3HB   ALA  71          3HB       ALA  71  -4.326   4.894 -11.611
  514    H    VAL  72           H        VAL  72  -2.721   4.127 -10.129
  515    HA   VAL  72           HA       VAL  72  -1.235   2.150 -11.547
  516    HB   VAL  72           HB       VAL  72  -0.482   3.904  -9.190
  517   1HG1  VAL  72          1HG1      VAL  72   1.163   2.105  -9.734
  518   2HG1  VAL  72          2HG1      VAL  72   1.802   3.722 -10.033
  519   3HG1  VAL  72          3HG1      VAL  72   1.253   2.727 -11.382
  520   1HG2  VAL  72          1HG2      VAL  72   0.102   5.591 -10.811
  521   2HG2  VAL  72          2HG2      VAL  72  -1.531   5.052 -11.206
  522   3HG2  VAL  72          3HG2      VAL  72  -0.160   4.474 -12.151
  523    H    ALA  73           H        ALA  73  -2.702   2.089  -8.399
  524    HA   ALA  73           HA       ALA  73  -0.984  -0.087  -7.380
  525   1HB   ALA  73          1HB       ALA  73  -1.893   0.530  -5.367
  526   2HB   ALA  73          2HB       ALA  73  -3.514   0.710  -6.044
  527   3HB   ALA  73          3HB       ALA  73  -2.314   1.990  -6.265
  528    H    MET  74           H        MET  74  -3.883   0.147  -9.246
  529    HA   MET  74           HA       MET  74  -4.983  -2.410  -8.262
  530   1HB   MET  74          2HB       MET  74  -5.819  -0.936 -10.756
  531   2HB   MET  74          1HB       MET  74  -6.814  -1.892  -9.663
  532   1HG   MET  74          2HG       MET  74  -5.757   0.899  -9.303
  533   2HG   MET  74          1HG       MET  74  -7.401   0.307  -9.100
  534   1HE   MET  74          1HE       MET  74  -7.400  -1.986  -7.891
  535   2HE   MET  74          2HE       MET  74  -7.592  -1.684  -6.167
  536   3HE   MET  74          3HE       MET  74  -6.143  -2.496  -6.754
  537    H    PHE  75           H        PHE  75  -3.345  -1.244 -11.210
  538    HA   PHE  75           HA       PHE  75  -3.420  -3.905 -12.423
  539   1HB   PHE  75          2HB       PHE  75  -2.513  -2.798 -14.264
  540   2HB   PHE  75          1HB       PHE  75  -3.258  -1.438 -13.429
  541    HD1  PHE  75           HD1      PHE  75  -0.163  -2.934 -14.555
  542    HD2  PHE  75           HD2      PHE  75  -1.843  -0.004 -11.904
  543    HE1  PHE  75           HE1      PHE  75   2.057  -1.852 -14.343
  544    HE2  PHE  75           HE2      PHE  75   0.370   1.080 -11.697
  545    HZ   PHE  75           HZ       PHE  75   2.324   0.157 -12.918
  546    H    LEU  76           H        LEU  76  -1.348  -2.095 -10.299
  547    HA   LEU  76           HA       LEU  76   1.058  -3.678 -10.612
  548   1HB   LEU  76          2HB       LEU  76  -0.064  -1.566  -8.866
  549   2HB   LEU  76          1HB       LEU  76   1.164  -2.584  -8.115
  550    HG   LEU  76           HG       LEU  76   1.477  -1.119 -10.751
  551   1HD1  LEU  76          1HD1      LEU  76   1.645  -0.129  -8.139
  552   2HD1  LEU  76          2HD1      LEU  76   2.314   0.623  -9.589
  553   3HD1  LEU  76          3HD1      LEU  76   3.317  -0.442  -8.603
  554   1HD2  LEU  76          1HD2      LEU  76   2.846  -3.366  -9.632
  555   2HD2  LEU  76          2HD2      LEU  76   3.937  -1.982  -9.574
  556   3HD2  LEU  76          3HD2      LEU  76   3.231  -2.485 -11.110
  557    H    VAL  77           H        VAL  77  -1.957  -4.056  -8.959
  558    HA   VAL  77           HA       VAL  77  -0.949  -6.195  -7.181
  559    HB   VAL  77           HB       VAL  77  -3.589  -4.761  -7.637
  560   1HG1  VAL  77          1HG1      VAL  77  -4.459  -6.776  -6.911
  561   2HG1  VAL  77          2HG1      VAL  77  -4.038  -6.079  -5.346
  562   3HG1  VAL  77          3HG1      VAL  77  -2.963  -7.255  -6.106
  563   1HG2  VAL  77          1HG2      VAL  77  -3.157  -3.925  -5.371
  564   2HG2  VAL  77          2HG2      VAL  77  -1.800  -3.553  -6.430
  565   3HG2  VAL  77          3HG2      VAL  77  -1.680  -4.883  -5.280
  566    H    TYR  78           H        TYR  78  -3.648  -5.865  -9.503
  567    HA   TYR  78           HA       TYR  78  -4.286  -8.542  -9.854
  568   1HB   TYR  78          2HB       TYR  78  -4.429  -6.038 -11.423
  569   2HB   TYR  78          1HB       TYR  78  -4.641  -7.523 -12.352
  570    HD1  TYR  78           HD1      TYR  78  -6.474  -5.090 -10.833
  571    HD2  TYR  78           HD2      TYR  78  -6.033  -9.361 -10.744
  572    HE1  TYR  78           HE1      TYR  78  -8.786  -5.308  -9.961
  573    HE2  TYR  78           HE2      TYR  78  -8.344  -9.581  -9.873
  574    HH   TYR  78           HH       TYR  78 -10.127  -8.491  -9.096
  575    H    CYS  79           H        CYS  79  -1.397  -6.930 -10.944
  576    HA   CYS  79           HA       CYS  79  -0.745  -8.966 -12.965
  577   1HB   CYS  79          2HB       CYS  79   0.526  -6.501 -11.783
  578   2HB   CYS  79          1HB       CYS  79   1.471  -7.578 -12.811
  579    HG   CYS  79           HG       CYS  79   0.323  -6.625 -14.782
  580    H    ALA  80           H        ALA  80  -0.390  -8.609  -9.554
  581    HA   ALA  80           HA       ALA  80   2.003 -10.330  -9.396
  582   1HB   ALA  80          1HB       ALA  80   1.019 -10.008  -6.852
  583   2HB   ALA  80          2HB       ALA  80   0.391  -8.570  -7.660
  584   3HB   ALA  80          3HB       ALA  80   2.127  -8.883  -7.637
  585    H    LEU  81           H        LEU  81  -1.390 -10.653  -9.551
  586    HA   LEU  81           HA       LEU  81  -1.476 -13.232  -8.102
  587   1HB   LEU  81          2HB       LEU  81  -3.504 -11.560  -9.613
  588   2HB   LEU  81          1HB       LEU  81  -3.900 -13.071  -8.790
  589    HG   LEU  81           HG       LEU  81  -2.867 -12.026  -6.699
  590   1HD1  LEU  81          1HD1      LEU  81  -1.640 -10.213  -7.487
  591   2HD1  LEU  81          2HD1      LEU  81  -3.096  -9.437  -6.861
  592   3HD1  LEU  81          3HD1      LEU  81  -2.914  -9.709  -8.596
  593   1HD2  LEU  81          1HD2      LEU  81  -5.430 -11.294  -8.034
  594   2HD2  LEU  81          2HD2      LEU  81  -4.982 -10.359  -6.607
  595   3HD2  LEU  81          3HD2      LEU  81  -5.162 -12.109  -6.493
  596    H    GLU  82           H        GLU  82  -1.703 -11.929 -11.373
  597    HA   GLU  82           HA       GLU  82  -2.270 -14.419 -12.712
  598   1HB   GLU  82          2HB       GLU  82  -1.923 -11.650 -13.267
  599   2HB   GLU  82          1HB       GLU  82  -0.800 -12.523 -14.308
  600   1HG   GLU  82          2HG       GLU  82  -3.075 -12.192 -15.322
  601   2HG   GLU  82          1HG       GLU  82  -2.587 -13.883 -15.204
  602    H    LYS  83           H        LYS  83   0.718 -12.487 -12.535
  603    HA   LYS  83           HA       LYS  83   2.468 -14.656 -11.922
  604   1HB   LYS  83          2HB       LYS  83   1.850 -15.647 -13.984
  605   2HB   LYS  83          1HB       LYS  83   1.869 -14.099 -14.828
  606   1HG   LYS  83          2HG       LYS  83   4.063 -14.298 -15.303
  607   2HG   LYS  83          1HG       LYS  83   4.452 -14.668 -13.624
  608   1HD   LYS  83          2HD       LYS  83   3.298 -17.000 -14.311
  609   2HD   LYS  83          1HD       LYS  83   3.912 -16.514 -15.892
  610   1HE   LYS  83          2HE       LYS  83   6.172 -16.153 -14.844
  611   2HE   LYS  83          1HE       LYS  83   5.525 -16.837 -13.339
  612   1HZ   LYS  83          1HZ       LYS  83   5.163 -18.880 -14.307
  613   2HZ   LYS  83          2HZ       LYS  83   6.607 -18.410 -15.067
  614   3HZ   LYS  83          3HZ       LYS  83   5.125 -18.257 -15.885
  615    H    GLU  84           H        GLU  84   1.960 -11.478 -13.298
  616    HA   GLU  84           HA       GLU  84   4.743 -10.747 -13.568
  617   1HB   GLU  84          2HB       GLU  84   2.055  -9.460 -13.623
  618   2HB   GLU  84          1HB       GLU  84   3.448  -8.402 -13.392
  619   1HG   GLU  84          2HG       GLU  84   3.451 -10.480 -15.573
  620   2HG   GLU  84          1HG       GLU  84   2.682  -8.911 -15.827
  621    HA   PRO  85           HA       PRO  85   5.323 -10.195  -9.157
  622   1HB   PRO  85          2HB       PRO  85   7.984  -9.567  -9.331
  623   2HB   PRO  85          1HB       PRO  85   7.380 -11.234  -9.411
  624   1HG   PRO  85          2HG       PRO  85   8.230  -9.420 -11.613
  625   2HG   PRO  85          1HG       PRO  85   8.489 -11.161 -11.419
  626   1HD   PRO  85          2HD       PRO  85   6.581 -10.099 -13.052
  627   2HD   PRO  85          1HD       PRO  85   6.436 -11.696 -12.285
  628    H    VAL  86           H        VAL  86   6.218  -8.243  -7.854
  629    HA   VAL  86           HA       VAL  86   5.667  -5.736  -9.403
  630    HB   VAL  86           HB       VAL  86   5.430  -6.317  -6.436
  631   1HG1  VAL  86          1HG1      VAL  86   5.754  -3.911  -7.276
  632   2HG1  VAL  86          2HG1      VAL  86   4.331  -4.212  -6.280
  633   3HG1  VAL  86          3HG1      VAL  86   4.169  -4.080  -8.031
  634   1HG2  VAL  86          1HG2      VAL  86   3.341  -6.284  -8.638
  635   2HG2  VAL  86          2HG2      VAL  86   2.978  -6.374  -6.915
  636   3HG2  VAL  86          3HG2      VAL  86   3.849  -7.691  -7.702
  637    HA   PRO  87           HA       PRO  87   9.892  -4.845  -8.265
  638   1HB   PRO  87          2HB       PRO  87  10.201  -2.763 -10.011
  639   2HB   PRO  87          1HB       PRO  87  10.281  -4.460 -10.518
  640   1HG   PRO  87          2HG       PRO  87   8.173  -2.473 -10.969
  641   2HG   PRO  87          1HG       PRO  87   8.542  -3.951 -11.864
  642   1HD   PRO  87          2HD       PRO  87   6.485  -3.549  -9.937
  643   2HD   PRO  87          1HD       PRO  87   6.913  -5.060 -10.770
  644    H    MET  88           H        MET  88  10.965  -2.672  -7.529
  645    HA   MET  88           HA       MET  88   8.921  -1.114  -5.988
  646   1HB   MET  88          2HB       MET  88  11.914  -1.469  -5.701
  647   2HB   MET  88          1HB       MET  88  10.901  -0.524  -4.612
  648   1HG   MET  88          2HG       MET  88   9.724  -2.461  -3.861
  649   2HG   MET  88          1HG       MET  88  10.362  -3.446  -5.178
  650   1HE   MET  88          1HE       MET  88  13.807  -3.973  -4.768
  651   2HE   MET  88          2HE       MET  88  12.258  -4.198  -5.576
  652   3HE   MET  88          3HE       MET  88  12.712  -5.262  -4.247
  653    H    SER  89           H        SER  89  10.089  -0.764  -8.902
  654    HA   SER  89           HA       SER  89  11.067   2.032  -8.492
  655   1HB   SER  89          2HB       SER  89  11.411   0.109 -10.791
  656   2HB   SER  89          1HB       SER  89  12.149   1.701 -10.665
  657    HG   SER  89           HG       SER  89  13.265  -0.415  -9.885
  658    H    LEU  90           H        LEU  90   9.192   3.196  -8.577
  659    HA   LEU  90           HA       LEU  90   6.946   2.793 -10.268
  660   1HB   LEU  90          2HB       LEU  90   7.985   4.742  -8.464
  661   2HB   LEU  90          1HB       LEU  90   7.507   5.595  -9.934
  662    HG   LEU  90           HG       LEU  90   5.730   3.591  -8.521
  663   1HD1  LEU  90          1HD1      LEU  90   6.459   6.103  -7.561
  664   2HD1  LEU  90          2HD1      LEU  90   5.020   5.194  -7.098
  665   3HD1  LEU  90          3HD1      LEU  90   4.928   6.395  -8.386
  666   1HD2  LEU  90          1HD2      LEU  90   4.633   5.748 -10.222
  667   2HD2  LEU  90          2HD2      LEU  90   4.194   4.042 -10.144
  668   3HD2  LEU  90          3HD2      LEU  90   5.601   4.548 -11.079
  669    HA   PRO  91           HA       PRO  91   9.278   3.462 -14.073
  670   1HB   PRO  91          2HB       PRO  91   7.227   2.657 -15.713
  671   2HB   PRO  91          1HB       PRO  91   8.326   1.526 -14.893
  672   1HG   PRO  91          2HG       PRO  91   5.585   2.399 -14.103
  673   2HG   PRO  91          1HG       PRO  91   6.293   0.777 -14.083
  674   1HD   PRO  91          2HD       PRO  91   6.061   2.250 -11.848
  675   2HD   PRO  91          1HD       PRO  91   7.445   1.163 -12.114
  676    HA   PRO  92           HA       PRO  92   7.737   7.404 -15.190
  677   1HB   PRO  92          2HB       PRO  92   8.577   7.591 -17.786
  678   2HB   PRO  92          1HB       PRO  92   9.682   7.687 -16.400
  679   1HG   PRO  92          2HG       PRO  92   9.126   5.404 -18.222
  680   2HG   PRO  92          1HG       PRO  92  10.652   5.916 -17.486
  681   1HD   PRO  92          2HD       PRO  92   9.140   3.824 -16.573
  682   2HD   PRO  92          1HD       PRO  92  10.255   4.762 -15.555
  683    H    ALA  93           H        ALA  93   6.784   4.654 -17.155
  684    HA   ALA  93           HA       ALA  93   4.733   6.143 -18.636
  685   1HB   ALA  93          1HB       ALA  93   6.118   3.667 -18.782
  686   2HB   ALA  93          2HB       ALA  93   4.955   4.311 -19.940
  687   3HB   ALA  93          3HB       ALA  93   4.406   3.276 -18.621
  688    H    LEU  94           H        LEU  94   4.960   5.269 -15.476
  689    HA   LEU  94           HA       LEU  94   2.096   4.460 -15.245
  690   1HB   LEU  94          2HB       LEU  94   4.618   4.058 -13.683
  691   2HB   LEU  94          1HB       LEU  94   3.092   4.052 -12.798
  692    HG   LEU  94           HG       LEU  94   3.823   1.779 -13.605
  693   1HD1  LEU  94          1HD1      LEU  94   1.229   3.013 -14.543
  694   2HD1  LEU  94          2HD1      LEU  94   1.509   2.022 -13.113
  695   3HD1  LEU  94          3HD1      LEU  94   1.560   1.291 -14.716
  696   1HD2  LEU  94          1HD2      LEU  94   4.791   2.627 -15.754
  697   2HD2  LEU  94          2HD2      LEU  94   3.156   2.954 -16.318
  698   3HD2  LEU  94          3HD2      LEU  94   3.657   1.297 -15.991
  699    H    VAL  95           H        VAL  95   4.095   7.155 -14.990
  700    HA   VAL  95           HA       VAL  95   2.526   8.402 -12.791
  701    HB   VAL  95           HB       VAL  95   5.062   9.077 -14.297
  702   1HG1  VAL  95          1HG1      VAL  95   4.323  11.231 -13.881
  703   2HG1  VAL  95          2HG1      VAL  95   5.096  10.878 -12.336
  704   3HG1  VAL  95          3HG1      VAL  95   3.345  10.739 -12.498
  705   1HG2  VAL  95          1HG2      VAL  95   5.196   8.995 -11.405
  706   2HG2  VAL  95          2HG2      VAL  95   6.081   8.024 -12.582
  707   3HG2  VAL  95          3HG2      VAL  95   4.491   7.501 -12.025
  708    HA   PRO  96           HA       PRO  96   0.109  10.324 -16.021
  709   1HB   PRO  96          2HB       PRO  96  -1.469  11.799 -14.329
  710   2HB   PRO  96          1HB       PRO  96  -1.728  10.070 -14.635
  711   1HG   PRO  96          2HG       PRO  96  -0.380  11.400 -12.333
  712   2HG   PRO  96          1HG       PRO  96  -1.476  10.009 -12.347
  713   1HD   PRO  96          2HD       PRO  96   1.212   9.758 -12.115
  714   2HD   PRO  96          1HD       PRO  96   0.193   8.528 -12.899
  715    HA   PRO  97           HA       PRO  97   1.923  14.295 -16.446
  716   1HB   PRO  97          2HB       PRO  97  -0.131  15.853 -17.375
  717   2HB   PRO  97          1HB       PRO  97   0.669  14.615 -18.364
  718   1HG   PRO  97          2HG       PRO  97  -1.924  14.487 -16.905
  719   2HG   PRO  97          1HG       PRO  97  -1.491  13.841 -18.495
  720   1HD   PRO  97          2HD       PRO  97  -1.651  12.305 -16.256
  721   2HD   PRO  97          1HD       PRO  97  -0.571  11.935 -17.618
  722    H    SER  98           H        SER  98  -0.566  13.802 -14.184
  723    HA   SER  98           HA       SER  98  -0.765  16.525 -13.164
  724   1HB   SER  98          2HB       SER  98  -2.468  14.651 -12.965
  725   2HB   SER  98          1HB       SER  98  -1.386  13.882 -11.806
  726    HG   SER  98           HG       SER  98  -2.612  16.439 -11.624
  727    H    LYS  99           H        LYS  99   1.493  13.944 -12.838
  728    HA   LYS  99           HA       LYS  99   2.571  14.925 -10.263
  729   1HB   LYS  99          2HB       LYS  99   2.370  12.499 -10.906
  730   2HB   LYS  99          1HB       LYS  99   3.560  12.785 -12.176
  731   1HG   LYS  99          2HG       LYS  99   4.486  11.862  -9.985
  732   2HG   LYS  99          1HG       LYS  99   5.266  13.324 -10.588
  733   1HD   LYS  99          2HD       LYS  99   4.216  14.694  -8.993
  734   2HD   LYS  99          1HD       LYS  99   2.948  13.511  -8.675
  735   1HE   LYS  99          2HE       LYS  99   4.204  12.929  -6.858
  736   2HE   LYS  99          1HE       LYS  99   5.269  12.122  -8.026
  737   1HZ   LYS  99          1HZ       LYS  99   6.163  14.035  -6.474
  738   2HZ   LYS  99          2HZ       LYS  99   5.527  15.020  -7.703
  739   3HZ   LYS  99          3HZ       LYS  99   6.716  13.863  -8.068
  740    H    ARG 100           H        ARG 100   2.754  15.920 -13.420
  741    HA   ARG 100           HA       ARG 100   5.433  17.158 -12.962
  742   1HB   ARG 100          2HB       ARG 100   5.824  16.617 -15.456
  743   2HB   ARG 100          1HB       ARG 100   5.923  15.268 -14.324
  744   1HG   ARG 100          2HG       ARG 100   3.921  14.346 -15.028
  745   2HG   ARG 100          1HG       ARG 100   3.260  15.903 -15.529
  746   1HD   ARG 100          2HD       ARG 100   3.800  15.272 -17.650
  747   2HD   ARG 100          1HD       ARG 100   5.487  15.566 -17.184
  748    HE   ARG 100           HE       ARG 100   4.682  12.988 -16.228
  749   1HH1  ARG 100          1HH2      ARG 100   4.257  14.157 -19.325
  750   2HH1  ARG 100          2HH2      ARG 100   5.317  13.026 -20.099
  751   1HH2  ARG 100          2HH1      ARG 100   6.564  11.756 -17.123
  752   2HH2  ARG 100          1HH1      ARG 100   6.624  11.667 -18.852
  753    H    SER 107           1H       SER 107   5.697   5.635   9.154
  754    HA   SER 107           HA       SER 107   7.097   5.123   6.597
  755   1HB   SER 107          2HB       SER 107   6.750   3.498   8.590
  756   2HB   SER 107          1HB       SER 107   5.053   3.502   8.122
  757    HG   SER 107           HG       SER 107   5.764   2.871   6.010
  758    H    THR 108           H        THR 108   5.856   5.122   4.693
  759    HA   THR 108           HA       THR 108   3.204   6.464   4.889
  760    HB   THR 108           HB       THR 108   3.626   7.062   2.589
  761    HG1  THR 108           HG1      THR 108   5.953   5.484   2.597
  762   1HG2  THR 108          1HG2      THR 108   5.719   8.245   2.777
  763   2HG2  THR 108          2HG2      THR 108   6.302   7.117   4.002
  764   3HG2  THR 108          3HG2      THR 108   4.976   8.218   4.376
  765    H    ASN 109           H        ASN 109   4.653   3.387   4.152
  766    HA   ASN 109           HA       ASN 109   2.260   2.433   2.687
  767   1HB   ASN 109          2HB       ASN 109   4.634   1.898   2.042
  768   2HB   ASN 109          1HB       ASN 109   4.776   0.974   3.540
  769   1HD2  ASN 109          1HD2      ASN 109   3.639   0.844   0.271
  770   2HD2  ASN 109          2HD2      ASN 109   2.879  -0.668   0.369
  771    HA   PRO 110           HA       PRO 110   0.614   0.754   6.438
  772   1HB   PRO 110          2HB       PRO 110  -1.608  -0.366   5.316
  773   2HB   PRO 110          1HB       PRO 110  -1.432   1.382   5.561
  774   1HG   PRO 110          2HG       PRO 110  -1.284  -0.188   3.080
  775   2HG   PRO 110          1HG       PRO 110  -1.701   1.512   3.324
  776   1HD   PRO 110          2HD       PRO 110   0.771   0.465   2.422
  777   2HD   PRO 110          1HD       PRO 110   0.400   2.153   2.830
  778    H    PHE 111           H        PHE 111   2.342  -0.959   4.287
  779    HA   PHE 111           HA       PHE 111   1.527  -3.598   5.467
  780   1HB   PHE 111          2HB       PHE 111   2.401  -2.836   2.671
  781   2HB   PHE 111          1HB       PHE 111   2.322  -4.512   3.215
  782    HD1  PHE 111           HD1      PHE 111   0.532  -2.077   1.516
  783    HD2  PHE 111           HD2      PHE 111   0.032  -4.988   4.634
  784    HE1  PHE 111           HE1      PHE 111  -1.913  -2.098   1.106
  785    HE2  PHE 111           HE2      PHE 111  -2.411  -5.010   4.224
  786    HZ   PHE 111           HZ       PHE 111  -3.383  -3.564   2.464
  787    H    LEU 112           HN       LEU 112   4.044  -1.320   4.979
  788    HA   LEU 112           HA       LEU 112   6.144  -3.376   5.545
  789   1HB   LEU 112          2HB       LEU 112   6.106  -0.589   4.382
  790   2HB   LEU 112          1HB       LEU 112   7.612  -1.333   4.919
  791    HG   LEU 112           HG       LEU 112   5.722  -2.714   3.007
  792   1HD1  LEU 112          1HD1      LEU 112   8.057  -0.876   2.418
  793   2HD1  LEU 112          2HD1      LEU 112   6.382  -0.661   1.912
  794   3HD1  LEU 112          3HD1      LEU 112   7.348  -1.969   1.231
  795   1HD2  LEU 112          1HD2      LEU 112   8.624  -3.194   2.908
  796   2HD2  LEU 112          2HD2      LEU 112   7.296  -4.354   2.951
  797   3HD2  LEU 112          3HD2      LEU 112   7.887  -3.634   4.449
  Start of MODEL    4
    1    HA   PRO   6           HA       PRO   6   1.139   6.626 -23.645
    2   1HB   PRO   6          2HB       PRO   6  -0.589   4.531 -23.326
    3   2HB   PRO   6          1HB       PRO   6  -0.266   5.284 -24.901
    4   1HG   PRO   6          2HG       PRO   6   0.782   2.744 -23.769
    5   2HG   PRO   6          1HG       PRO   6   0.329   3.138 -25.433
    6   1HD   PRO   6          2HD       PRO   6   2.915   3.046 -24.515
    7   2HD   PRO   6          1HD       PRO   6   2.384   3.994 -25.921
    8    H    TRP   7           H        TRP   7  -0.520   5.830 -21.659
    9    HA   TRP   7           HA       TRP   7   1.203   5.719 -19.304
   10   1HB   TRP   7          2HB       TRP   7  -0.878   7.057 -19.488
   11   2HB   TRP   7          1HB       TRP   7  -1.812   5.574 -19.675
   12    HD1  TRP   7           HD1      TRP   7   0.941   5.066 -17.319
   13    HE1  TRP   7           HE1      TRP   7   0.103   5.129 -14.876
   14    HE3  TRP   7           HE3      TRP   7  -3.729   6.962 -18.059
   15    HZ2  TRP   7           HZ2      TRP   7  -2.251   5.888 -13.437
   16    HZ3  TRP   7           HZ3      TRP   7  -5.253   7.345 -16.143
   17    HH2  TRP   7           HH2      TRP   7  -4.521   6.810 -13.836
   18    H    ALA   8           H        ALA   8   1.880   3.823 -18.356
   19    HA   ALA   8           HA       ALA   8   1.509   1.235 -19.245
   20   1HB   ALA   8          1HB       ALA   8   2.801   2.386 -17.207
   21   2HB   ALA   8          2HB       ALA   8   2.494   0.650 -17.229
   22   3HB   ALA   8          3HB       ALA   8   1.447   1.718 -16.294
   23    H    VAL   9           H        VAL   9  -0.751   3.179 -17.377
   24    HA   VAL   9           HA       VAL   9  -2.580   0.881 -16.978
   25    HB   VAL   9           HB       VAL   9  -2.419   3.763 -16.110
   26   1HG1  VAL   9          1HG1      VAL   9  -4.616   3.332 -14.907
   27   2HG1  VAL   9          2HG1      VAL   9  -4.819   1.921 -15.946
   28   3HG1  VAL   9          3HG1      VAL   9  -4.753   3.535 -16.654
   29   1HG2  VAL   9          1HG2      VAL   9  -3.079   1.986 -14.015
   30   2HG2  VAL   9          2HG2      VAL   9  -1.509   2.730 -14.321
   31   3HG2  VAL   9          3HG2      VAL   9  -1.882   1.145 -14.998
   32    H    LYS  10           H        LYS  10  -4.796   0.971 -17.878
   33    HA   LYS  10           HA       LYS  10  -4.890   2.517 -20.443
   34   1HB   LYS  10          2HB       LYS  10  -6.065  -0.079 -19.440
   35   2HB   LYS  10          1HB       LYS  10  -6.666   0.687 -20.908
   36   1HG   LYS  10          2HG       LYS  10  -3.738   0.067 -20.449
   37   2HG   LYS  10          1HG       LYS  10  -4.839  -1.037 -21.272
   38   1HD   LYS  10          2HD       LYS  10  -5.014   1.701 -22.293
   39   2HD   LYS  10          1HD       LYS  10  -3.406   0.999 -22.487
   40   1HE   LYS  10          2HE       LYS  10  -4.128  -0.388 -24.131
   41   2HE   LYS  10          1HE       LYS  10  -5.521  -0.910 -23.161
   42   1HZ   LYS  10          1HZ       LYS  10  -5.431   1.802 -24.316
   43   2HZ   LYS  10          2HZ       LYS  10  -6.782   0.891 -23.835
   44   3HZ   LYS  10          3HZ       LYS  10  -5.950   0.495 -25.263
   45    HA   PRO  11           HA       PRO  11  -8.417   4.803 -19.163
   46   1HB   PRO  11          2HB       PRO  11 -10.077   4.635 -21.337
   47   2HB   PRO  11          1HB       PRO  11  -8.607   5.631 -21.319
   48   1HG   PRO  11          2HG       PRO  11  -9.048   2.923 -22.486
   49   2HG   PRO  11          1HG       PRO  11  -8.138   4.296 -23.137
   50   1HD   PRO  11          2HD       PRO  11  -6.936   2.183 -21.949
   51   2HD   PRO  11          1HD       PRO  11  -6.270   3.830 -21.876
   52    H    GLU  12           H        GLU  12  -9.009   1.611 -20.509
   53    HA   GLU  12           HA       GLU  12 -11.681   1.324 -19.335
   54   1HB   GLU  12          2HB       GLU  12  -9.815  -0.837 -20.345
   55   2HB   GLU  12          1HB       GLU  12 -11.580  -0.842 -20.350
   56   1HG   GLU  12          2HG       GLU  12  -9.813   1.004 -21.978
   57   2HG   GLU  12          1HG       GLU  12 -10.706  -0.377 -22.602
   58    H    ASP  13           H        ASP  13  -8.361   0.482 -18.551
   59    HA   ASP  13           HA       ASP  13  -9.045  -1.170 -16.235
   60   1HB   ASP  13          2HB       ASP  13  -6.661  -0.175 -17.685
   61   2HB   ASP  13          1HB       ASP  13  -6.422  -0.444 -15.958
   62    H    LYS  14           H        LYS  14  -8.140   2.176 -16.889
   63    HA   LYS  14           HA       LYS  14  -7.842   2.948 -14.114
   64   1HB   LYS  14          2HB       LYS  14  -6.797   4.172 -15.953
   65   2HB   LYS  14          1HB       LYS  14  -8.375   4.482 -16.677
   66   1HG   LYS  14          2HG       LYS  14  -7.790   6.481 -15.502
   67   2HG   LYS  14          1HG       LYS  14  -8.996   5.665 -14.507
   68   1HD   LYS  14          2HD       LYS  14  -7.255   4.739 -13.074
   69   2HD   LYS  14          1HD       LYS  14  -6.001   5.416 -14.113
   70   1HE   LYS  14          2HE       LYS  14  -6.331   6.871 -12.151
   71   2HE   LYS  14          1HE       LYS  14  -6.894   7.711 -13.611
   72   1HZ   LYS  14          1HZ       LYS  14  -8.535   7.761 -11.780
   73   2HZ   LYS  14          2HZ       LYS  14  -8.627   6.066 -11.845
   74   3HZ   LYS  14          3HZ       LYS  14  -9.126   6.997 -13.175
   75    H    ALA  15           H        ALA  15 -10.494   2.386 -16.226
   76    HA   ALA  15           HA       ALA  15 -12.449   4.111 -14.930
   77   1HB   ALA  15          1HB       ALA  15 -12.430   3.055 -17.296
   78   2HB   ALA  15          2HB       ALA  15 -13.962   3.022 -16.423
   79   3HB   ALA  15          3HB       ALA  15 -12.959   1.573 -16.501
   80    H    LYS  16           H        LYS  16 -11.554   0.666 -14.731
   81    HA   LYS  16           HA       LYS  16 -13.498   0.083 -12.639
   82   1HB   LYS  16          2HB       LYS  16 -12.780  -2.080 -12.999
   83   2HB   LYS  16          1HB       LYS  16 -12.169  -1.357 -14.484
   84   1HG   LYS  16          2HG       LYS  16  -9.980  -1.014 -13.428
   85   2HG   LYS  16          1HG       LYS  16 -10.588  -1.721 -11.932
   86   1HD   LYS  16          2HD       LYS  16  -9.557  -3.565 -12.919
   87   2HD   LYS  16          1HD       LYS  16 -11.217  -3.749 -13.485
   88   1HE   LYS  16          2HE       LYS  16 -10.527  -2.408 -15.555
   89   2HE   LYS  16          1HE       LYS  16  -8.849  -2.641 -15.017
   90   1HZ   LYS  16          1HZ       LYS  16 -10.857  -4.781 -15.495
   91   2HZ   LYS  16          2HZ       LYS  16  -9.298  -5.034 -14.868
   92   3HZ   LYS  16          3HZ       LYS  16  -9.496  -4.456 -16.453
   93    H    TYR  17           H        TYR  17 -10.234   1.274 -12.850
   94    HA   TYR  17           HA       TYR  17  -9.443   0.752 -10.098
   95   1HB   TYR  17          2HB       TYR  17  -8.538   2.738 -12.215
   96   2HB   TYR  17          1HB       TYR  17  -7.690   2.450 -10.702
   97    HD1  TYR  17           HD1      TYR  17  -9.132  -0.601 -11.662
   98    HD2  TYR  17           HD2      TYR  17  -5.892   2.031 -12.655
   99    HE1  TYR  17           HE1      TYR  17  -7.927  -2.487 -12.722
  100    HE2  TYR  17           HE2      TYR  17  -4.676   0.145 -13.706
  101    HH   TYR  17           HH       TYR  17  -5.254  -2.058 -14.740
  102    H    ASP  18           H        ASP  18 -10.933   3.410 -11.886
  103    HA   ASP  18           HA       ASP  18 -10.974   5.248  -9.608
  104   1HB   ASP  18          2HB       ASP  18 -10.807   6.096 -11.856
  105   2HB   ASP  18          1HB       ASP  18 -12.214   5.162 -12.371
  106    H    ALA  19           H        ALA  19 -12.823   2.556 -10.484
  107    HA   ALA  19           HA       ALA  19 -15.327   3.589  -9.234
  108   1HB   ALA  19          1HB       ALA  19 -16.323   1.653 -10.216
  109   2HB   ALA  19          2HB       ALA  19 -14.773   0.819 -10.334
  110   3HB   ALA  19          3HB       ALA  19 -15.132   2.170 -11.409
  111    H    ILE  20           H        ILE  20 -12.657   1.363  -8.829
  112    HA   ILE  20           HA       ILE  20 -13.617   0.148  -6.359
  113    HB   ILE  20           HB       ILE  20 -10.993   0.328  -7.876
  114   1HG1  ILE  20          2HG1      ILE  20 -12.806  -2.054  -7.416
  115   2HG1  ILE  20          1HG1      ILE  20 -12.953  -0.996  -8.821
  116   1HG2  ILE  20          1HG2      ILE  20 -10.974  -0.041  -5.263
  117   2HG2  ILE  20          2HG2      ILE  20  -9.944  -1.004  -6.319
  118   3HG2  ILE  20          3HG2      ILE  20 -11.459  -1.673  -5.713
  119   1HD1  ILE  20          1HD1      ILE  20 -10.753  -1.542  -9.583
  120   2HD1  ILE  20          2HD1      ILE  20 -11.509  -3.077  -9.151
  121   3HD1  ILE  20          3HD1      ILE  20 -10.345  -2.327  -8.056
  122    H    PHE  21           H        PHE  21 -11.600   2.833  -7.403
  123    HA   PHE  21           HA       PHE  21 -10.475   3.550  -4.856
  124   1HB   PHE  21          2HB       PHE  21  -9.359   4.505  -6.645
  125   2HB   PHE  21          1HB       PHE  21 -10.834   4.686  -7.591
  126    HD1  PHE  21           HD1      PHE  21  -8.431   6.354  -5.529
  127    HD2  PHE  21           HD2      PHE  21 -12.531   6.487  -6.803
  128    HE1  PHE  21           HE1      PHE  21  -8.557   8.746  -4.880
  129    HE2  PHE  21           HE2      PHE  21 -12.658   8.874  -6.150
  130    HZ   PHE  21           HZ       PHE  21 -10.673  10.003  -5.189
  131    H    ASP  22           H        ASP  22 -13.410   4.446  -6.604
  132    HA   ASP  22           HA       ASP  22 -14.283   6.241  -4.424
  133   1HB   ASP  22          2HB       ASP  22 -14.687   7.033  -6.609
  134   2HB   ASP  22          1HB       ASP  22 -15.258   5.458  -7.168
  135    H    SER  23           H        SER  23 -14.337   2.959  -5.005
  136    HA   SER  23           HA       SER  23 -17.061   2.378  -4.086
  137   1HB   SER  23          2HB       SER  23 -16.040   0.832  -5.597
  138   2HB   SER  23          1HB       SER  23 -14.541   0.808  -4.675
  139    HG   SER  23           HG       SER  23 -17.042  -0.352  -4.076
  140    H    LEU  24           H        LEU  24 -14.092   3.241  -2.690
  141    HA   LEU  24           HA       LEU  24 -14.618   1.904  -0.098
  142   1HB   LEU  24          2HB       LEU  24 -12.399   3.827  -0.797
  143   2HB   LEU  24          1HB       LEU  24 -12.371   2.507   0.369
  144    HG   LEU  24           HG       LEU  24 -12.736   1.972  -2.576
  145   1HD1  LEU  24          1HD1      LEU  24 -10.043   1.494  -1.659
  146   2HD1  LEU  24          2HD1      LEU  24 -10.466   3.188  -1.414
  147   3HD1  LEU  24          3HD1      LEU  24 -10.588   2.472  -3.021
  148   1HD2  LEU  24          1HD2      LEU  24 -12.066  -0.224  -2.006
  149   2HD2  LEU  24          2HD2      LEU  24 -13.109   0.259  -0.666
  150   3HD2  LEU  24          3HD2      LEU  24 -11.354   0.305  -0.480
  151    H    SER  25           H        SER  25 -13.899   5.138  -1.348
  152    HA   SER  25           HA       SER  25 -15.771   6.870  -0.560
  153   1HB   SER  25          2HB       SER  25 -15.241   7.371   1.916
  154   2HB   SER  25          1HB       SER  25 -16.152   5.900   1.592
  155    HG   SER  25           HG       SER  25 -14.573   4.869   2.499
  156    HA   PRO  26           HA       PRO  26 -11.700   8.683  -1.503
  157   1HB   PRO  26          2HB       PRO  26 -12.622  10.350  -3.457
  158   2HB   PRO  26          1HB       PRO  26 -12.205   8.651  -3.752
  159   1HG   PRO  26          2HG       PRO  26 -14.866   9.914  -3.419
  160   2HG   PRO  26          1HG       PRO  26 -14.373   8.569  -4.458
  161   1HD   PRO  26          2HD       PRO  26 -15.721   8.289  -2.069
  162   2HD   PRO  26          1HD       PRO  26 -14.738   7.021  -2.828
  163    H    VAL  27           H        VAL  27 -10.903  10.745  -0.951
  164    HA   VAL  27           HA       VAL  27 -12.885  12.664   0.224
  165    HB   VAL  27           HB       VAL  27 -10.115  11.937   1.241
  166   1HG1  VAL  27          1HG1      VAL  27 -11.158  14.245   1.729
  167   2HG1  VAL  27          2HG1      VAL  27 -10.618  13.298   3.115
  168   3HG1  VAL  27          3HG1      VAL  27 -12.332  13.366   2.710
  169   1HG2  VAL  27          1HG2      VAL  27 -12.048  11.151   3.107
  170   2HG2  VAL  27          2HG2      VAL  27 -11.108  10.081   2.068
  171   3HG2  VAL  27          3HG2      VAL  27 -12.703  10.629   1.554
  172    H    ASN  28           H        ASN  28 -12.813  14.340  -1.248
  173    HA   ASN  28           HA       ASN  28 -11.912  16.087  -2.555
  174   1HB   ASN  28          2HB       ASN  28 -10.938  16.727  -0.431
  175   2HB   ASN  28          1HB       ASN  28  -9.670  15.512  -0.594
  176   1HD2  ASN  28          1HD2      ASN  28  -7.840  16.023  -1.913
  177   2HD2  ASN  28          2HD2      ASN  28  -7.636  17.531  -2.664
  178    H    GLY  29           H        GLY  29 -11.354  13.108  -3.161
  179   1HA   GLY  29          2HA       GLY  29 -10.470  12.248  -5.225
  180   2HA   GLY  29          1HA       GLY  29  -9.410  13.653  -5.327
  181    H    PHE  30           H        PHE  30  -9.811  11.501  -2.529
  182    HA   PHE  30           HA       PHE  30  -7.130  10.319  -3.030
  183   1HB   PHE  30          2HB       PHE  30  -7.909  12.109  -0.725
  184   2HB   PHE  30          1HB       PHE  30  -6.492  11.050  -0.676
  185    HD1  PHE  30           HD1      PHE  30  -7.984  14.048  -2.150
  186    HD2  PHE  30           HD2      PHE  30  -4.632  11.376  -2.234
  187    HE1  PHE  30           HE1      PHE  30  -6.706  15.709  -3.461
  188    HE2  PHE  30           HE2      PHE  30  -3.331  13.048  -3.540
  189    HZ   PHE  30           HZ       PHE  30  -4.371  15.216  -4.156
  190    H    LEU  31           H        LEU  31  -6.731   8.449  -1.823
  191    HA   LEU  31           HA       LEU  31  -9.026   7.402  -0.194
  192   1HB   LEU  31          2HB       LEU  31  -7.277   6.182  -2.319
  193   2HB   LEU  31          1HB       LEU  31  -7.912   5.144  -1.041
  194    HG   LEU  31           HG       LEU  31  -9.466   6.749  -3.075
  195   1HD1  LEU  31          1HD1      LEU  31  -9.044   4.642  -3.950
  196   2HD1  LEU  31          2HD1      LEU  31 -10.531   4.323  -3.064
  197   3HD1  LEU  31          3HD1      LEU  31  -8.977   3.884  -2.356
  198   1HD2  LEU  31          1HD2      LEU  31 -10.338   5.554  -0.435
  199   2HD2  LEU  31          2HD2      LEU  31 -11.470   5.766  -1.772
  200   3HD2  LEU  31          3HD2      LEU  31 -10.670   7.170  -1.060
  201    H    SER  32           H        SER  32  -8.377   6.534   1.811
  202    HA   SER  32           HA       SER  32  -5.573   7.072   2.557
  203   1HB   SER  32          2HB       SER  32  -6.405   6.985   4.765
  204   2HB   SER  32          1HB       SER  32  -7.751   7.650   3.844
  205    HG   SER  32           HG       SER  32  -8.809   6.011   4.620
  206    H    GLY  33           H        GLY  33  -4.090   5.499   3.103
  207   1HA   GLY  33          2HA       GLY  33  -4.065   2.981   1.966
  208   2HA   GLY  33          1HA       GLY  33  -3.253   3.308   3.498
  209    H    ASP  34           H        ASP  34  -5.852   4.002   4.780
  210    HA   ASP  34           HA       ASP  34  -6.525   1.479   5.909
  211   1HB   ASP  34          2HB       ASP  34  -7.015   4.151   6.358
  212   2HB   ASP  34          1HB       ASP  34  -8.610   3.537   5.927
  213    H    LYS  35           H        LYS  35  -7.751   3.185   3.073
  214    HA   LYS  35           HA       LYS  35  -9.967   1.232   2.760
  215   1HB   LYS  35          2HB       LYS  35  -9.144   3.671   1.147
  216   2HB   LYS  35          1HB       LYS  35 -10.676   2.808   1.022
  217   1HG   LYS  35          2HG       LYS  35 -11.052   3.321   3.474
  218   2HG   LYS  35          1HG       LYS  35  -9.650   4.387   3.391
  219   1HD   LYS  35          2HD       LYS  35 -10.894   5.420   1.328
  220   2HD   LYS  35          1HD       LYS  35 -12.319   4.668   2.043
  221   1HE   LYS  35          2HE       LYS  35 -12.449   6.291   3.620
  222   2HE   LYS  35          1HE       LYS  35 -10.748   6.057   4.067
  223   1HZ   LYS  35          1HZ       LYS  35 -11.057   8.248   3.117
  224   2HZ   LYS  35          2HZ       LYS  35 -11.746   7.578   1.716
  225   3HZ   LYS  35          3HZ       LYS  35 -10.110   7.300   2.078
  226    H    VAL  36           H        VAL  36  -6.901   2.257   1.356
  227    HA   VAL  36           HA       VAL  36  -7.100   0.525  -0.990
  228    HB   VAL  36           HB       VAL  36  -4.784   1.923   0.380
  229   1HG1  VAL  36          1HG1      VAL  36  -4.954   0.968  -2.481
  230   2HG1  VAL  36          2HG1      VAL  36  -4.259  -0.015  -1.194
  231   3HG1  VAL  36          3HG1      VAL  36  -3.532   1.535  -1.610
  232   1HG2  VAL  36          1HG2      VAL  36  -6.649   3.399  -0.422
  233   2HG2  VAL  36          2HG2      VAL  36  -6.421   2.738  -2.042
  234   3HG2  VAL  36          3HG2      VAL  36  -5.132   3.670  -1.280
  235    H    LYS  37           H        LYS  37  -5.382   0.381   2.140
  236    HA   LYS  37           HA       LYS  37  -3.821  -1.867   1.943
  237   1HB   LYS  37          2HB       LYS  37  -3.909  -0.739   4.008
  238   2HB   LYS  37          1HB       LYS  37  -5.666  -0.823   4.085
  239   1HG   LYS  37          2HG       LYS  37  -5.508  -3.291   4.395
  240   2HG   LYS  37          1HG       LYS  37  -3.750  -3.152   4.406
  241   1HD   LYS  37          2HD       LYS  37  -3.810  -1.758   6.387
  242   2HD   LYS  37          1HD       LYS  37  -5.571  -1.681   6.330
  243   1HE   LYS  37          2HE       LYS  37  -5.753  -4.060   6.804
  244   2HE   LYS  37          1HE       LYS  37  -3.991  -4.252   6.695
  245   1HZ   LYS  37          1HZ       LYS  37  -3.657  -3.217   8.660
  246   2HZ   LYS  37          2HZ       LYS  37  -5.245  -3.729   8.981
  247   3HZ   LYS  37          3HZ       LYS  37  -4.951  -2.142   8.451
  248    HA   PRO  38           HA       PRO  38  -7.531  -4.845   2.694
  249   1HB   PRO  38          2HB       PRO  38 -10.040  -3.784   2.328
  250   2HB   PRO  38          1HB       PRO  38  -9.230  -3.845   3.909
  251   1HG   PRO  38          2HG       PRO  38  -9.427  -1.579   1.972
  252   2HG   PRO  38          1HG       PRO  38  -9.622  -1.572   3.733
  253   1HD   PRO  38          2HD       PRO  38  -7.351  -0.752   2.577
  254   2HD   PRO  38          1HD       PRO  38  -7.339  -1.636   4.121
  255    H    VAL  39           H        VAL  39  -7.947  -2.232   0.350
  256    HA   VAL  39           HA       VAL  39  -9.212  -3.716  -1.744
  257    HB   VAL  39           HB       VAL  39  -7.615  -1.211  -1.404
  258   1HG1  VAL  39          1HG1      VAL  39  -7.765  -2.759  -3.921
  259   2HG1  VAL  39          2HG1      VAL  39  -6.625  -1.503  -3.436
  260   3HG1  VAL  39          3HG1      VAL  39  -8.213  -1.059  -4.060
  261   1HG2  VAL  39          1HG2      VAL  39 -10.333  -1.967  -1.615
  262   2HG2  VAL  39          2HG2      VAL  39  -9.960  -1.054  -3.077
  263   3HG2  VAL  39          3HG2      VAL  39  -9.684  -0.332  -1.492
  264    H    LEU  40           H        LEU  40  -5.806  -3.295  -0.828
  265    HA   LEU  40           HA       LEU  40  -4.822  -4.789  -3.165
  266   1HB   LEU  40          2HB       LEU  40  -3.394  -3.900  -0.645
  267   2HB   LEU  40          1HB       LEU  40  -2.670  -4.248  -2.213
  268    HG   LEU  40           HG       LEU  40  -4.681  -2.045  -1.727
  269   1HD1  LEU  40          1HD1      LEU  40  -2.781  -1.276  -0.597
  270   2HD1  LEU  40          2HD1      LEU  40  -2.501  -0.668  -2.231
  271   3HD1  LEU  40          3HD1      LEU  40  -1.677  -2.126  -1.680
  272   1HD2  LEU  40          1HD2      LEU  40  -2.858  -2.635  -4.077
  273   2HD2  LEU  40          2HD2      LEU  40  -4.033  -1.323  -3.971
  274   3HD2  LEU  40          3HD2      LEU  40  -4.582  -2.999  -4.028
  275    H    LEU  41           H        LEU  41  -5.560  -5.374   0.224
  276    HA   LEU  41           HA       LEU  41  -4.167  -7.900   0.439
  277   1HB   LEU  41          2HB       LEU  41  -6.417  -6.534   1.934
  278   2HB   LEU  41          1HB       LEU  41  -5.752  -8.088   2.436
  279    HG   LEU  41           HG       LEU  41  -3.957  -5.717   1.958
  280   1HD1  LEU  41          1HD1      LEU  41  -4.121  -5.219   4.362
  281   2HD1  LEU  41          2HD1      LEU  41  -5.325  -6.494   4.552
  282   3HD1  LEU  41          3HD1      LEU  41  -5.702  -5.061   3.597
  283   1HD2  LEU  41          1HD2      LEU  41  -3.565  -8.429   2.561
  284   2HD2  LEU  41          2HD2      LEU  41  -3.315  -7.590   4.092
  285   3HD2  LEU  41          3HD2      LEU  41  -2.357  -7.148   2.677
  286    H    ASN  42           H        ASN  42  -7.029  -6.866  -1.114
  287    HA   ASN  42           HA       ASN  42  -8.495  -9.368  -0.903
  288   1HB   ASN  42          2HB       ASN  42  -9.099  -6.785  -1.472
  289   2HB   ASN  42          1HB       ASN  42  -8.999  -7.438  -3.108
  290   1HD2  ASN  42          1HD2      ASN  42 -11.454  -6.931  -3.000
  291   2HD2  ASN  42          2HD2      ASN  42 -12.464  -8.145  -2.376
  292    H    SER  43           H        SER  43  -5.843  -8.266  -2.735
  293    HA   SER  43           HA       SER  43  -6.342  -9.844  -5.151
  294   1HB   SER  43          2HB       SER  43  -4.199  -8.947  -5.791
  295   2HB   SER  43          1HB       SER  43  -5.052  -7.672  -4.931
  296    HG   SER  43           HG       SER  43  -3.151  -7.704  -3.924
  297    H    LYS  44           H        LYS  44  -5.654 -10.766  -2.066
  298    HA   LYS  44           HA       LYS  44  -4.867 -12.820  -1.189
  299   1HB   LYS  44          2HB       LYS  44  -5.774 -13.351  -3.700
  300   2HB   LYS  44          1HB       LYS  44  -4.079 -13.814  -3.873
  301   1HG   LYS  44          2HG       LYS  44  -4.393 -15.123  -1.676
  302   2HG   LYS  44          1HG       LYS  44  -6.123 -14.906  -1.937
  303   1HD   LYS  44          2HD       LYS  44  -4.328 -16.028  -4.091
  304   2HD   LYS  44          1HD       LYS  44  -5.067 -17.063  -2.867
  305   1HE   LYS  44          2HE       LYS  44  -7.156 -15.405  -3.789
  306   2HE   LYS  44          1HE       LYS  44  -6.284 -15.936  -5.241
  307   1HZ   LYS  44          1HZ       LYS  44  -6.355 -18.200  -4.440
  308   2HZ   LYS  44          2HZ       LYS  44  -7.935 -17.581  -4.523
  309   3HZ   LYS  44          3HZ       LYS  44  -7.150 -17.714  -3.023
  310    H    LEU  45           H        LEU  45  -3.094 -10.439  -2.259
  311    HA   LEU  45           HA       LEU  45  -0.477 -11.833  -2.506
  312   1HB   LEU  45          2HB       LEU  45  -1.609  -9.096  -2.986
  313   2HB   LEU  45          1HB       LEU  45   0.128  -9.257  -2.738
  314    HG   LEU  45           HG       LEU  45  -1.465 -10.833  -4.779
  315   1HD1  LEU  45          1HD1      LEU  45   0.550  -8.860  -5.655
  316   2HD1  LEU  45          2HD1      LEU  45  -0.885  -8.159  -4.909
  317   3HD1  LEU  45          3HD1      LEU  45  -1.046  -9.207  -6.318
  318   1HD2  LEU  45          1HD2      LEU  45   1.472 -10.487  -4.984
  319   2HD2  LEU  45          2HD2      LEU  45   0.486 -11.917  -5.289
  320   3HD2  LEU  45          3HD2      LEU  45   0.929 -11.487  -3.637
  321    HA   PRO  46           HA       PRO  46   0.522 -11.073   1.694
  322   1HB   PRO  46          2HB       PRO  46   3.251 -10.986   1.518
  323   2HB   PRO  46          1HB       PRO  46   2.318 -12.488   1.389
  324   1HG   PRO  46          2HG       PRO  46   3.571 -10.854  -0.735
  325   2HG   PRO  46          1HG       PRO  46   3.378 -12.607  -0.622
  326   1HD   PRO  46          2HD       PRO  46   1.804 -10.967  -2.166
  327   2HD   PRO  46          1HD       PRO  46   1.318 -12.569  -1.584
  328    H    VAL  47           H        VAL  47   1.971  -9.475   3.024
  329    HA   VAL  47           HA       VAL  47   1.300  -6.770   2.288
  330    HB   VAL  47           HB       VAL  47   2.936  -8.167   4.414
  331   1HG1  VAL  47          1HG1      VAL  47   3.836  -5.836   3.879
  332   2HG1  VAL  47          2HG1      VAL  47   3.328  -6.108   5.541
  333   3HG1  VAL  47          3HG1      VAL  47   2.281  -5.219   4.438
  334   1HG2  VAL  47          1HG2      VAL  47   0.185  -7.102   4.102
  335   2HG2  VAL  47          2HG2      VAL  47   0.941  -6.837   5.674
  336   3HG2  VAL  47          3HG2      VAL  47   0.761  -8.476   5.046
  337    H    ASP  48           H        ASP  48   3.792  -8.836   1.312
  338    HA   ASP  48           HA       ASP  48   5.921  -6.859   1.129
  339   1HB   ASP  48          2HB       ASP  48   5.415  -9.699   0.329
  340   2HB   ASP  48          1HB       ASP  48   6.792  -8.848  -0.370
  341    H    ILE  49           H        ILE  49   3.403  -8.175  -0.952
  342    HA   ILE  49           HA       ILE  49   4.436  -6.831  -3.349
  343    HB   ILE  49           HB       ILE  49   1.674  -7.982  -2.935
  344   1HG1  ILE  49          2HG1      ILE  49   3.178  -9.649  -2.024
  345   2HG1  ILE  49          1HG1      ILE  49   2.670 -10.183  -3.621
  346   1HG2  ILE  49          1HG2      ILE  49   2.395  -8.772  -5.361
  347   2HG2  ILE  49          2HG2      ILE  49   3.533  -7.433  -5.214
  348   3HG2  ILE  49          3HG2      ILE  49   1.800  -7.134  -5.087
  349   1HD1  ILE  49          1HD1      ILE  49   4.749  -9.290  -4.587
  350   2HD1  ILE  49          2HD1      ILE  49   5.089 -10.485  -3.334
  351   3HD1  ILE  49          3HD1      ILE  49   5.266  -8.765  -2.983
  352    H    LEU  50           H        LEU  50   1.924  -6.413  -0.932
  353    HA   LEU  50           HA       LEU  50   0.696  -4.082  -2.162
  354   1HB   LEU  50          2HB       LEU  50   0.650  -5.016   0.717
  355   2HB   LEU  50          1HB       LEU  50  -0.588  -4.083  -0.126
  356    HG   LEU  50           HG       LEU  50   0.215  -6.946  -0.724
  357   1HD1  LEU  50          1HD1      LEU  50  -2.123  -7.423  -0.018
  358   2HD1  LEU  50          2HD1      LEU  50  -2.303  -5.728   0.435
  359   3HD1  LEU  50          3HD1      LEU  50  -1.146  -6.750   1.288
  360   1HD2  LEU  50          1HD2      LEU  50  -2.213  -6.116  -1.995
  361   2HD2  LEU  50          2HD2      LEU  50  -0.721  -6.676  -2.750
  362   3HD2  LEU  50          3HD2      LEU  50  -0.945  -4.961  -2.407
  363    H    GLY  51           H        GLY  51   3.353  -4.713   0.027
  364   1HA   GLY  51          2HA       GLY  51   3.573  -1.997   1.046
  365   2HA   GLY  51          1HA       GLY  51   4.834  -3.236   1.131
  366    H    ARG  52           H        ARG  52   4.508  -3.714  -1.795
  367    HA   ARG  52           HA       ARG  52   6.261  -1.503  -2.735
  368   1HB   ARG  52          2HB       ARG  52   6.065  -4.370  -3.016
  369   2HB   ARG  52          1HB       ARG  52   6.049  -3.609  -4.606
  370   1HG   ARG  52          2HG       ARG  52   8.048  -2.232  -3.802
  371   2HG   ARG  52          1HG       ARG  52   8.143  -3.355  -2.445
  372   1HD   ARG  52          2HD       ARG  52   7.864  -4.825  -4.929
  373   2HD   ARG  52          1HD       ARG  52   9.260  -3.733  -5.000
  374    HE   ARG  52           HE       ARG  52   9.851  -4.712  -2.686
  375   1HH1  ARG  52          1HH2      ARG  52  10.486  -6.511  -5.061
  376   2HH1  ARG  52          2HH2      ARG  52   9.851  -8.026  -4.514
  377   1HH2  ARG  52          2HH1      ARG  52   7.956  -6.611  -1.975
  378   2HH2  ARG  52          1HH1      ARG  52   8.416  -8.082  -2.763
  379    H    VAL  53           H        VAL  53   3.194  -3.149  -3.392
  380    HA   VAL  53           HA       VAL  53   2.737  -1.843  -5.945
  381    HB   VAL  53           HB       VAL  53   1.119  -3.366  -3.910
  382   1HG1  VAL  53          1HG1      VAL  53  -0.753  -2.283  -4.583
  383   2HG1  VAL  53          2HG1      VAL  53  -0.526  -3.083  -6.138
  384   3HG1  VAL  53          3HG1      VAL  53   0.106  -1.456  -5.882
  385   1HG2  VAL  53          1HG2      VAL  53   1.407  -3.915  -6.863
  386   2HG2  VAL  53          2HG2      VAL  53   1.137  -5.056  -5.542
  387   3HG2  VAL  53          3HG2      VAL  53   2.724  -4.313  -5.753
  388    H    TRP  54           H        TRP  54   1.913  -1.130  -2.567
  389    HA   TRP  54           HA       TRP  54   0.272   1.176  -3.186
  390   1HB   TRP  54          2HB       TRP  54  -0.052   0.226  -1.042
  391   2HB   TRP  54          1HB       TRP  54   1.683   0.089  -0.744
  392    HD1  TRP  54           HD1      TRP  54   3.031   2.444  -0.422
  393    HE1  TRP  54           HE1      TRP  54   2.261   4.664   0.606
  394    HE3  TRP  54           HE3      TRP  54  -2.022   1.757  -0.556
  395    HZ2  TRP  54           HZ2      TRP  54  -0.186   5.978   1.316
  396    HZ3  TRP  54           HZ3      TRP  54  -3.552   3.517   0.309
  397    HH2  TRP  54           HH2      TRP  54  -2.641   5.613   1.242
  398    H    GLU  55           H        GLU  55   3.672   0.817  -2.043
  399    HA   GLU  55           HA       GLU  55   4.310   3.572  -2.011
  400   1HB   GLU  55          2HB       GLU  55   6.021   1.162  -2.668
  401   2HB   GLU  55          1HB       GLU  55   6.632   2.741  -2.163
  402   1HG   GLU  55          2HG       GLU  55   4.576   1.365  -0.473
  403   2HG   GLU  55          1HG       GLU  55   6.262   0.857  -0.361
  404    H    LEU  56           H        LEU  56   4.942   1.248  -4.671
  405    HA   LEU  56           HA       LEU  56   5.779   3.258  -6.548
  406   1HB   LEU  56          2HB       LEU  56   4.473   0.539  -6.952
  407   2HB   LEU  56          1HB       LEU  56   5.332   1.444  -8.198
  408    HG   LEU  56           HG       LEU  56   6.809   1.003  -5.655
  409   1HD1  LEU  56          1HD1      LEU  56   6.961  -1.263  -5.753
  410   2HD1  LEU  56          2HD1      LEU  56   6.998  -1.272  -7.517
  411   3HD1  LEU  56          3HD1      LEU  56   5.457  -1.165  -6.668
  412   1HD2  LEU  56          1HD2      LEU  56   7.317   1.561  -8.465
  413   2HD2  LEU  56          2HD2      LEU  56   8.293   0.201  -7.912
  414   3HD2  LEU  56          3HD2      LEU  56   8.399   1.756  -7.086
  415    H    SER  57           H        SER  57   2.755   2.576  -5.141
  416    HA   SER  57           HA       SER  57   1.162   3.687  -7.388
  417   1HB   SER  57          2HB       SER  57   0.679   2.189  -4.834
  418   2HB   SER  57          1HB       SER  57  -0.648   3.084  -5.570
  419    HG   SER  57           HG       SER  57   0.739   0.835  -6.467
  420    H    ASP  58           H        ASP  58   2.072   4.362  -4.009
  421    HA   ASP  58           HA       ASP  58   0.442   6.719  -3.692
  422   1HB   ASP  58          2HB       ASP  58   1.885   5.084  -2.087
  423   2HB   ASP  58          1HB       ASP  58   3.007   6.440  -2.221
  424    H    ILE  59           H        ILE  59   0.883   7.943  -5.673
  425    HA   ILE  59           HA       ILE  59   3.435   8.740  -6.606
  426    HB   ILE  59           HB       ILE  59   0.774  10.204  -6.611
  427   1HG1  ILE  59          2HG1      ILE  59   0.592   7.945  -7.530
  428   2HG1  ILE  59          1HG1      ILE  59   0.535   9.115  -8.849
  429   1HG2  ILE  59          1HG2      ILE  59   2.951  11.468  -7.243
  430   2HG2  ILE  59          2HG2      ILE  59   1.610  11.518  -8.386
  431   3HG2  ILE  59          3HG2      ILE  59   2.969  10.430  -8.669
  432   1HD1  ILE  59          1HD1      ILE  59   2.815   7.323  -8.028
  433   2HD1  ILE  59          2HD1      ILE  59   3.098   8.774  -8.992
  434   3HD1  ILE  59          3HD1      ILE  59   2.063   7.486  -9.615
  435    H    ASP  60           H        ASP  60   1.510   9.953  -3.915
  436    HA   ASP  60           HA       ASP  60   3.550  12.100  -3.457
  437   1HB   ASP  60          2HB       ASP  60   1.764  13.246  -2.269
  438   2HB   ASP  60          1HB       ASP  60   1.140  12.716  -3.832
  439    H    HIS  61           H        HIS  61   2.822   9.028  -2.452
  440    HA   HIS  61           HA       HIS  61   3.097   7.836  -0.425
  441   1HB   HIS  61          2HB       HIS  61   5.370   8.499   0.583
  442   2HB   HIS  61          1HB       HIS  61   5.364   8.033  -1.115
  443    HD1  HIS  61           HD1      HIS  61   5.822  10.983   1.151
  444    HD2  HIS  61           HD2      HIS  61   5.830  10.181  -2.940
  445    HE1  HIS  61           HE1      HIS  61   6.780  13.037   0.019
  446    H    ASP  62           H        ASP  62   1.133   9.644   0.061
  447    HA   ASP  62           HA       ASP  62   1.889  10.956   2.649
  448   1HB   ASP  62          2HB       ASP  62   0.039  12.459   2.173
  449   2HB   ASP  62          1HB       ASP  62   1.013  12.342   0.707
  450    H    GLY  63           H        GLY  63   1.120   8.080   1.989
  451   1HA   GLY  63          2HA       GLY  63  -0.096   6.414   3.117
  452   2HA   GLY  63          1HA       GLY  63  -0.677   7.665   4.219
  453    H    MET  64           H        MET  64  -1.045   7.896   0.716
  454    HA   MET  64           HA       MET  64  -3.892   7.074   0.903
  455   1HB   MET  64          2HB       MET  64  -2.863   9.859   0.373
  456   2HB   MET  64          1HB       MET  64  -4.467   9.348  -0.142
  457   1HG   MET  64          2HG       MET  64  -5.077   8.813   2.145
  458   2HG   MET  64          1HG       MET  64  -3.446   9.200   2.700
  459   1HE   MET  64          1HE       MET  64  -6.544  10.445   3.469
  460   2HE   MET  64          2HE       MET  64  -6.853  10.225   1.749
  461   3HE   MET  64          3HE       MET  64  -6.968  11.833   2.458
  462    H    LEU  65           H        LEU  65  -4.930   7.006  -1.252
  463    HA   LEU  65           HA       LEU  65  -2.964   6.901  -3.518
  464   1HB   LEU  65          2HB       LEU  65  -5.095   5.003  -2.565
  465   2HB   LEU  65          1HB       LEU  65  -4.707   5.059  -4.282
  466    HG   LEU  65           HG       LEU  65  -2.859   4.369  -1.990
  467   1HD1  LEU  65          1HD1      LEU  65  -3.412   2.887  -4.567
  468   2HD1  LEU  65          2HD1      LEU  65  -4.403   2.659  -3.128
  469   3HD1  LEU  65          3HD1      LEU  65  -2.685   2.259  -3.088
  470   1HD2  LEU  65          1HD2      LEU  65  -1.453   5.709  -3.326
  471   2HD2  LEU  65          2HD2      LEU  65  -2.260   5.227  -4.818
  472   3HD2  LEU  65          3HD2      LEU  65  -1.193   4.095  -3.988
  473    H    ASP  66           H        ASP  66  -3.560   8.780  -4.649
  474    HA   ASP  66           HA       ASP  66  -6.260   9.792  -4.753
  475   1HB   ASP  66          2HB       ASP  66  -3.880  10.846  -5.222
  476   2HB   ASP  66          1HB       ASP  66  -4.221  10.330  -6.872
  477    H    ARG  67           H        ARG  67  -7.531   9.942  -6.793
  478    HA   ARG  67           HA       ARG  67  -8.346   7.558  -7.924
  479   1HB   ARG  67          2HB       ARG  67  -9.119   8.975  -9.814
  480   2HB   ARG  67          1HB       ARG  67  -9.400   9.756  -8.257
  481   1HG   ARG  67          2HG       ARG  67  -6.986  10.750  -8.692
  482   2HG   ARG  67          1HG       ARG  67  -7.396  10.424 -10.377
  483   1HD   ARG  67          2HD       ARG  67  -9.591  11.700  -8.895
  484   2HD   ARG  67          1HD       ARG  67  -8.133  12.705  -9.002
  485    HE   ARG  67           HE       ARG  67  -8.186  12.116 -11.511
  486   1HH1  ARG  67          1HH2      ARG  67 -10.573  13.640  -9.842
  487   2HH1  ARG  67          2HH2      ARG  67 -11.851  13.316 -10.964
  488   1HH2  ARG  67          2HH1      ARG  67 -10.006  11.044 -12.821
  489   2HH2  ARG  67          1HH1      ARG  67 -11.531  11.848 -12.650
  490    H    ASP  68           H        ASP  68  -5.587   9.532  -8.939
  491    HA   ASP  68           HA       ASP  68  -4.958   7.796 -11.221
  492   1HB   ASP  68          2HB       ASP  68  -4.359  10.406 -10.276
  493   2HB   ASP  68          1HB       ASP  68  -2.822   9.545 -10.380
  494    H    GLU  69           H        GLU  69  -3.833   8.268  -7.898
  495    HA   GLU  69           HA       GLU  69  -1.541   6.481  -8.164
  496   1HB   GLU  69          2HB       GLU  69  -3.042   7.324  -5.667
  497   2HB   GLU  69          1HB       GLU  69  -1.344   6.861  -5.789
  498   1HG   GLU  69          2HG       GLU  69  -1.105   8.836  -7.424
  499   2HG   GLU  69          1HG       GLU  69  -2.674   9.363  -6.824
  500    H    PHE  70           H        PHE  70  -4.856   6.213  -6.887
  501    HA   PHE  70           HA       PHE  70  -4.719   3.520  -5.957
  502   1HB   PHE  70          2HB       PHE  70  -6.510   5.350  -5.671
  503   2HB   PHE  70          1HB       PHE  70  -7.092   4.879  -7.267
  504    HD1  PHE  70           HD1      PHE  70  -6.715   3.849  -3.754
  505    HD2  PHE  70           HD2      PHE  70  -8.110   2.688  -7.646
  506    HE1  PHE  70           HE1      PHE  70  -7.965   1.965  -2.744
  507    HE2  PHE  70           HE2      PHE  70  -9.361   0.804  -6.634
  508    HZ   PHE  70           HZ       PHE  70  -9.289   0.445  -4.181
  509    H    ALA  71           H        ALA  71  -4.991   4.922  -9.154
  510    HA   ALA  71           HA       ALA  71  -5.874   2.527 -10.539
  511   1HB   ALA  71          1HB       ALA  71  -5.462   3.865 -12.482
  512   2HB   ALA  71          2HB       ALA  71  -4.255   4.836 -11.638
  513   3HB   ALA  71          3HB       ALA  71  -5.967   5.009 -11.238
  514    H    VAL  72           H        VAL  72  -2.743   4.168 -10.222
  515    HA   VAL  72           HA       VAL  72  -1.120   2.315 -11.591
  516    HB   VAL  72           HB       VAL  72  -0.693   4.126  -9.199
  517   1HG1  VAL  72          1HG1      VAL  72   1.147   2.741  -8.956
  518   2HG1  VAL  72          2HG1      VAL  72   1.780   3.905 -10.117
  519   3HG1  VAL  72          3HG1      VAL  72   1.199   2.333 -10.668
  520   1HG2  VAL  72          1HG2      VAL  72  -1.351   5.112 -11.430
  521   2HG2  VAL  72          2HG2      VAL  72   0.134   4.435 -12.104
  522   3HG2  VAL  72          3HG2      VAL  72   0.220   5.663 -10.838
  523    H    ALA  73           H        ALA  73  -2.574   2.182  -8.410
  524    HA   ALA  73           HA       ALA  73  -0.963  -0.139  -7.533
  525   1HB   ALA  73          1HB       ALA  73  -1.885   0.355  -5.450
  526   2HB   ALA  73          2HB       ALA  73  -3.395   0.942  -6.149
  527   3HB   ALA  73          3HB       ALA  73  -1.940   1.940  -6.223
  528    H    MET  74           H        MET  74  -3.661   0.273  -9.508
  529    HA   MET  74           HA       MET  74  -5.081  -2.128  -8.508
  530   1HB   MET  74          2HB       MET  74  -5.504  -0.056 -10.672
  531   2HB   MET  74          1HB       MET  74  -6.520  -1.496 -10.577
  532   1HG   MET  74          2HG       MET  74  -6.108   0.050  -8.060
  533   2HG   MET  74          1HG       MET  74  -7.156   0.762  -9.286
  534   1HE   MET  74          1HE       MET  74  -8.077  -1.973  -6.131
  535   2HE   MET  74          2HE       MET  74  -6.568  -1.169  -6.560
  536   3HE   MET  74          3HE       MET  74  -6.846  -2.832  -7.069
  537    H    PHE  75           H        PHE  75  -3.268  -1.099 -11.404
  538    HA   PHE  75           HA       PHE  75  -3.434  -3.774 -12.586
  539   1HB   PHE  75          2HB       PHE  75  -2.385  -2.754 -14.418
  540   2HB   PHE  75          1HB       PHE  75  -3.214  -1.387 -13.680
  541    HD1  PHE  75           HD1      PHE  75   0.060  -3.177 -13.786
  542    HD2  PHE  75           HD2      PHE  75  -2.001   0.489 -12.913
  543    HE1  PHE  75           HE1      PHE  75   2.235  -2.021 -13.509
  544    HE2  PHE  75           HE2      PHE  75   0.174   1.641 -12.634
  545    HZ   PHE  75           HZ       PHE  75   2.291   0.389 -12.932
  546    H    LEU  76           H        LEU  76  -1.459  -2.105 -10.315
  547    HA   LEU  76           HA       LEU  76   0.938  -3.760 -10.620
  548   1HB   LEU  76          2HB       LEU  76  -0.056  -1.486  -9.047
  549   2HB   LEU  76          1HB       LEU  76   0.974  -2.574  -8.119
  550    HG   LEU  76           HG       LEU  76   1.705  -1.400 -10.817
  551   1HD1  LEU  76          1HD1      LEU  76   2.266  -0.553  -7.986
  552   2HD1  LEU  76          2HD1      LEU  76   1.836   0.442  -9.378
  553   3HD1  LEU  76          3HD1      LEU  76   3.459  -0.237  -9.246
  554   1HD2  LEU  76          1HD2      LEU  76   2.893  -3.429 -10.570
  555   2HD2  LEU  76          2HD2      LEU  76   3.087  -3.205  -8.832
  556   3HD2  LEU  76          3HD2      LEU  76   4.017  -2.216  -9.957
  557    H    VAL  77           H        VAL  77  -2.095  -3.904  -8.932
  558    HA   VAL  77           HA       VAL  77  -1.180  -6.018  -7.073
  559    HB   VAL  77           HB       VAL  77  -3.678  -4.377  -7.559
  560   1HG1  VAL  77          1HG1      VAL  77  -3.434  -6.876  -5.846
  561   2HG1  VAL  77          2HG1      VAL  77  -4.552  -6.612  -7.183
  562   3HG1  VAL  77          3HG1      VAL  77  -4.738  -5.701  -5.685
  563   1HG2  VAL  77          1HG2      VAL  77  -3.123  -4.396  -4.873
  564   2HG2  VAL  77          2HG2      VAL  77  -2.495  -3.199  -6.005
  565   3HG2  VAL  77          3HG2      VAL  77  -1.509  -4.589  -5.558
  566    H    TYR  78           H        TYR  78  -3.239  -5.628  -9.946
  567    HA   TYR  78           HA       TYR  78  -4.066  -8.430  -9.918
  568   1HB   TYR  78          2HB       TYR  78  -4.475  -5.976 -11.551
  569   2HB   TYR  78          1HB       TYR  78  -4.725  -7.521 -12.369
  570    HD1  TYR  78           HD1      TYR  78  -6.573  -5.105 -10.956
  571    HD2  TYR  78           HD2      TYR  78  -5.764  -9.277 -10.345
  572    HE1  TYR  78           HE1      TYR  78  -8.758  -5.360  -9.808
  573    HE2  TYR  78           HE2      TYR  78  -7.948  -9.536  -9.197
  574    HH   TYR  78           HH       TYR  78 -10.297  -8.094  -9.372
  575    H    CYS  79           H        CYS  79  -1.435  -6.574 -11.269
  576    HA   CYS  79           HA       CYS  79  -0.704  -8.641 -13.223
  577   1HB   CYS  79          2HB       CYS  79   0.497  -6.056 -12.208
  578   2HB   CYS  79          1HB       CYS  79   1.354  -7.085 -13.353
  579    HG   CYS  79           HG       CYS  79  -0.339  -6.543 -15.153
  580    H    ALA  80           H        ALA  80  -0.146  -7.952  -9.876
  581    HA   ALA  80           HA       ALA  80   2.381  -9.395  -9.653
  582   1HB   ALA  80          1HB       ALA  80   1.837  -7.655  -8.072
  583   2HB   ALA  80          2HB       ALA  80   1.765  -9.179  -7.186
  584   3HB   ALA  80          3HB       ALA  80   0.276  -8.395  -7.714
  585    H    LEU  81           H        LEU  81  -0.932 -10.208  -9.914
  586    HA   LEU  81           HA       LEU  81  -0.669 -12.809  -8.556
  587   1HB   LEU  81          2HB       LEU  81  -2.847 -11.191  -9.847
  588   2HB   LEU  81          1HB       LEU  81  -3.119 -12.876  -9.396
  589    HG   LEU  81           HG       LEU  81  -1.793 -11.497  -7.244
  590   1HD1  LEU  81          1HD1      LEU  81  -2.951  -9.577  -6.990
  591   2HD1  LEU  81          2HD1      LEU  81  -4.479 -10.343  -7.429
  592   3HD1  LEU  81          3HD1      LEU  81  -3.387  -9.760  -8.688
  593   1HD2  LEU  81          1HD2      LEU  81  -3.204 -12.821  -6.059
  594   2HD2  LEU  81          2HD2      LEU  81  -3.620 -13.525  -7.621
  595   3HD2  LEU  81          3HD2      LEU  81  -4.621 -12.242  -6.936
  596    H    GLU  82           H        GLU  82  -1.533 -11.641 -11.827
  597    HA   GLU  82           HA       GLU  82  -0.793 -14.357 -12.846
  598   1HB   GLU  82          2HB       GLU  82  -2.540 -12.525 -14.414
  599   2HB   GLU  82          1HB       GLU  82  -2.646 -14.271 -14.212
  600   1HG   GLU  82          2HG       GLU  82  -3.363 -12.226 -12.087
  601   2HG   GLU  82          1HG       GLU  82  -4.525 -13.089 -13.095
  602    H    LYS  83           H        LYS  83   0.325 -11.167 -12.888
  603    HA   LYS  83           HA       LYS  83   1.331 -11.443 -15.685
  604   1HB   LYS  83          2HB       LYS  83   0.074  -9.402 -14.696
  605   2HB   LYS  83          1HB       LYS  83   1.619  -9.013 -13.942
  606   1HG   LYS  83          2HG       LYS  83   1.760  -7.867 -15.980
  607   2HG   LYS  83          1HG       LYS  83   2.588  -9.382 -16.346
  608   1HD   LYS  83          2HD       LYS  83   1.106  -9.755 -17.997
  609   2HD   LYS  83          1HD       LYS  83  -0.177  -9.837 -16.789
  610   1HE   LYS  83          2HE       LYS  83   0.025  -7.173 -16.919
  611   2HE   LYS  83          1HE       LYS  83   0.616  -7.552 -18.547
  612   1HZ   LYS  83          1HZ       LYS  83  -2.020  -7.612 -17.652
  613   2HZ   LYS  83          2HZ       LYS  83  -1.568  -9.227 -17.915
  614   3HZ   LYS  83          3HZ       LYS  83  -1.435  -8.088 -19.170
  615    H    GLU  84           H        GLU  84   2.807  -9.871 -12.841
  616    HA   GLU  84           HA       GLU  84   5.091 -11.736 -12.881
  617   1HB   GLU  84          2HB       GLU  84   4.964  -9.309 -14.454
  618   2HB   GLU  84          1HB       GLU  84   6.260  -9.188 -13.263
  619   1HG   GLU  84          2HG       GLU  84   7.089 -11.428 -14.010
  620   2HG   GLU  84          1HG       GLU  84   5.864 -11.414 -15.281
  621    HA   PRO  85           HA       PRO  85   5.750 -10.173  -8.829
  622   1HB   PRO  85          2HB       PRO  85   8.423  -9.593  -8.672
  623   2HB   PRO  85          1HB       PRO  85   7.793 -11.252  -8.715
  624   1HG   PRO  85          2HG       PRO  85   8.982  -9.625 -10.907
  625   2HG   PRO  85          1HG       PRO  85   9.171 -11.349 -10.549
  626   1HD   PRO  85          2HD       PRO  85   7.531 -10.403 -12.507
  627   2HD   PRO  85          1HD       PRO  85   7.238 -11.924 -11.636
  628    H    VAL  86           H        VAL  86   6.576  -8.174  -7.547
  629    HA   VAL  86           HA       VAL  86   6.265  -5.748  -9.279
  630    HB   VAL  86           HB       VAL  86   5.514  -6.346  -6.402
  631   1HG1  VAL  86          1HG1      VAL  86   6.301  -3.982  -6.805
  632   2HG1  VAL  86          2HG1      VAL  86   4.619  -4.104  -6.290
  633   3HG1  VAL  86          3HG1      VAL  86   5.003  -3.813  -7.986
  634   1HG2  VAL  86          1HG2      VAL  86   3.360  -6.617  -7.152
  635   2HG2  VAL  86          2HG2      VAL  86   4.190  -7.090  -8.634
  636   3HG2  VAL  86          3HG2      VAL  86   3.557  -5.452  -8.462
  637    HA   PRO  87           HA       PRO  87  10.312  -4.833  -7.654
  638   1HB   PRO  87          2HB       PRO  87  10.783  -2.688  -9.282
  639   2HB   PRO  87          1HB       PRO  87  10.920  -4.365  -9.842
  640   1HG   PRO  87          2HG       PRO  87   8.847  -2.365 -10.413
  641   2HG   PRO  87          1HG       PRO  87   9.325  -3.795 -11.337
  642   1HD   PRO  87          2HD       PRO  87   7.073  -3.509  -9.631
  643   2HD   PRO  87          1HD       PRO  87   7.624  -4.983 -10.455
  644    H    MET  88           H        MET  88  11.268  -2.325  -7.216
  645    HA   MET  88           HA       MET  88   9.126  -1.021  -5.559
  646   1HB   MET  88          2HB       MET  88  12.110  -0.852  -5.157
  647   2HB   MET  88          1HB       MET  88  10.836  -0.505  -3.993
  648   1HG   MET  88          2HG       MET  88  10.315  -2.800  -3.699
  649   2HG   MET  88          1HG       MET  88  11.168  -3.268  -5.170
  650   1HE   MET  88          1HE       MET  88  13.107  -5.041  -4.293
  651   2HE   MET  88          2HE       MET  88  14.541  -4.018  -4.357
  652   3HE   MET  88          3HE       MET  88  13.236  -3.767  -5.514
  653    H    SER  89           H        SER  89  10.551  -0.611  -8.430
  654    HA   SER  89           HA       SER  89  11.077   2.301  -7.984
  655   1HB   SER  89          2HB       SER  89  12.579   2.145  -9.809
  656   2HB   SER  89          1HB       SER  89  12.895   0.758  -8.775
  657    HG   SER  89           HG       SER  89  11.655  -0.501 -10.186
  658    H    LEU  90           H        LEU  90   9.084   3.138  -8.325
  659    HA   LEU  90           HA       LEU  90   7.126   2.438 -10.230
  660   1HB   LEU  90          2HB       LEU  90   7.684   4.507  -8.399
  661   2HB   LEU  90          1HB       LEU  90   7.435   5.315  -9.946
  662    HG   LEU  90           HG       LEU  90   5.546   3.448  -8.507
  663   1HD1  LEU  90          1HD1      LEU  90   5.172   5.629  -7.741
  664   2HD1  LEU  90          2HD1      LEU  90   4.040   5.513  -9.088
  665   3HD1  LEU  90          3HD1      LEU  90   5.578   6.349  -9.299
  666   1HD2  LEU  90          1HD2      LEU  90   4.415   4.498 -10.918
  667   2HD2  LEU  90          2HD2      LEU  90   4.691   2.809 -10.494
  668   3HD2  LEU  90          3HD2      LEU  90   5.944   3.723 -11.331
  669    HA   PRO  91           HA       PRO  91   9.775   3.331 -13.786
  670   1HB   PRO  91          2HB       PRO  91   8.086   2.192 -15.630
  671   2HB   PRO  91          1HB       PRO  91   9.244   1.261 -14.659
  672   1HG   PRO  91          2HG       PRO  91   6.320   1.660 -14.249
  673   2HG   PRO  91          1HG       PRO  91   7.296   0.197 -14.048
  674   1HD   PRO  91          2HD       PRO  91   6.508   1.699 -11.939
  675   2HD   PRO  91          1HD       PRO  91   8.049   0.814 -11.957
  676    HA   PRO  92           HA       PRO  92   7.779   7.057 -14.947
  677   1HB   PRO  92          2HB       PRO  92   9.151   7.558 -17.264
  678   2HB   PRO  92          1HB       PRO  92   9.855   7.789 -15.651
  679   1HG   PRO  92          2HG       PRO  92  10.185   5.521 -17.556
  680   2HG   PRO  92          1HG       PRO  92  11.391   6.310 -16.524
  681   1HD   PRO  92          2HD       PRO  92  10.258   3.935 -15.890
  682   2HD   PRO  92          1HD       PRO  92  10.780   5.110 -14.661
  683    H    ALA  93           H        ALA  93   7.471   4.171 -16.636
  684    HA   ALA  93           HA       ALA  93   5.997   5.185 -18.949
  685   1HB   ALA  93          1HB       ALA  93   6.585   3.110 -19.622
  686   2HB   ALA  93          2HB       ALA  93   5.501   2.423 -18.411
  687   3HB   ALA  93          3HB       ALA  93   7.187   2.748 -18.004
  688    H    LEU  94           H        LEU  94   5.289   4.962 -15.692
  689    HA   LEU  94           HA       LEU  94   2.400   4.987 -16.296
  690   1HB   LEU  94          2HB       LEU  94   1.939   3.061 -15.149
  691   2HB   LEU  94          1HB       LEU  94   3.604   2.686 -15.572
  692    HG   LEU  94           HG       LEU  94   3.867   4.142 -13.221
  693   1HD1  LEU  94          1HD1      LEU  94   1.943   2.154 -12.326
  694   2HD1  LEU  94          2HD1      LEU  94   1.185   3.364 -13.363
  695   3HD1  LEU  94          3HD1      LEU  94   2.055   3.865 -11.914
  696   1HD2  LEU  94          1HD2      LEU  94   4.212   1.429 -14.185
  697   2HD2  LEU  94          2HD2      LEU  94   3.743   1.443 -12.484
  698   3HD2  LEU  94          3HD2      LEU  94   5.170   2.331 -13.012
  699    H    VAL  95           H        VAL  95   4.224   7.105 -15.499
  700    HA   VAL  95           HA       VAL  95   3.067   7.748 -12.804
  701    HB   VAL  95           HB       VAL  95   5.811   8.229 -13.989
  702   1HG1  VAL  95          1HG1      VAL  95   5.536  10.237 -12.862
  703   2HG1  VAL  95          2HG1      VAL  95   6.103   9.216 -11.540
  704   3HG1  VAL  95          3HG1      VAL  95   4.381   9.553 -11.716
  705   1HG2  VAL  95          1HG2      VAL  95   4.840   6.088 -12.594
  706   2HG2  VAL  95          2HG2      VAL  95   5.435   7.102 -11.279
  707   3HG2  VAL  95          3HG2      VAL  95   6.528   6.596 -12.567
  708    HA   PRO  96           HA       PRO  96   1.514  11.263 -15.036
  709   1HB   PRO  96          2HB       PRO  96   0.491  12.583 -12.866
  710   2HB   PRO  96          1HB       PRO  96  -0.309  11.183 -13.610
  711   1HG   PRO  96          2HG       PRO  96   1.354  11.325 -11.147
  712   2HG   PRO  96          1HG       PRO  96  -0.096  10.365 -11.479
  713   1HD   PRO  96          2HD       PRO  96   2.442   9.353 -11.536
  714   2HD   PRO  96          1HD       PRO  96   1.088   8.681 -12.472
  715    HA   PRO  97           HA       PRO  97   4.477  14.450 -14.425
  716   1HB   PRO  97          2HB       PRO  97   3.030  16.768 -14.588
  717   2HB   PRO  97          1HB       PRO  97   3.363  15.737 -15.993
  718   1HG   PRO  97          2HG       PRO  97   0.891  15.963 -14.358
  719   2HG   PRO  97          1HG       PRO  97   1.074  15.730 -16.102
  720   1HD   PRO  97          2HD       PRO  97   0.450  13.721 -14.354
  721   2HD   PRO  97          1HD       PRO  97   1.273  13.462 -15.909
  722    H    SER  98           H        SER  98   4.841  16.613 -13.098
  723    HA   SER  98           HA       SER  98   4.854  17.736 -11.021
  724   1HB   SER  98          2HB       SER  98   2.824  17.798 -10.012
  725   2HB   SER  98          1HB       SER  98   2.296  16.646 -11.235
  726    HG   SER  98           HG       SER  98   1.917  15.584  -9.395
  727    H    LYS  99           H        LYS  99   4.403  14.211 -10.790
  728    HA   LYS  99           HA       LYS  99   6.248  14.093  -8.490
  729   1HB   LYS  99          2HB       LYS  99   4.274  12.671  -8.507
  730   2HB   LYS  99          1HB       LYS  99   4.683  12.052 -10.106
  731   1HG   LYS  99          2HG       LYS  99   5.278  10.490  -8.222
  732   2HG   LYS  99          1HG       LYS  99   6.645  10.931  -9.243
  733   1HD   LYS  99          2HD       LYS  99   7.166  12.769  -7.573
  734   2HD   LYS  99          1HD       LYS  99   5.951  12.049  -6.517
  735   1HE   LYS  99          2HE       LYS  99   7.190   9.989  -6.354
  736   2HE   LYS  99          1HE       LYS  99   8.306  10.494  -7.638
  737   1HZ   LYS  99          1HZ       LYS  99   8.463  12.581  -6.001
  738   2HZ   LYS  99          2HZ       LYS  99   9.509  11.247  -5.898
  739   3HZ   LYS  99          3HZ       LYS  99   8.167  11.360  -4.862
  740    H    ARG 100           H        ARG 100   6.732  14.652 -11.638
  741    HA   ARG 100           HA       ARG 100   8.425  12.689 -12.720
  742   1HB   ARG 100          2HB       ARG 100   8.763  15.707 -12.780
  743   2HB   ARG 100          1HB       ARG 100   9.367  14.570 -13.986
  744   1HG   ARG 100          2HG       ARG 100   6.597  14.026 -13.637
  745   2HG   ARG 100          1HG       ARG 100   6.766  15.772 -13.822
  746   1HD   ARG 100          2HD       ARG 100   6.709  15.179 -16.064
  747   2HD   ARG 100          1HD       ARG 100   8.450  14.975 -15.780
  748    HE   ARG 100           HE       ARG 100   6.530  12.698 -15.450
  749   1HH1  ARG 100          1HH2      ARG 100   9.400  12.338 -14.665
  750   2HH1  ARG 100          2HH2      ARG 100  10.083  11.638 -16.095
  751   1HH2  ARG 100          2HH1      ARG 100   7.433  12.556 -18.134
  752   2HH2  ARG 100          1HH1      ARG 100   8.970  11.762 -18.058
  753    H    SER 107           1H       SER 107   2.399   7.596   9.368
  754    HA   SER 107           HA       SER 107  -0.231   6.572   8.468
  755   1HB   SER 107          2HB       SER 107   0.133   8.738   9.750
  756   2HB   SER 107          1HB       SER 107   1.092   9.300   8.384
  757    HG   SER 107           HG       SER 107  -0.787   9.892   7.640
  758    H    THR 108           H        THR 108   1.614   5.190   7.100
  759    HA   THR 108           HA       THR 108   1.648   6.524   4.445
  760    HB   THR 108           HB       THR 108   3.758   7.111   5.611
  761    HG1  THR 108           HG1      THR 108   5.138   6.262   3.994
  762   1HG2  THR 108          1HG2      THR 108   4.841   4.386   5.527
  763   2HG2  THR 108          2HG2      THR 108   3.539   4.584   6.699
  764   3HG2  THR 108          3HG2      THR 108   4.972   5.609   6.790
  765    H    ASN 109           H        ASN 109   3.719   4.280   3.812
  766    HA   ASN 109           HA       ASN 109   2.180   2.415   2.508
  767   1HB   ASN 109          2HB       ASN 109   4.718   2.681   2.734
  768   2HB   ASN 109          1HB       ASN 109   4.590   1.685   4.184
  769   1HD2  ASN 109          1HD2      ASN 109   5.964   0.917   1.680
  770   2HD2  ASN 109          2HD2      ASN 109   5.165  -0.460   1.094
  771    HA   PRO 110           HA       PRO 110   0.028   0.623   6.015
  772   1HB   PRO 110          2HB       PRO 110  -1.903  -0.618   4.538
  773   2HB   PRO 110          1HB       PRO 110  -1.939   1.116   4.912
  774   1HG   PRO 110          2HG       PRO 110  -1.243  -0.253   2.390
  775   2HG   PRO 110          1HG       PRO 110  -1.962   1.341   2.653
  776   1HD   PRO 110          2HD       PRO 110   0.711   0.824   2.017
  777   2HD   PRO 110          1HD       PRO 110   0.056   2.355   2.633
  778    H    PHE 111           H        PHE 111   2.256  -0.742   4.187
  779    HA   PHE 111           HA       PHE 111   1.635  -3.501   5.152
  780   1HB   PHE 111          2HB       PHE 111   2.434  -2.592   2.375
  781   2HB   PHE 111          1HB       PHE 111   2.535  -4.276   2.889
  782    HD1  PHE 111           HD1      PHE 111   0.444  -1.810   1.441
  783    HD2  PHE 111           HD2      PHE 111   0.353  -5.246   4.015
  784    HE1  PHE 111           HE1      PHE 111  -1.976  -2.096   0.973
  785    HE2  PHE 111           HE2      PHE 111  -2.066  -5.531   3.549
  786    HZ   PHE 111           HZ       PHE 111  -3.228  -3.957   2.027
  787    H    LEU 112           HN       LEU 112   3.480  -1.357   6.105
  788    HA   LEU 112           HA       LEU 112   6.013  -2.935   5.934
  789   1HB   LEU 112          2HB       LEU 112   5.486  -0.523   4.607
  790   2HB   LEU 112          1HB       LEU 112   6.439  -0.054   6.014
  791    HG   LEU 112           HG       LEU 112   7.977  -2.048   5.350
  792   1HD1  LEU 112          1HD1      LEU 112   6.969  -1.465   2.585
  793   2HD1  LEU 112          2HD1      LEU 112   6.134  -2.672   3.563
  794   3HD1  LEU 112          3HD1      LEU 112   7.844  -2.875   3.177
  795   1HD2  LEU 112          1HD2      LEU 112   7.746   0.678   4.180
  796   2HD2  LEU 112          2HD2      LEU 112   8.863  -0.426   3.377
  797   3HD2  LEU 112          3HD2      LEU 112   9.073  -0.047   5.087
  Start of MODEL    5
    1    HA   PRO   6           HA       PRO   6   2.501   7.762 -22.287
    2   1HB   PRO   6          2HB       PRO   6   0.055   6.544 -22.203
    3   2HB   PRO   6          1HB       PRO   6   0.658   7.400 -23.636
    4   1HG   PRO   6          2HG       PRO   6   0.569   4.481 -23.075
    5   2HG   PRO   6          1HG       PRO   6   0.289   5.348 -24.591
    6   1HD   PRO   6          2HD       PRO   6   2.617   4.044 -23.992
    7   2HD   PRO   6          1HD       PRO   6   2.514   5.423 -25.109
    8    H    TRP   7           H        TRP   7   0.596   7.272 -20.393
    9    HA   TRP   7           HA       TRP   7   2.030   6.383 -18.112
   10   1HB   TRP   7          2HB       TRP   7   0.077   7.881 -18.118
   11   2HB   TRP   7          1HB       TRP   7  -0.947   6.564 -18.686
   12    HD1  TRP   7           HD1      TRP   7   1.586   5.408 -16.256
   13    HE1  TRP   7           HE1      TRP   7   0.503   5.010 -13.948
   14    HE3  TRP   7           HE3      TRP   7  -2.936   7.644 -17.014
   15    HZ2  TRP   7           HZ2      TRP   7  -1.961   5.572 -12.603
   16    HZ3  TRP   7           HZ3      TRP   7  -4.633   7.701 -15.209
   17    HH2  TRP   7           HH2      TRP   7  -4.151   6.671 -13.006
   18    H    ALA   8           H        ALA   8   2.531   4.313 -17.496
   19    HA   ALA   8           HA       ALA   8   2.105   1.950 -18.837
   20   1HB   ALA   8          1HB       ALA   8   2.151   0.955 -16.432
   21   2HB   ALA   8          2HB       ALA   8   2.249   2.635 -15.905
   22   3HB   ALA   8          3HB       ALA   8   3.511   1.959 -16.936
   23    H    VAL   9           H        VAL   9  -0.248   3.695 -16.908
   24    HA   VAL   9           HA       VAL   9  -2.187   1.441 -17.080
   25    HB   VAL   9           HB       VAL   9  -2.104   4.114 -15.655
   26   1HG1  VAL   9          1HG1      VAL   9  -4.258   2.003 -15.406
   27   2HG1  VAL   9          2HG1      VAL   9  -4.427   3.423 -16.439
   28   3HG1  VAL   9          3HG1      VAL   9  -4.244   3.616 -14.694
   29   1HG2  VAL   9          1HG2      VAL   9  -1.689   1.236 -14.922
   30   2HG2  VAL   9          2HG2      VAL   9  -2.363   2.327 -13.710
   31   3HG2  VAL   9          3HG2      VAL   9  -0.781   2.660 -14.414
   32    H    LYS  10           H        LYS  10  -3.983   1.539 -18.425
   33    HA   LYS  10           HA       LYS  10  -4.101   3.794 -20.359
   34   1HB   LYS  10          2HB       LYS  10  -4.816   0.928 -20.211
   35   2HB   LYS  10          1HB       LYS  10  -5.961   1.919 -21.111
   36   1HG   LYS  10          2HG       LYS  10  -3.267   2.685 -21.802
   37   2HG   LYS  10          1HG       LYS  10  -3.462   0.943 -22.009
   38   1HD   LYS  10          2HD       LYS  10  -4.425   1.439 -23.994
   39   2HD   LYS  10          1HD       LYS  10  -5.819   1.965 -23.049
   40   1HE   LYS  10          2HE       LYS  10  -5.432   3.932 -24.211
   41   2HE   LYS  10          1HE       LYS  10  -4.301   4.202 -22.869
   42   1HZ   LYS  10          1HZ       LYS  10  -2.893   2.596 -24.522
   43   2HZ   LYS  10          2HZ       LYS  10  -2.748   4.287 -24.463
   44   3HZ   LYS  10          3HZ       LYS  10  -3.747   3.557 -25.628
   45    HA   PRO  11           HA       PRO  11  -7.841   5.513 -18.837
   46   1HB   PRO  11          2HB       PRO  11  -9.572   5.490 -20.965
   47   2HB   PRO  11          1HB       PRO  11  -8.197   6.606 -20.840
   48   1HG   PRO  11          2HG       PRO  11  -8.423   4.048 -22.358
   49   2HG   PRO  11          1HG       PRO  11  -7.690   5.586 -22.846
   50   1HD   PRO  11          2HD       PRO  11  -6.207   3.498 -22.007
   51   2HD   PRO  11          1HD       PRO  11  -5.738   5.182 -21.681
   52    H    GLU  12           H        GLU  12  -8.371   2.503 -20.670
   53    HA   GLU  12           HA       GLU  12 -10.918   1.900 -19.412
   54   1HB   GLU  12          2HB       GLU  12 -10.626  -0.237 -20.555
   55   2HB   GLU  12          1HB       GLU  12 -10.102   1.059 -21.627
   56   1HG   GLU  12          2HG       GLU  12  -7.987   0.276 -21.688
   57   2HG   GLU  12          1HG       GLU  12  -7.927   0.093 -19.937
   58    H    ASP  13           H        ASP  13  -7.565   1.419 -18.578
   59    HA   ASP  13           HA       ASP  13  -8.100  -0.593 -16.504
   60   1HB   ASP  13          2HB       ASP  13  -5.815   0.800 -17.777
   61   2HB   ASP  13          1HB       ASP  13  -5.576   0.387 -16.079
   62    H    LYS  14           H        LYS  14  -7.377   2.866 -16.737
   63    HA   LYS  14           HA       LYS  14  -7.365   3.351 -13.881
   64   1HB   LYS  14          2HB       LYS  14  -6.341   4.727 -15.790
   65   2HB   LYS  14          1HB       LYS  14  -7.978   5.291 -16.125
   66   1HG   LYS  14          2HG       LYS  14  -7.264   5.470 -13.287
   67   2HG   LYS  14          1HG       LYS  14  -6.227   6.451 -14.322
   68   1HD   LYS  14          2HD       LYS  14  -7.965   7.804 -15.022
   69   2HD   LYS  14          1HD       LYS  14  -9.174   6.536 -14.815
   70   1HE   LYS  14          2HE       LYS  14  -9.552   7.088 -12.626
   71   2HE   LYS  14          1HE       LYS  14  -7.833   7.403 -12.314
   72   1HZ   LYS  14          1HZ       LYS  14  -9.103   9.467 -12.309
   73   2HZ   LYS  14          2HZ       LYS  14  -9.658   9.150 -13.883
   74   3HZ   LYS  14          3HZ       LYS  14  -8.008   9.443 -13.604
   75    H    ALA  15           H        ALA  15  -9.781   2.858 -16.270
   76    HA   ALA  15           HA       ALA  15 -11.949   4.347 -15.046
   77   1HB   ALA  15          1HB       ALA  15 -12.640   1.982 -16.635
   78   2HB   ALA  15          2HB       ALA  15 -11.419   2.983 -17.418
   79   3HB   ALA  15          3HB       ALA  15 -12.973   3.681 -16.966
   80    H    LYS  16           H        LYS  16 -10.940   0.912 -15.029
   81    HA   LYS  16           HA       LYS  16 -13.019   0.156 -13.129
   82   1HB   LYS  16          2HB       LYS  16 -12.353  -1.908 -13.812
   83   2HB   LYS  16          1HB       LYS  16 -11.259  -1.084 -14.917
   84   1HG   LYS  16          2HG       LYS  16  -9.424  -1.313 -13.458
   85   2HG   LYS  16          1HG       LYS  16 -10.453  -1.649 -12.065
   86   1HD   LYS  16          2HD       LYS  16  -9.339  -3.700 -12.953
   87   2HD   LYS  16          1HD       LYS  16 -11.099  -3.801 -13.006
   88   1HE   LYS  16          2HE       LYS  16 -11.175  -3.516 -15.342
   89   2HE   LYS  16          1HE       LYS  16  -9.556  -2.787 -15.395
   90   1HZ   LYS  16          1HZ       LYS  16  -8.557  -4.835 -14.837
   91   2HZ   LYS  16          2HZ       LYS  16  -9.670  -5.193 -16.070
   92   3HZ   LYS  16          3HZ       LYS  16 -10.044  -5.556 -14.453
   93    H    TYR  17           H        TYR  17  -9.719   1.321 -12.997
   94    HA   TYR  17           HA       TYR  17  -9.157   0.668 -10.239
   95   1HB   TYR  17          2HB       TYR  17  -8.163   2.864 -12.094
   96   2HB   TYR  17          1HB       TYR  17  -7.403   2.430 -10.568
   97    HD1  TYR  17           HD1      TYR  17  -8.699  -0.543 -11.873
   98    HD2  TYR  17           HD2      TYR  17  -5.503   2.255 -12.495
   99    HE1  TYR  17           HE1      TYR  17  -7.391  -2.295 -13.034
  100    HE2  TYR  17           HE2      TYR  17  -4.184   0.499 -13.647
  101    HH   TYR  17           HH       TYR  17  -4.977  -2.775 -13.509
  102    H    ASP  18           H        ASP  18 -10.732   3.332 -11.914
  103    HA   ASP  18           HA       ASP  18 -10.962   5.056  -9.568
  104   1HB   ASP  18          2HB       ASP  18 -10.902   6.046 -11.744
  105   2HB   ASP  18          1HB       ASP  18 -12.147   4.951 -12.350
  106    H    ALA  19           H        ALA  19 -12.569   2.246 -10.585
  107    HA   ALA  19           HA       ALA  19 -15.157   2.978  -9.308
  108   1HB   ALA  19          1HB       ALA  19 -14.100   0.972 -11.199
  109   2HB   ALA  19          2HB       ALA  19 -15.729   1.635 -11.073
  110   3HB   ALA  19          3HB       ALA  19 -15.234   0.307 -10.024
  111    H    ILE  20           H        ILE  20 -12.254   1.114  -8.908
  112    HA   ILE  20           HA       ILE  20 -13.109  -0.268  -6.475
  113    HB   ILE  20           HB       ILE  20 -10.551   0.121  -8.058
  114   1HG1  ILE  20          2HG1      ILE  20 -12.098  -2.421  -7.532
  115   2HG1  ILE  20          1HG1      ILE  20 -12.492  -1.352  -8.880
  116   1HG2  ILE  20          1HG2      ILE  20 -10.784  -1.906  -5.877
  117   2HG2  ILE  20          2HG2      ILE  20 -10.381  -0.244  -5.456
  118   3HG2  ILE  20          3HG2      ILE  20  -9.345  -1.149  -6.556
  119   1HD1  ILE  20          1HD1      ILE  20 -10.936  -3.141  -9.587
  120   2HD1  ILE  20          2HD1      ILE  20  -9.777  -2.608  -8.368
  121   3HD1  ILE  20          3HD1      ILE  20 -10.183  -1.552  -9.722
  122    H    PHE  21           H        PHE  21 -11.329   2.597  -7.470
  123    HA   PHE  21           HA       PHE  21 -10.312   3.307  -4.846
  124   1HB   PHE  21          2HB       PHE  21  -9.076   4.338  -6.484
  125   2HB   PHE  21          1HB       PHE  21 -10.424   4.347  -7.616
  126    HD1  PHE  21           HD1      PHE  21  -8.505   6.279  -5.246
  127    HD2  PHE  21           HD2      PHE  21 -12.276   6.072  -7.293
  128    HE1  PHE  21           HE1      PHE  21  -8.896   8.680  -4.769
  129    HE2  PHE  21           HE2      PHE  21 -12.669   8.473  -6.811
  130    HZ   PHE  21           HZ       PHE  21 -10.979   9.777  -5.549
  131    H    ASP  22           H        ASP  22 -13.138   4.126  -6.800
  132    HA   ASP  22           HA       ASP  22 -14.214   5.990  -4.790
  133   1HB   ASP  22          2HB       ASP  22 -14.591   6.533  -7.079
  134   2HB   ASP  22          1HB       ASP  22 -15.083   4.884  -7.469
  135    H    SER  23           H        SER  23 -14.045   2.669  -5.030
  136    HA   SER  23           HA       SER  23 -16.779   2.085  -4.059
  137   1HB   SER  23          2HB       SER  23 -15.932   0.425  -5.492
  138   2HB   SER  23          1HB       SER  23 -14.301   0.567  -4.846
  139    HG   SER  23           HG       SER  23 -16.301  -1.066  -4.095
  140    H    LEU  24           H        LEU  24 -13.816   3.095  -2.812
  141    HA   LEU  24           HA       LEU  24 -14.212   1.836  -0.137
  142   1HB   LEU  24          2HB       LEU  24 -11.967   3.688  -0.838
  143   2HB   LEU  24          1HB       LEU  24 -11.937   2.234   0.155
  144    HG   LEU  24           HG       LEU  24 -12.216   2.298  -2.859
  145   1HD1  LEU  24          1HD1      LEU  24  -9.892   0.951  -1.716
  146   2HD1  LEU  24          2HD1      LEU  24  -9.934   2.658  -1.283
  147   3HD1  LEU  24          3HD1      LEU  24  -9.956   2.175  -2.980
  148   1HD2  LEU  24          1HD2      LEU  24 -11.914  -0.137  -2.671
  149   2HD2  LEU  24          2HD2      LEU  24 -13.333   0.378  -1.757
  150   3HD2  LEU  24          3HD2      LEU  24 -11.827   0.004  -0.916
  151    H    SER  25           H        SER  25 -14.937   4.614  -1.882
  152    HA   SER  25           HA       SER  25 -16.182   6.521  -1.115
  153   1HB   SER  25          2HB       SER  25 -15.028   6.109   1.634
  154   2HB   SER  25          1HB       SER  25 -16.573   6.823   1.182
  155    HG   SER  25           HG       SER  25 -16.841   4.510   0.256
  156    HA   PRO  26           HA       PRO  26 -12.136   8.479  -1.728
  157   1HB   PRO  26          2HB       PRO  26 -13.068  10.305  -3.534
  158   2HB   PRO  26          1HB       PRO  26 -12.615   8.648  -3.981
  159   1HG   PRO  26          2HG       PRO  26 -15.311   9.812  -3.505
  160   2HG   PRO  26          1HG       PRO  26 -14.788   8.640  -4.725
  161   1HD   PRO  26          2HD       PRO  26 -16.130   7.949  -2.455
  162   2HD   PRO  26          1HD       PRO  26 -14.999   6.863  -3.294
  163    H    VAL  27           H        VAL  27 -11.377  10.497  -0.985
  164    HA   VAL  27           HA       VAL  27 -13.402  12.231   0.390
  165    HB   VAL  27           HB       VAL  27 -10.566  11.461   1.162
  166   1HG1  VAL  27          1HG1      VAL  27 -10.930  12.772   3.174
  167   2HG1  VAL  27          2HG1      VAL  27 -12.581  13.146   2.678
  168   3HG1  VAL  27          3HG1      VAL  27 -11.218  13.807   1.775
  169   1HG2  VAL  27          1HG2      VAL  27 -12.779   9.938   1.451
  170   2HG2  VAL  27          2HG2      VAL  27 -12.923  10.931   2.902
  171   3HG2  VAL  27          3HG2      VAL  27 -11.477   9.955   2.641
  172    H    ASN  28           H        ASN  28 -13.526  13.806  -1.258
  173    HA   ASN  28           HA       ASN  28 -12.837  15.725  -2.445
  174   1HB   ASN  28          2HB       ASN  28 -11.824  16.181  -0.181
  175   2HB   ASN  28          1HB       ASN  28 -10.338  15.423  -0.750
  176   1HD2  ASN  28          1HD2      ASN  28  -9.211  16.481  -2.598
  177   2HD2  ASN  28          2HD2      ASN  28  -9.448  18.137  -2.893
  178    H    GLY  29           H        GLY  29 -11.834  12.771  -2.991
  179   1HA   GLY  29          2HA       GLY  29 -10.993  12.136  -5.197
  180   2HA   GLY  29          1HA       GLY  29 -10.003  13.596  -5.195
  181    H    PHE  30           H        PHE  30 -10.280  11.414  -2.433
  182    HA   PHE  30           HA       PHE  30  -7.599  10.264  -3.015
  183   1HB   PHE  30          2HB       PHE  30  -8.336  12.013  -0.657
  184   2HB   PHE  30          1HB       PHE  30  -6.863  11.037  -0.719
  185    HD1  PHE  30           HD1      PHE  30  -8.516  14.059  -1.842
  186    HD2  PHE  30           HD2      PHE  30  -5.206  11.428  -2.565
  187    HE1  PHE  30           HE1      PHE  30  -7.419  15.823  -3.184
  188    HE2  PHE  30           HE2      PHE  30  -4.095  13.197  -3.913
  189    HZ   PHE  30           HZ       PHE  30  -5.203  15.397  -4.222
  190    H    LEU  31           H        LEU  31  -7.088   8.456  -1.717
  191    HA   LEU  31           HA       LEU  31  -9.363   7.326  -0.109
  192   1HB   LEU  31          2HB       LEU  31  -7.422   6.120  -2.085
  193   2HB   LEU  31          1HB       LEU  31  -8.120   5.109  -0.821
  194    HG   LEU  31           HG       LEU  31  -9.569   6.590  -3.020
  195   1HD1  LEU  31          1HD1      LEU  31  -8.887   3.802  -2.268
  196   2HD1  LEU  31          2HD1      LEU  31  -9.114   4.511  -3.872
  197   3HD1  LEU  31          3HD1      LEU  31 -10.516   4.053  -2.902
  198   1HD2  LEU  31          1HD2      LEU  31 -10.606   5.384  -0.439
  199   2HD2  LEU  31          2HD2      LEU  31 -11.631   5.583  -1.863
  200   3HD2  LEU  31          3HD2      LEU  31 -10.921   6.997  -1.083
  201    H    SER  32           H        SER  32  -8.561   5.979   1.729
  202    HA   SER  32           HA       SER  32  -5.942   7.026   2.695
  203   1HB   SER  32          2HB       SER  32  -6.919   6.185   4.906
  204   2HB   SER  32          1HB       SER  32  -7.785   7.517   4.146
  205    HG   SER  32           HG       SER  32  -8.405   4.754   3.893
  206    H    GLY  33           H        GLY  33  -4.293   5.594   3.261
  207   1HA   GLY  33          2HA       GLY  33  -3.998   3.120   2.031
  208   2HA   GLY  33          1HA       GLY  33  -3.222   3.499   3.570
  209    H    ASP  34           H        ASP  34  -5.933   3.921   4.800
  210    HA   ASP  34           HA       ASP  34  -6.337   1.241   5.808
  211   1HB   ASP  34          2HB       ASP  34  -6.724   3.131   7.228
  212   2HB   ASP  34          1HB       ASP  34  -7.788   3.887   6.041
  213    H    LYS  35           H        LYS  35  -7.737   3.095   3.173
  214    HA   LYS  35           HA       LYS  35 -10.030   1.232   2.915
  215   1HB   LYS  35          2HB       LYS  35  -9.081   3.805   1.647
  216   2HB   LYS  35          1HB       LYS  35 -10.394   2.876   0.925
  217   1HG   LYS  35          2HG       LYS  35 -11.709   3.034   2.953
  218   2HG   LYS  35          1HG       LYS  35 -10.361   3.775   3.817
  219   1HD   LYS  35          2HD       LYS  35 -10.488   5.767   2.490
  220   2HD   LYS  35          1HD       LYS  35 -11.610   5.015   1.356
  221   1HE   LYS  35          2HE       LYS  35 -13.075   6.264   2.702
  222   2HE   LYS  35          1HE       LYS  35 -13.100   4.695   3.532
  223   1HZ   LYS  35          1HZ       LYS  35 -12.610   6.607   5.026
  224   2HZ   LYS  35          2HZ       LYS  35 -11.176   6.872   4.156
  225   3HZ   LYS  35          3HZ       LYS  35 -11.396   5.423   5.015
  226    H    VAL  36           H        VAL  36  -7.024   2.207   1.366
  227    HA   VAL  36           HA       VAL  36  -7.297   0.389  -0.908
  228    HB   VAL  36           HB       VAL  36  -4.987   1.933   0.308
  229   1HG1  VAL  36          1HG1      VAL  36  -3.829   1.583  -1.779
  230   2HG1  VAL  36          2HG1      VAL  36  -5.231   0.771  -2.476
  231   3HG1  VAL  36          3HG1      VAL  36  -4.331   0.008  -1.165
  232   1HG2  VAL  36          1HG2      VAL  36  -6.639   2.606  -2.135
  233   2HG2  VAL  36          2HG2      VAL  36  -5.503   3.648  -1.277
  234   3HG2  VAL  36          3HG2      VAL  36  -7.037   3.207  -0.525
  235    H    LYS  37           H        LYS  37  -5.533   0.411   2.188
  236    HA   LYS  37           HA       LYS  37  -3.844  -1.732   2.026
  237   1HB   LYS  37          2HB       LYS  37  -3.979  -0.585   4.070
  238   2HB   LYS  37          1HB       LYS  37  -5.726  -0.777   4.173
  239   1HG   LYS  37          2HG       LYS  37  -5.416  -3.221   4.522
  240   2HG   LYS  37          1HG       LYS  37  -3.668  -2.986   4.482
  241   1HD   LYS  37          2HD       LYS  37  -4.115  -1.224   6.361
  242   2HD   LYS  37          1HD       LYS  37  -5.646  -2.077   6.558
  243   1HE   LYS  37          2HE       LYS  37  -4.511  -3.545   7.871
  244   2HE   LYS  37          1HE       LYS  37  -3.718  -4.115   6.389
  245   1HZ   LYS  37          1HZ       LYS  37  -2.127  -2.269   6.628
  246   2HZ   LYS  37          2HZ       LYS  37  -2.047  -3.362   7.926
  247   3HZ   LYS  37          3HZ       LYS  37  -2.829  -1.866   8.118
  248    HA   PRO  38           HA       PRO  38  -7.317  -4.952   2.817
  249   1HB   PRO  38          2HB       PRO  38  -9.905  -4.099   2.520
  250   2HB   PRO  38          1HB       PRO  38  -9.050  -4.073   4.076
  251   1HG   PRO  38          2HG       PRO  38  -9.522  -1.854   2.138
  252   2HG   PRO  38          1HG       PRO  38  -9.615  -1.843   3.906
  253   1HD   PRO  38          2HD       PRO  38  -7.486  -0.862   2.567
  254   2HD   PRO  38          1HD       PRO  38  -7.337  -1.639   4.160
  255    H    VAL  39           H        VAL  39  -8.031  -2.391   0.488
  256    HA   VAL  39           HA       VAL  39  -9.277  -3.941  -1.546
  257    HB   VAL  39           HB       VAL  39  -7.727  -1.388  -1.302
  258   1HG1  VAL  39          1HG1      VAL  39  -7.467  -1.000  -3.538
  259   2HG1  VAL  39          2HG1      VAL  39  -8.872  -1.969  -3.979
  260   3HG1  VAL  39          3HG1      VAL  39  -7.341  -2.752  -3.613
  261   1HG2  VAL  39          1HG2      VAL  39  -9.854  -0.741  -0.947
  262   2HG2  VAL  39          2HG2      VAL  39 -10.482  -2.298  -1.483
  263   3HG2  VAL  39          3HG2      VAL  39 -10.142  -1.031  -2.663
  264    H    LEU  40           H        LEU  40  -5.854  -3.390  -0.773
  265    HA   LEU  40           HA       LEU  40  -4.929  -4.888  -3.131
  266   1HB   LEU  40          2HB       LEU  40  -3.390  -3.988  -0.683
  267   2HB   LEU  40          1HB       LEU  40  -2.758  -4.280  -2.301
  268    HG   LEU  40           HG       LEU  40  -4.798  -2.143  -1.655
  269   1HD1  LEU  40          1HD1      LEU  40  -1.818  -2.175  -1.586
  270   2HD1  LEU  40          2HD1      LEU  40  -2.955  -1.215  -0.635
  271   3HD1  LEU  40          3HD1      LEU  40  -2.592  -0.761  -2.302
  272   1HD2  LEU  40          1HD2      LEU  40  -4.503  -3.233  -4.019
  273   2HD2  LEU  40          2HD2      LEU  40  -3.014  -2.287  -4.072
  274   3HD2  LEU  40          3HD2      LEU  40  -4.570  -1.477  -3.889
  275    H    LEU  41           H        LEU  41  -5.647  -5.469   0.238
  276    HA   LEU  41           HA       LEU  41  -4.185  -7.955   0.507
  277   1HB   LEU  41          2HB       LEU  41  -6.475  -6.598   1.941
  278   2HB   LEU  41          1HB       LEU  41  -5.842  -8.158   2.462
  279    HG   LEU  41           HG       LEU  41  -4.062  -5.752   2.060
  280   1HD1  LEU  41          1HD1      LEU  41  -6.082  -5.909   3.952
  281   2HD1  LEU  41          2HD1      LEU  41  -4.629  -4.917   4.088
  282   3HD1  LEU  41          3HD1      LEU  41  -4.675  -6.520   4.822
  283   1HD2  LEU  41          1HD2      LEU  41  -3.171  -7.544   4.070
  284   2HD2  LEU  41          2HD2      LEU  41  -2.470  -7.298   2.471
  285   3HD2  LEU  41          3HD2      LEU  41  -3.701  -8.539   2.713
  286    H    ASN  42           H        ASN  42  -7.067  -6.988  -1.075
  287    HA   ASN  42           HA       ASN  42  -8.414  -9.573  -0.923
  288   1HB   ASN  42          2HB       ASN  42  -8.816  -6.876  -2.111
  289   2HB   ASN  42          1HB       ASN  42  -9.632  -8.209  -2.930
  290   1HD2  ASN  42          1HD2      ASN  42 -10.720  -5.970  -1.126
  291   2HD2  ASN  42          2HD2      ASN  42 -11.612  -6.793   0.063
  292    H    SER  43           H        SER  43  -5.827  -8.290  -2.696
  293    HA   SER  43           HA       SER  43  -6.269  -9.732  -5.205
  294   1HB   SER  43          2HB       SER  43  -3.595  -8.744  -4.352
  295   2HB   SER  43          1HB       SER  43  -4.443  -8.502  -5.876
  296    HG   SER  43           HG       SER  43  -4.211  -6.741  -4.074
  297    H    LYS  44           H        LYS  44  -5.716 -10.905  -2.226
  298    HA   LYS  44           HA       LYS  44  -4.847 -12.965  -1.454
  299   1HB   LYS  44          2HB       LYS  44  -5.448 -13.226  -4.197
  300   2HB   LYS  44          1HB       LYS  44  -3.838 -13.918  -4.004
  301   1HG   LYS  44          2HG       LYS  44  -4.580 -15.498  -2.405
  302   2HG   LYS  44          1HG       LYS  44  -6.080 -14.618  -2.110
  303   1HD   LYS  44          2HD       LYS  44  -6.758 -15.109  -4.480
  304   2HD   LYS  44          1HD       LYS  44  -5.326 -16.132  -4.626
  305   1HE   LYS  44          2HE       LYS  44  -6.323 -17.197  -2.375
  306   2HE   LYS  44          1HE       LYS  44  -7.840 -16.608  -3.082
  307   1HZ   LYS  44          1HZ       LYS  44  -7.651 -18.568  -4.202
  308   2HZ   LYS  44          2HZ       LYS  44  -5.954 -18.592  -4.121
  309   3HZ   LYS  44          3HZ       LYS  44  -6.739 -17.590  -5.245
  310    H    LEU  45           H        LEU  45  -3.179 -10.431  -2.304
  311    HA   LEU  45           HA       LEU  45  -0.483 -11.654  -2.555
  312   1HB   LEU  45          2HB       LEU  45  -1.767  -8.962  -2.880
  313   2HB   LEU  45          1HB       LEU  45  -0.030  -9.034  -2.586
  314    HG   LEU  45           HG       LEU  45  -1.496 -10.481  -4.809
  315   1HD1  LEU  45          1HD1      LEU  45   0.560  -8.347  -5.227
  316   2HD1  LEU  45          2HD1      LEU  45  -1.072  -7.856  -4.784
  317   3HD1  LEU  45          3HD1      LEU  45  -0.801  -8.797  -6.247
  318   1HD2  LEU  45          1HD2      LEU  45   0.430 -11.615  -5.219
  319   2HD2  LEU  45          2HD2      LEU  45   0.903 -11.157  -3.584
  320   3HD2  LEU  45          3HD2      LEU  45   1.421 -10.181  -4.955
  321    HA   PRO  46           HA       PRO  46   0.333 -11.057   1.722
  322   1HB   PRO  46          2HB       PRO  46   3.068 -10.957   1.634
  323   2HB   PRO  46          1HB       PRO  46   2.149 -12.460   1.427
  324   1HG   PRO  46          2HG       PRO  46   3.476 -10.763  -0.597
  325   2HG   PRO  46          1HG       PRO  46   3.263 -12.518  -0.551
  326   1HD   PRO  46          2HD       PRO  46   1.757 -10.782  -2.076
  327   2HD   PRO  46          1HD       PRO  46   1.259 -12.419  -1.614
  328    H    VAL  47           H        VAL  47   1.942  -9.473   3.055
  329    HA   VAL  47           HA       VAL  47   1.200  -6.759   2.297
  330    HB   VAL  47           HB       VAL  47   2.445  -8.248   4.564
  331   1HG1  VAL  47          1HG1      VAL  47   4.044  -6.364   4.145
  332   2HG1  VAL  47          2HG1      VAL  47   3.209  -6.235   5.694
  333   3HG1  VAL  47          3HG1      VAL  47   2.702  -5.236   4.336
  334   1HG2  VAL  47          1HG2      VAL  47   0.824  -6.548   5.737
  335   2HG2  VAL  47          2HG2      VAL  47   0.149  -7.900   4.828
  336   3HG2  VAL  47          3HG2      VAL  47   0.209  -6.293   4.104
  337    H    ASP  48           H        ASP  48   3.641  -8.779   1.274
  338    HA   ASP  48           HA       ASP  48   5.814  -6.796   1.245
  339   1HB   ASP  48          2HB       ASP  48   6.303  -9.159   1.586
  340   2HB   ASP  48          1HB       ASP  48   5.453  -9.582   0.098
  341    H    ILE  49           H        ILE  49   3.397  -8.146  -0.943
  342    HA   ILE  49           HA       ILE  49   4.505  -6.766  -3.295
  343    HB   ILE  49           HB       ILE  49   1.733  -7.931  -3.039
  344   1HG1  ILE  49          2HG1      ILE  49   3.190  -9.599  -2.007
  345   2HG1  ILE  49          1HG1      ILE  49   2.730 -10.150  -3.616
  346   1HG2  ILE  49          1HG2      ILE  49   2.117  -6.995  -5.161
  347   2HG2  ILE  49          2HG2      ILE  49   2.475  -8.705  -5.403
  348   3HG2  ILE  49          3HG2      ILE  49   3.791  -7.547  -5.204
  349   1HD1  ILE  49          1HD1      ILE  49   5.349  -8.939  -2.746
  350   2HD1  ILE  49          2HD1      ILE  49   4.882  -9.061  -4.446
  351   3HD1  ILE  49          3HD1      ILE  49   5.065 -10.522  -3.472
  352    H    LEU  50           H        LEU  50   1.851  -6.453  -1.004
  353    HA   LEU  50           HA       LEU  50   0.636  -4.136  -2.254
  354   1HB   LEU  50          2HB       LEU  50   0.519  -5.115   0.611
  355   2HB   LEU  50          1HB       LEU  50  -0.695  -4.158  -0.239
  356    HG   LEU  50           HG       LEU  50   0.116  -7.004  -0.891
  357   1HD1  LEU  50          1HD1      LEU  50  -2.264  -7.471  -0.286
  358   2HD1  LEU  50          2HD1      LEU  50  -2.421  -5.794   0.240
  359   3HD1  LEU  50          3HD1      LEU  50  -1.307  -6.880   1.073
  360   1HD2  LEU  50          1HD2      LEU  50  -1.025  -4.956  -2.534
  361   2HD2  LEU  50          2HD2      LEU  50  -2.258  -6.177  -2.225
  362   3HD2  LEU  50          3HD2      LEU  50  -0.718  -6.642  -2.947
  363    H    GLY  51           H        GLY  51   3.236  -4.700   0.023
  364   1HA   GLY  51          2HA       GLY  51   3.330  -1.959   1.021
  365   2HA   GLY  51          1HA       GLY  51   4.606  -3.171   1.209
  366    H    ARG  52           H        ARG  52   4.403  -3.685  -1.748
  367    HA   ARG  52           HA       ARG  52   6.214  -1.486  -2.604
  368   1HB   ARG  52          2HB       ARG  52   6.061  -4.333  -2.855
  369   2HB   ARG  52          1HB       ARG  52   5.977  -3.629  -4.467
  370   1HG   ARG  52          2HG       ARG  52   7.978  -2.205  -3.820
  371   2HG   ARG  52          1HG       ARG  52   8.132  -3.229  -2.392
  372   1HD   ARG  52          2HD       ARG  52   7.839  -4.669  -4.976
  373   2HD   ARG  52          1HD       ARG  52   9.372  -3.810  -4.728
  374    HE   ARG  52           HE       ARG  52   9.099  -5.027  -2.328
  375   1HH1  ARG  52          1HH2      ARG  52   9.621  -6.025  -5.518
  376   2HH1  ARG  52          2HH2      ARG  52   9.586  -7.721  -5.166
  377   1HH2  ARG  52          2HH1      ARG  52   8.616  -7.288  -1.865
  378   2HH2  ARG  52          1HH1      ARG  52   9.018  -8.435  -3.098
  379    H    VAL  53           H        VAL  53   3.167  -3.118  -3.400
  380    HA   VAL  53           HA       VAL  53   2.818  -1.809  -5.964
  381    HB   VAL  53           HB       VAL  53   1.039  -3.232  -3.974
  382   1HG1  VAL  53          1HG1      VAL  53  -0.785  -2.303  -4.914
  383   2HG1  VAL  53          2HG1      VAL  53  -0.297  -2.991  -6.463
  384   3HG1  VAL  53          3HG1      VAL  53   0.224  -1.367  -6.016
  385   1HG2  VAL  53          1HG2      VAL  53   1.710  -3.936  -6.845
  386   2HG2  VAL  53          2HG2      VAL  53   1.066  -4.994  -5.587
  387   3HG2  VAL  53          3HG2      VAL  53   2.734  -4.426  -5.491
  388    H    TRP  54           H        TRP  54   1.903  -1.051  -2.621
  389    HA   TRP  54           HA       TRP  54   0.270   1.246  -3.284
  390   1HB   TRP  54          2HB       TRP  54  -0.059   0.301  -1.139
  391   2HB   TRP  54          1HB       TRP  54   1.675   0.196  -0.822
  392    HD1  TRP  54           HD1      TRP  54   2.975   2.598  -0.560
  393    HE1  TRP  54           HE1      TRP  54   2.163   4.804   0.445
  394    HE3  TRP  54           HE3      TRP  54  -2.055   1.761  -0.615
  395    HZ2  TRP  54           HZ2      TRP  54  -0.321   6.058   1.187
  396    HZ3  TRP  54           HZ3      TRP  54  -3.628   3.479   0.267
  397    HH2  TRP  54           HH2      TRP  54  -2.765   5.611   1.152
  398    H    GLU  55           H        GLU  55   3.659   0.921  -2.088
  399    HA   GLU  55           HA       GLU  55   4.297   3.678  -2.096
  400   1HB   GLU  55          2HB       GLU  55   5.899   1.165  -2.560
  401   2HB   GLU  55          1HB       GLU  55   6.651   2.753  -2.425
  402   1HG   GLU  55          2HG       GLU  55   4.817   2.520  -0.273
  403   2HG   GLU  55          1HG       GLU  55   5.758   1.030  -0.319
  404    H    LEU  56           H        LEU  56   5.059   1.313  -4.678
  405    HA   LEU  56           HA       LEU  56   5.917   3.234  -6.600
  406   1HB   LEU  56          2HB       LEU  56   4.562   0.525  -6.895
  407   2HB   LEU  56          1HB       LEU  56   5.387   1.371  -8.204
  408    HG   LEU  56           HG       LEU  56   6.944   1.075  -5.700
  409   1HD1  LEU  56          1HD1      LEU  56   5.571  -1.176  -6.711
  410   2HD1  LEU  56          2HD1      LEU  56   6.883  -1.165  -5.533
  411   3HD1  LEU  56          3HD1      LEU  56   7.242  -1.340  -7.251
  412   1HD2  LEU  56          1HD2      LEU  56   7.374   1.561  -8.491
  413   2HD2  LEU  56          2HD2      LEU  56   8.240   0.085  -8.060
  414   3HD2  LEU  56          3HD2      LEU  56   8.567   1.585  -7.192
  415    H    SER  57           H        SER  57   2.810   2.510  -5.315
  416    HA   SER  57           HA       SER  57   1.284   3.673  -7.575
  417   1HB   SER  57          2HB       SER  57   0.171   1.866  -6.619
  418   2HB   SER  57          1HB       SER  57   0.758   2.237  -5.000
  419    HG   SER  57           HG       SER  57  -1.068   3.849  -6.458
  420    H    ASP  58           H        ASP  58   2.237   4.412  -4.238
  421    HA   ASP  58           HA       ASP  58   0.670   6.835  -3.978
  422   1HB   ASP  58          2HB       ASP  58   2.223   5.120  -2.399
  423   2HB   ASP  58          1HB       ASP  58   3.075   6.663  -2.349
  424    H    ILE  59           H        ILE  59   1.155   8.293  -5.686
  425    HA   ILE  59           HA       ILE  59   3.851   8.875  -6.575
  426    HB   ILE  59           HB       ILE  59   1.230  10.388  -6.813
  427   1HG1  ILE  59          2HG1      ILE  59   1.099   8.084  -7.670
  428   2HG1  ILE  59          1HG1      ILE  59   1.084   9.233  -9.008
  429   1HG2  ILE  59          1HG2      ILE  59   2.296  11.877  -8.138
  430   2HG2  ILE  59          2HG2      ILE  59   3.179  10.607  -8.985
  431   3HG2  ILE  59          3HG2      ILE  59   3.793  11.240  -7.458
  432   1HD1  ILE  59          1HD1      ILE  59   3.527   8.889  -9.301
  433   2HD1  ILE  59          2HD1      ILE  59   2.622   7.390  -9.508
  434   3HD1  ILE  59          3HD1      ILE  59   3.498   7.692  -8.006
  435    H    ASP  60           H        ASP  60   1.716  10.175  -4.098
  436    HA   ASP  60           HA       ASP  60   3.765  12.263  -3.461
  437   1HB   ASP  60          2HB       ASP  60   1.181  12.502  -2.128
  438   2HB   ASP  60          1HB       ASP  60   2.033  13.684  -3.107
  439    H    HIS  61           H        HIS  61   2.308   9.357  -2.402
  440    HA   HIS  61           HA       HIS  61   2.614   8.079  -0.448
  441   1HB   HIS  61          2HB       HIS  61   4.893  10.063  -0.309
  442   2HB   HIS  61          1HB       HIS  61   4.725   8.720   0.818
  443    HD1  HIS  61           HD1      HIS  61   4.665   6.269  -0.307
  444    HD2  HIS  61           HD2      HIS  61   6.006   9.357  -2.764
  445    HE1  HIS  61           HE1      HIS  61   5.842   5.169  -2.261
  446    H    ASP  62           H        ASP  62   0.583   9.992  -0.204
  447    HA   ASP  62           HA       ASP  62   1.022  11.317   2.436
  448   1HB   ASP  62          2HB       ASP  62  -1.512  11.417   0.808
  449   2HB   ASP  62          1HB       ASP  62  -0.811  12.665   1.835
  450    H    GLY  63           H        GLY  63   0.697   8.336   1.930
  451   1HA   GLY  63          2HA       GLY  63  -0.402   6.552   2.991
  452   2HA   GLY  63          1HA       GLY  63  -1.035   7.738   4.137
  453    H    MET  64           H        MET  64  -1.510   8.052   0.680
  454    HA   MET  64           HA       MET  64  -4.297   7.029   0.859
  455   1HB   MET  64          2HB       MET  64  -3.469   9.882   0.259
  456   2HB   MET  64          1HB       MET  64  -5.079   9.249  -0.057
  457   1HG   MET  64          2HG       MET  64  -5.507   8.893   2.247
  458   2HG   MET  64          1HG       MET  64  -3.807   9.116   2.671
  459   1HE   MET  64          1HE       MET  64  -6.881  10.041   2.895
  460   2HE   MET  64          2HE       MET  64  -7.258  11.560   2.087
  461   3HE   MET  64          3HE       MET  64  -6.705  11.575   3.760
  462    H    LEU  65           H        LEU  65  -5.299   6.907  -1.309
  463    HA   LEU  65           HA       LEU  65  -3.339   7.080  -3.571
  464   1HB   LEU  65          2HB       LEU  65  -5.179   4.870  -2.662
  465   2HB   LEU  65          1HB       LEU  65  -4.730   4.992  -4.362
  466    HG   LEU  65           HG       LEU  65  -2.887   4.618  -1.990
  467   1HD1  LEU  65          1HD1      LEU  65  -2.788   2.982  -4.479
  468   2HD1  LEU  65          2HD1      LEU  65  -4.183   2.744  -3.426
  469   3HD1  LEU  65          3HD1      LEU  65  -2.552   2.491  -2.803
  470   1HD2  LEU  65          1HD2      LEU  65  -2.348   5.570  -4.792
  471   2HD2  LEU  65          2HD2      LEU  65  -1.149   4.570  -3.971
  472   3HD2  LEU  65          3HD2      LEU  65  -1.631   6.117  -3.276
  473    H    ASP  66           H        ASP  66  -4.237   8.947  -4.530
  474    HA   ASP  66           HA       ASP  66  -7.079   9.442  -4.681
  475   1HB   ASP  66          2HB       ASP  66  -6.395  11.315  -6.051
  476   2HB   ASP  66          1HB       ASP  66  -5.181  11.114  -4.789
  477    H    ARG  67           H        ARG  67  -8.332   9.495  -6.697
  478    HA   ARG  67           HA       ARG  67  -8.739   7.182  -8.050
  479   1HB   ARG  67          2HB       ARG  67  -9.249   8.825 -10.075
  480   2HB   ARG  67          1HB       ARG  67 -10.213   8.877  -8.600
  481   1HG   ARG  67          2HG       ARG  67  -9.149  10.819  -7.822
  482   2HG   ARG  67          1HG       ARG  67  -7.741  10.578  -8.853
  483   1HD   ARG  67          2HD       ARG  67  -9.043  12.371  -9.836
  484   2HD   ARG  67          1HD       ARG  67  -9.298  10.937 -10.852
  485    HE   ARG  67           HE       ARG  67 -11.450  10.588  -9.703
  486   1HH1  ARG  67          1HH2      ARG  67 -10.530  12.293  -7.281
  487   2HH1  ARG  67          2HH2      ARG  67 -11.585  13.657  -7.449
  488   1HH2  ARG  67          2HH1      ARG  67 -12.503  12.877 -10.703
  489   2HH2  ARG  67          1HH1      ARG  67 -12.703  13.987  -9.387
  490    H    ASP  68           H        ASP  68  -6.251   9.542  -9.070
  491    HA   ASP  68           HA       ASP  68  -5.394   7.845 -11.302
  492   1HB   ASP  68          2HB       ASP  68  -5.178  10.532 -10.475
  493   2HB   ASP  68          1HB       ASP  68  -3.529   9.907 -10.481
  494    H    GLU  69           H        GLU  69  -4.272   8.576  -8.030
  495    HA   GLU  69           HA       GLU  69  -1.755   7.161  -8.224
  496   1HB   GLU  69          2HB       GLU  69  -2.771   8.964  -6.557
  497   2HB   GLU  69          1HB       GLU  69  -3.303   7.531  -5.677
  498   1HG   GLU  69          2HG       GLU  69  -1.039   6.714  -5.499
  499   2HG   GLU  69          1HG       GLU  69  -0.446   7.989  -6.567
  500    H    PHE  70           H        PHE  70  -4.991   6.357  -6.992
  501    HA   PHE  70           HA       PHE  70  -4.409   3.714  -6.066
  502   1HB   PHE  70          2HB       PHE  70  -6.423   5.162  -5.594
  503   2HB   PHE  70          1HB       PHE  70  -6.973   4.843  -7.239
  504    HD1  PHE  70           HD1      PHE  70  -6.327   3.351  -3.920
  505    HD2  PHE  70           HD2      PHE  70  -7.825   2.676  -7.889
  506    HE1  PHE  70           HE1      PHE  70  -7.327   1.207  -3.179
  507    HE2  PHE  70           HE2      PHE  70  -8.825   0.537  -7.146
  508    HZ   PHE  70           HZ       PHE  70  -8.575  -0.197  -4.794
  509    H    ALA  71           H        ALA  71  -4.770   5.084  -9.218
  510    HA   ALA  71           HA       ALA  71  -5.549   2.692 -10.654
  511   1HB   ALA  71          1HB       ALA  71  -5.736   5.138 -11.354
  512   2HB   ALA  71          2HB       ALA  71  -5.065   4.066 -12.583
  513   3HB   ALA  71          3HB       ALA  71  -3.995   5.102 -11.640
  514    H    VAL  72           H        VAL  72  -2.444   4.282  -9.973
  515    HA   VAL  72           HA       VAL  72  -0.770   2.506 -11.467
  516    HB   VAL  72           HB       VAL  72  -0.244   4.069  -8.915
  517   1HG1  VAL  72          1HG1      VAL  72   2.090   4.051  -9.614
  518   2HG1  VAL  72          2HG1      VAL  72   1.672   3.195 -11.100
  519   3HG1  VAL  72          3HG1      VAL  72   1.508   2.387  -9.541
  520   1HG2  VAL  72          1HG2      VAL  72   0.207   4.914 -11.791
  521   2HG2  VAL  72          2HG2      VAL  72   0.359   5.914 -10.346
  522   3HG2  VAL  72          3HG2      VAL  72  -1.231   5.358 -10.871
  523    H    ALA  73           H        ALA  73  -2.179   2.312  -8.244
  524    HA   ALA  73           HA       ALA  73  -0.633  -0.103  -7.526
  525   1HB   ALA  73          1HB       ALA  73  -2.751   0.376  -5.733
  526   2HB   ALA  73          2HB       ALA  73  -2.225   1.968  -6.286
  527   3HB   ALA  73          3HB       ALA  73  -1.067   0.867  -5.539
  528    H    MET  74           H        MET  74  -3.278   0.411  -9.503
  529    HA   MET  74           HA       MET  74  -4.823  -1.933  -8.561
  530   1HB   MET  74          2HB       MET  74  -5.085   0.205 -10.676
  531   2HB   MET  74          1HB       MET  74  -6.110  -1.227 -10.748
  532   1HG   MET  74          2HG       MET  74  -5.875   0.270  -8.159
  533   2HG   MET  74          1HG       MET  74  -6.922   0.903  -9.429
  534   1HE   MET  74          1HE       MET  74  -5.936  -1.378  -7.007
  535   2HE   MET  74          2HE       MET  74  -6.565  -2.960  -7.465
  536   3HE   MET  74          3HE       MET  74  -7.468  -1.955  -6.334
  537    H    PHE  75           H        PHE  75  -2.910  -0.970 -11.417
  538    HA   PHE  75           HA       PHE  75  -3.156  -3.614 -12.643
  539   1HB   PHE  75          2HB       PHE  75  -1.941  -2.626 -14.398
  540   2HB   PHE  75          1HB       PHE  75  -2.747  -1.232 -13.684
  541    HD1  PHE  75           HD1      PHE  75   0.447  -3.088 -13.905
  542    HD2  PHE  75           HD2      PHE  75  -1.511   0.476 -12.527
  543    HE1  PHE  75           HE1      PHE  75   2.652  -2.055 -13.452
  544    HE2  PHE  75           HE2      PHE  75   0.692   1.512 -12.075
  545    HZ   PHE  75           HZ       PHE  75   2.779   0.242 -12.536
  546    H    LEU  76           H        LEU  76  -1.115  -2.037 -10.340
  547    HA   LEU  76           HA       LEU  76   1.164  -3.841 -10.564
  548   1HB   LEU  76          2HB       LEU  76   0.256  -1.509  -9.026
  549   2HB   LEU  76          1HB       LEU  76   1.222  -2.635  -8.074
  550    HG   LEU  76           HG       LEU  76   2.029  -1.474 -10.758
  551   1HD1  LEU  76          1HD1      LEU  76   3.747  -0.859  -8.508
  552   2HD1  LEU  76          2HD1      LEU  76   2.101  -0.313  -8.192
  553   3HD1  LEU  76          3HD1      LEU  76   2.954   0.244  -9.631
  554   1HD2  LEU  76          1HD2      LEU  76   3.356  -3.374  -8.810
  555   2HD2  LEU  76          2HD2      LEU  76   4.275  -2.473 -10.017
  556   3HD2  LEU  76          3HD2      LEU  76   3.039  -3.626 -10.527
  557    H    VAL  77           H        VAL  77  -1.911  -3.840  -8.934
  558    HA   VAL  77           HA       VAL  77  -1.118  -5.986  -7.052
  559    HB   VAL  77           HB       VAL  77  -3.515  -4.213  -7.554
  560   1HG1  VAL  77          1HG1      VAL  77  -3.434  -6.814  -6.009
  561   2HG1  VAL  77          2HG1      VAL  77  -4.654  -6.252  -7.149
  562   3HG1  VAL  77          3HG1      VAL  77  -4.539  -5.519  -5.550
  563   1HG2  VAL  77          1HG2      VAL  77  -1.371  -4.549  -5.547
  564   2HG2  VAL  77          2HG2      VAL  77  -2.972  -4.263  -4.865
  565   3HG2  VAL  77          3HG2      VAL  77  -2.274  -3.106  -5.997
  566    H    TYR  78           H        TYR  78  -3.182  -5.522  -9.914
  567    HA   TYR  78           HA       TYR  78  -4.261  -8.208  -9.881
  568   1HB   TYR  78          2HB       TYR  78  -4.248  -5.788 -11.579
  569   2HB   TYR  78          1HB       TYR  78  -4.498  -7.300 -12.451
  570    HD1  TYR  78           HD1      TYR  78  -6.236  -4.721 -11.021
  571    HD2  TYR  78           HD2      TYR  78  -6.057  -9.010 -10.890
  572    HE1  TYR  78           HE1      TYR  78  -8.587  -4.795 -10.235
  573    HE2  TYR  78           HE2      TYR  78  -8.409  -9.084 -10.104
  574    HH   TYR  78           HH       TYR  78 -10.530  -6.865 -10.446
  575    H    CYS  79           H        CYS  79  -1.289  -6.806 -11.061
  576    HA   CYS  79           HA       CYS  79  -0.703  -9.006 -12.914
  577   1HB   CYS  79          2HB       CYS  79   0.322  -6.376 -12.162
  578   2HB   CYS  79          1HB       CYS  79   1.624  -7.548 -12.365
  579    HG   CYS  79           HG       CYS  79  -0.224  -6.516 -14.604
  580    H    ALA  80           H        ALA  80  -0.358  -8.401  -9.533
  581    HA   ALA  80           HA       ALA  80   1.901 -10.282  -9.214
  582   1HB   ALA  80          1HB       ALA  80   2.107  -8.690  -7.575
  583   2HB   ALA  80          2HB       ALA  80   0.964  -9.716  -6.710
  584   3HB   ALA  80          3HB       ALA  80   0.384  -8.307  -7.602
  585    H    LEU  81           H        LEU  81  -1.459 -10.405  -9.535
  586    HA   LEU  81           HA       LEU  81  -1.866 -12.779  -7.816
  587   1HB   LEU  81          2HB       LEU  81  -3.817 -11.646  -9.809
  588   2HB   LEU  81          1HB       LEU  81  -4.149 -12.368  -8.237
  589    HG   LEU  81           HG       LEU  81  -3.094  -9.629  -8.872
  590   1HD1  LEU  81          1HD1      LEU  81  -5.579 -10.225  -8.584
  591   2HD1  LEU  81          2HD1      LEU  81  -4.964  -8.882  -7.619
  592   3HD1  LEU  81          3HD1      LEU  81  -5.199 -10.466  -6.878
  593   1HD2  LEU  81          1HD2      LEU  81  -2.943  -9.575  -6.221
  594   2HD2  LEU  81          2HD2      LEU  81  -1.579 -10.145  -7.182
  595   3HD2  LEU  81          3HD2      LEU  81  -2.665 -11.305  -6.424
  596    H    GLU  82           H        GLU  82  -1.915 -11.884 -11.249
  597    HA   GLU  82           HA       GLU  82  -2.499 -14.540 -12.211
  598   1HB   GLU  82          2HB       GLU  82  -1.358 -12.014 -13.426
  599   2HB   GLU  82          1HB       GLU  82  -1.725 -13.450 -14.382
  600   1HG   GLU  82          2HG       GLU  82  -3.905 -12.610 -12.587
  601   2HG   GLU  82          1HG       GLU  82  -3.518 -11.441 -13.851
  602    H    LYS  83           H        LYS  83   0.495 -12.597 -12.209
  603    HA   LYS  83           HA       LYS  83   2.209 -14.762 -11.465
  604   1HB   LYS  83          2HB       LYS  83   1.139 -15.192 -13.904
  605   2HB   LYS  83          1HB       LYS  83   2.570 -14.277 -14.367
  606   1HG   LYS  83          2HG       LYS  83   3.865 -15.877 -12.809
  607   2HG   LYS  83          1HG       LYS  83   2.423 -16.891 -12.871
  608   1HD   LYS  83          2HD       LYS  83   3.328 -17.761 -14.758
  609   2HD   LYS  83          1HD       LYS  83   2.818 -16.258 -15.529
  610   1HE   LYS  83          2HE       LYS  83   5.224 -16.704 -15.957
  611   2HE   LYS  83          1HE       LYS  83   5.024 -15.243 -14.968
  612   1HZ   LYS  83          1HZ       LYS  83   6.606 -17.206 -14.216
  613   2HZ   LYS  83          2HZ       LYS  83   5.152 -17.814 -13.581
  614   3HZ   LYS  83          3HZ       LYS  83   5.724 -16.291 -13.093
  615    H    GLU  84           H        GLU  84   1.809 -11.711 -13.162
  616    HA   GLU  84           HA       GLU  84   4.557 -10.979 -13.425
  617   1HB   GLU  84          2HB       GLU  84   1.897  -9.820 -13.654
  618   2HB   GLU  84          1HB       GLU  84   3.059  -8.650 -13.025
  619   1HG   GLU  84          2HG       GLU  84   4.427  -9.996 -15.071
  620   2HG   GLU  84          1HG       GLU  84   2.811  -9.709 -15.716
  621    HA   PRO  85           HA       PRO  85   5.272 -10.489  -9.025
  622   1HB   PRO  85          2HB       PRO  85   7.954  -9.976  -9.275
  623   2HB   PRO  85          1HB       PRO  85   7.272 -11.614  -9.317
  624   1HG   PRO  85          2HG       PRO  85   8.132  -9.864 -11.569
  625   2HG   PRO  85          1HG       PRO  85   8.332 -11.611 -11.355
  626   1HD   PRO  85          2HD       PRO  85   6.421 -10.524 -12.955
  627   2HD   PRO  85          1HD       PRO  85   6.221 -12.083 -12.123
  628    H    VAL  86           H        VAL  86   6.149  -8.608  -7.722
  629    HA   VAL  86           HA       VAL  86   5.810  -6.051  -9.251
  630    HB   VAL  86           HB       VAL  86   5.173  -6.899  -6.417
  631   1HG1  VAL  86          1HG1      VAL  86   5.607  -4.744  -5.871
  632   2HG1  VAL  86          2HG1      VAL  86   4.124  -4.373  -6.748
  633   3HG1  VAL  86          3HG1      VAL  86   5.685  -4.237  -7.557
  634   1HG2  VAL  86          1HG2      VAL  86   2.942  -6.777  -7.056
  635   2HG2  VAL  86          2HG2      VAL  86   3.676  -7.330  -8.562
  636   3HG2  VAL  86          3HG2      VAL  86   3.268  -5.626  -8.353
  637    HA   PRO  87           HA       PRO  87   9.991  -5.403  -7.783
  638   1HB   PRO  87          2HB       PRO  87  10.541  -3.325  -9.462
  639   2HB   PRO  87          1HB       PRO  87  10.565  -5.015  -9.998
  640   1HG   PRO  87          2HG       PRO  87   8.576  -2.908 -10.517
  641   2HG   PRO  87          1HG       PRO  87   8.984  -4.339 -11.471
  642   1HD   PRO  87          2HD       PRO  87   6.762  -4.010  -9.762
  643   2HD   PRO  87          1HD       PRO  87   7.294  -5.512 -10.548
  644    H    MET  88           H        MET  88  11.056  -2.883  -7.565
  645    HA   MET  88           HA       MET  88   9.094  -1.433  -5.804
  646   1HB   MET  88          2HB       MET  88  11.866  -0.790  -5.338
  647   2HB   MET  88          1HB       MET  88  10.695  -1.460  -4.206
  648   1HG   MET  88          2HG       MET  88  11.151  -3.738  -5.207
  649   2HG   MET  88          1HG       MET  88  12.446  -3.001  -6.149
  650   1HE   MET  88          1HE       MET  88  14.477  -4.967  -3.668
  651   2HE   MET  88          2HE       MET  88  14.812  -3.988  -5.094
  652   3HE   MET  88          3HE       MET  88  13.427  -5.076  -5.087
  653    H    SER  89           H        SER  89  10.378  -1.215  -8.773
  654    HA   SER  89           HA       SER  89  11.274   1.596  -8.532
  655   1HB   SER  89          2HB       SER  89  12.542   1.098 -10.337
  656   2HB   SER  89          1HB       SER  89  12.189  -0.568  -9.893
  657    HG   SER  89           HG       SER  89  11.276  -0.673 -11.780
  658    H    LEU  90           H        LEU  90   9.782   3.096  -8.734
  659    HA   LEU  90           HA       LEU  90   7.413   2.612 -10.484
  660   1HB   LEU  90          2HB       LEU  90   6.552   3.300  -8.463
  661   2HB   LEU  90          1HB       LEU  90   8.064   4.058  -7.974
  662    HG   LEU  90           HG       LEU  90   7.582   6.032  -9.197
  663   1HD1  LEU  90          1HD1      LEU  90   6.608   5.694 -11.228
  664   2HD1  LEU  90          2HD1      LEU  90   5.080   5.789 -10.354
  665   3HD1  LEU  90          3HD1      LEU  90   5.808   4.218 -10.689
  666   1HD2  LEU  90          1HD2      LEU  90   6.249   6.581  -7.462
  667   2HD2  LEU  90          2HD2      LEU  90   5.642   4.930  -7.339
  668   3HD2  LEU  90          3HD2      LEU  90   4.878   6.070  -8.448
  669    HA   PRO  91           HA       PRO  91  10.336   5.148 -12.989
  670   1HB   PRO  91          2HB       PRO  91   9.339   4.234 -15.381
  671   2HB   PRO  91          1HB       PRO  91  10.596   3.387 -14.455
  672   1HG   PRO  91          2HG       PRO  91   7.645   2.892 -14.522
  673   2HG   PRO  91          1HG       PRO  91   8.981   1.727 -14.603
  674   1HD   PRO  91          2HD       PRO  91   7.655   2.127 -12.319
  675   2HD   PRO  91          1HD       PRO  91   9.417   1.865 -12.323
  676    HA   PRO  92           HA       PRO  92   7.703   8.441 -14.138
  677   1HB   PRO  92          2HB       PRO  92   8.612   9.184 -16.614
  678   2HB   PRO  92          1HB       PRO  92   9.516   9.494 -15.117
  679   1HG   PRO  92          2HG       PRO  92   9.884   7.332 -17.136
  680   2HG   PRO  92          1HG       PRO  92  11.100   8.281 -16.264
  681   1HD   PRO  92          2HD       PRO  92  10.437   5.747 -15.566
  682   2HD   PRO  92          1HD       PRO  92  10.978   6.964 -14.387
  683    H    ALA  93           H        ALA  93   7.724   5.606 -16.069
  684    HA   ALA  93           HA       ALA  93   5.654   6.410 -17.959
  685   1HB   ALA  93          1HB       ALA  93   7.393   4.162 -17.374
  686   2HB   ALA  93          2HB       ALA  93   6.582   4.561 -18.887
  687   3HB   ALA  93          3HB       ALA  93   5.748   3.599 -17.665
  688    H    LEU  94           H        LEU  94   5.710   5.644 -14.659
  689    HA   LEU  94           HA       LEU  94   2.903   4.648 -14.678
  690   1HB   LEU  94          2HB       LEU  94   5.277   4.479 -12.851
  691   2HB   LEU  94          1HB       LEU  94   3.663   4.277 -12.169
  692    HG   LEU  94           HG       LEU  94   4.777   2.127 -12.917
  693   1HD1  LEU  94          1HD1      LEU  94   2.707   1.392 -14.250
  694   2HD1  LEU  94          2HD1      LEU  94   2.148   3.056 -14.085
  695   3HD1  LEU  94          3HD1      LEU  94   2.413   2.069 -12.648
  696   1HD2  LEU  94          1HD2      LEU  94   4.163   3.191 -15.687
  697   2HD2  LEU  94          2HD2      LEU  94   4.985   1.686 -15.273
  698   3HD2  LEU  94          3HD2      LEU  94   5.778   3.234 -14.979
  699    H    VAL  95           H        VAL  95   4.797   7.437 -14.061
  700    HA   VAL  95           HA       VAL  95   3.031   8.594 -12.027
  701    HB   VAL  95           HB       VAL  95   4.589  10.434 -12.173
  702   1HG1  VAL  95          1HG1      VAL  95   6.070   7.843 -12.710
  703   2HG1  VAL  95          2HG1      VAL  95   5.437   8.343 -11.141
  704   3HG1  VAL  95          3HG1      VAL  95   6.730   9.267 -11.905
  705   1HG2  VAL  95          1HG2      VAL  95   6.406   9.909 -14.157
  706   2HG2  VAL  95          2HG2      VAL  95   5.067  11.046 -14.314
  707   3HG2  VAL  95          3HG2      VAL  95   4.899   9.398 -14.918
  708    HA   PRO  96           HA       PRO  96   0.172  10.172 -15.018
  709   1HB   PRO  96          2HB       PRO  96  -1.174  11.862 -13.331
  710   2HB   PRO  96          1HB       PRO  96  -1.412  10.103 -13.331
  711   1HG   PRO  96          2HG       PRO  96   0.214  11.794 -11.495
  712   2HG   PRO  96          1HG       PRO  96  -0.801  10.388 -11.134
  713   1HD   PRO  96          2HD       PRO  96   1.909  10.258 -11.311
  714   2HD   PRO  96          1HD       PRO  96   0.841   8.890 -11.695
  715    HA   PRO  97           HA       PRO  97   1.668  14.095 -16.301
  716   1HB   PRO  97          2HB       PRO  97  -0.588  15.539 -16.880
  717   2HB   PRO  97          1HB       PRO  97  -0.012  14.198 -17.891
  718   1HG   PRO  97          2HG       PRO  97  -2.166  14.223 -15.829
  719   2HG   PRO  97          1HG       PRO  97  -2.133  13.431 -17.413
  720   1HD   PRO  97          2HD       PRO  97  -1.699  12.091 -15.101
  721   2HD   PRO  97          1HD       PRO  97  -0.931  11.631 -16.638
  722    H    SER  98           H        SER  98  -0.336  13.887 -13.531
  723    HA   SER  98           HA       SER  98  -0.352  16.676 -12.756
  724   1HB   SER  98          2HB       SER  98  -1.886  15.635 -11.442
  725   2HB   SER  98          1HB       SER  98  -1.175  14.057 -11.769
  726    HG   SER  98           HG       SER  98   0.245  14.362 -10.112
  727    H    LYS  99           H        LYS  99   2.017  14.158 -12.647
  728    HA   LYS  99           HA       LYS  99   3.624  15.480 -10.544
  729   1HB   LYS  99          2HB       LYS  99   3.248  12.904 -11.252
  730   2HB   LYS  99          1HB       LYS  99   4.657  13.259 -12.253
  731   1HG   LYS  99          2HG       LYS  99   5.256  14.405  -9.770
  732   2HG   LYS  99          1HG       LYS  99   4.501  12.861  -9.375
  733   1HD   LYS  99          2HD       LYS  99   6.078  11.940 -11.279
  734   2HD   LYS  99          1HD       LYS  99   7.010  13.396 -10.930
  735   1HE   LYS  99          2HE       LYS  99   7.976  11.998  -9.360
  736   2HE   LYS  99          1HE       LYS  99   6.581  12.523  -8.397
  737   1HZ   LYS  99          1HZ       LYS  99   6.781  10.095 -10.095
  738   2HZ   LYS  99          2HZ       LYS  99   5.321  10.660  -9.434
  739   3HZ   LYS  99          3HZ       LYS  99   6.581  10.153  -8.412
  740    H    ARG 100           H        ARG 100   3.040  16.051 -13.757
  741    HA   ARG 100           HA       ARG 100   5.858  16.751 -14.441
  742   1HB   ARG 100          2HB       ARG 100   3.261  16.358 -15.923
  743   2HB   ARG 100          1HB       ARG 100   4.614  17.186 -16.695
  744   1HG   ARG 100          2HG       ARG 100   4.669  14.782 -17.212
  745   2HG   ARG 100          1HG       ARG 100   6.064  15.239 -16.236
  746   1HD   ARG 100          2HD       ARG 100   5.075  14.319 -14.239
  747   2HD   ARG 100          1HD       ARG 100   3.516  14.087 -15.054
  748    HE   ARG 100           HE       ARG 100   4.417  12.053 -15.829
  749   1HH1  ARG 100          1HH2      ARG 100   6.903  12.304 -14.147
  750   2HH1  ARG 100          2HH2      ARG 100   8.151  12.242 -15.347
  751   1HH2  ARG 100          2HH1      ARG 100   6.009  12.893 -17.994
  752   2HH2  ARG 100          1HH1      ARG 100   7.645  12.576 -17.522
  753    H    SER 107           1H       SER 107  -1.383   7.251   7.114
  754    HA   SER 107           HA       SER 107   1.058   6.152   8.222
  755   1HB   SER 107          2HB       SER 107  -0.695   4.022   7.273
  756   2HB   SER 107          1HB       SER 107   0.260   4.100   8.750
  757    HG   SER 107           HG       SER 107  -2.052   4.030   9.074
  758    H    THR 108           H        THR 108   2.296   6.556   6.426
  759    HA   THR 108           HA       THR 108   1.409   7.020   3.791
  760    HB   THR 108           HB       THR 108   3.877   6.144   3.355
  761    HG1  THR 108           HG1      THR 108   4.823   5.447   5.072
  762   1HG2  THR 108          1HG2      THR 108   2.762   8.576   3.963
  763   2HG2  THR 108          2HG2      THR 108   4.458   8.328   3.542
  764   3HG2  THR 108          3HG2      THR 108   3.972   8.407   5.235
  765    H    ASN 109           H        ASN 109   3.201   4.082   4.696
  766    HA   ASN 109           HA       ASN 109   1.645   2.570   2.651
  767   1HB   ASN 109          2HB       ASN 109   4.222   2.765   2.785
  768   2HB   ASN 109          1HB       ASN 109   4.101   1.676   4.167
  769   1HD2  ASN 109          1HD2      ASN 109   5.328   1.048   1.533
  770   2HD2  ASN 109          2HD2      ASN 109   4.450  -0.263   0.906
  771    HA   PRO 110           HA       PRO 110  -0.484   0.843   6.191
  772   1HB   PRO 110          2HB       PRO 110  -2.222  -0.695   4.741
  773   2HB   PRO 110          1HB       PRO 110  -2.438   1.054   4.968
  774   1HG   PRO 110          2HG       PRO 110  -1.349  -0.432   2.631
  775   2HG   PRO 110          1HG       PRO 110  -2.399   0.993   2.673
  776   1HD   PRO 110          2HD       PRO 110   0.281   1.113   2.180
  777   2HD   PRO 110          1HD       PRO 110  -0.641   2.442   2.917
  778    H    PHE 111           H        PHE 111   1.094  -0.882   3.574
  779    HA   PHE 111           HA       PHE 111   0.966  -3.486   4.966
  780   1HB   PHE 111          2HB       PHE 111   2.475  -2.636   2.478
  781   2HB   PHE 111          1HB       PHE 111   2.028  -4.279   2.930
  782    HD1  PHE 111           HD1      PHE 111   1.021  -1.355   1.134
  783    HD2  PHE 111           HD2      PHE 111  -0.499  -4.752   3.280
  784    HE1  PHE 111           HE1      PHE 111  -1.166  -1.079   0.018
  785    HE2  PHE 111           HE2      PHE 111  -2.691  -4.478   2.157
  786    HZ   PHE 111           HZ       PHE 111  -3.024  -2.642   0.530
  787    H    LEU 112           HN       LEU 112   3.376  -0.974   4.207
  788    HA   LEU 112           HA       LEU 112   5.595  -2.453   5.394
  789   1HB   LEU 112          2HB       LEU 112   5.101  -0.093   3.838
  790   2HB   LEU 112          1HB       LEU 112   6.087   0.352   5.232
  791    HG   LEU 112           HG       LEU 112   7.665  -1.473   4.692
  792   1HD1  LEU 112          1HD1      LEU 112   6.103  -3.012   3.611
  793   2HD1  LEU 112          2HD1      LEU 112   7.413  -2.628   2.495
  794   3HD1  LEU 112          3HD1      LEU 112   5.837  -1.861   2.303
  795   1HD2  LEU 112          1HD2      LEU 112   8.733  -0.355   2.899
  796   2HD2  LEU 112          2HD2      LEU 112   7.757   0.901   3.659
  797   3HD2  LEU 112          3HD2      LEU 112   7.198   0.128   2.175
  Start of MODEL    6
    1    HA   PRO   6           HA       PRO   6   0.804   6.505 -23.287
    2   1HB   PRO   6          2HB       PRO   6  -1.553   5.275 -22.639
    3   2HB   PRO   6          1HB       PRO   6  -1.223   5.938 -24.252
    4   1HG   PRO   6          2HG       PRO   6  -1.110   3.121 -23.305
    5   2HG   PRO   6          1HG       PRO   6  -1.672   3.772 -24.852
    6   1HD   PRO   6          2HD       PRO   6   0.769   2.597 -24.501
    7   2HD   PRO   6          1HD       PRO   6   0.432   3.820 -25.746
    8    H    TRP   7           H        TRP   7  -0.673   6.319 -21.026
    9    HA   TRP   7           HA       TRP   7   1.137   5.712 -18.938
   10   1HB   TRP   7          2HB       TRP   7  -0.804   7.185 -18.747
   11   2HB   TRP   7          1HB       TRP   7  -1.896   5.836 -19.053
   12    HD1  TRP   7           HD1      TRP   7   1.013   5.007 -16.870
   13    HE1  TRP   7           HE1      TRP   7   0.237   4.770 -14.421
   14    HE3  TRP   7           HE3      TRP   7  -3.718   6.872 -17.267
   15    HZ2  TRP   7           HZ2      TRP   7  -2.090   5.309 -12.841
   16    HZ3  TRP   7           HZ3      TRP   7  -5.194   7.003 -15.283
   17    HH2  TRP   7           HH2      TRP   7  -4.388   6.224 -13.070
   18    H    ALA   8           H        ALA   8   1.734   3.765 -18.051
   19    HA   ALA   8           HA       ALA   8   1.325   1.237 -18.990
   20   1HB   ALA   8          1HB       ALA   8   1.246   0.842 -16.261
   21   2HB   ALA   8          2HB       ALA   8   1.874   2.484 -16.393
   22   3HB   ALA   8          3HB       ALA   8   2.713   1.157 -17.193
   23    H    VAL   9           H        VAL   9  -0.979   3.118 -17.124
   24    HA   VAL   9           HA       VAL   9  -2.891   0.828 -17.068
   25    HB   VAL   9           HB       VAL   9  -2.752   3.541 -15.719
   26   1HG1  VAL   9          1HG1      VAL   9  -4.748   1.686 -14.686
   27   2HG1  VAL   9          2HG1      VAL   9  -5.078   2.122 -16.362
   28   3HG1  VAL   9          3HG1      VAL   9  -4.930   3.381 -15.136
   29   1HG2  VAL   9          1HG2      VAL   9  -2.243   0.689 -14.931
   30   2HG2  VAL   9          2HG2      VAL   9  -2.824   1.821 -13.710
   31   3HG2  VAL   9          3HG2      VAL   9  -1.304   2.134 -14.552
   32    H    LYS  10           H        LYS  10  -4.608   0.817 -18.474
   33    HA   LYS  10           HA       LYS  10  -4.870   3.044 -20.400
   34   1HB   LYS  10          2HB       LYS  10  -5.335   0.197 -20.241
   35   2HB   LYS  10          1HB       LYS  10  -6.793   1.006 -20.817
   36   1HG   LYS  10          2HG       LYS  10  -5.080   2.322 -22.343
   37   2HG   LYS  10          1HG       LYS  10  -4.065   0.908 -22.055
   38   1HD   LYS  10          2HD       LYS  10  -6.543  -0.202 -22.617
   39   2HD   LYS  10          1HD       LYS  10  -6.456   1.168 -23.725
   40   1HE   LYS  10          2HE       LYS  10  -4.147  -0.767 -23.421
   41   2HE   LYS  10          1HE       LYS  10  -5.454  -1.037 -24.591
   42   1HZ   LYS  10          1HZ       LYS  10  -3.327   0.487 -25.107
   43   2HZ   LYS  10          2HZ       LYS  10  -4.385   1.661 -24.485
   44   3HZ   LYS  10          3HZ       LYS  10  -4.843   0.727 -25.828
   45    HA   PRO  11           HA       PRO  11  -8.616   4.745 -18.867
   46   1HB   PRO  11          2HB       PRO  11 -10.460   4.490 -20.880
   47   2HB   PRO  11          1HB       PRO  11  -9.118   5.651 -20.937
   48   1HG   PRO  11          2HG       PRO  11  -9.364   2.975 -22.227
   49   2HG   PRO  11          1HG       PRO  11  -8.679   4.478 -22.869
   50   1HD   PRO  11          2HD       PRO  11  -7.144   2.460 -21.930
   51   2HD   PRO  11          1HD       PRO  11  -6.658   4.165 -21.820
   52    H    GLU  12           H        GLU  12  -9.089   1.579 -20.398
   53    HA   GLU  12           HA       GLU  12 -11.553   0.955 -18.990
   54   1HB   GLU  12          2HB       GLU  12 -11.207  -1.228 -19.989
   55   2HB   GLU  12          1HB       GLU  12 -10.706  -0.015 -21.167
   56   1HG   GLU  12          2HG       GLU  12  -8.370  -0.374 -19.836
   57   2HG   GLU  12          1HG       GLU  12  -9.071  -1.984 -19.670
   58    H    ASP  13           H        ASP  13  -8.132   0.654 -18.287
   59    HA   ASP  13           HA       ASP  13  -8.512  -1.192 -16.036
   60   1HB   ASP  13          2HB       ASP  13  -6.359   0.068 -17.582
   61   2HB   ASP  13          1HB       ASP  13  -6.004  -0.002 -15.855
   62    H    LYS  14           H        LYS  14  -7.928   2.252 -16.582
   63    HA   LYS  14           HA       LYS  14  -7.786   2.962 -13.778
   64   1HB   LYS  14          2HB       LYS  14  -6.764   4.364 -15.444
   65   2HB   LYS  14          1HB       LYS  14  -8.263   4.454 -16.369
   66   1HG   LYS  14          2HG       LYS  14  -8.130   6.522 -15.195
   67   2HG   LYS  14          1HG       LYS  14  -9.299   5.552 -14.300
   68   1HD   LYS  14          2HD       LYS  14  -7.014   4.787 -13.060
   69   2HD   LYS  14          1HD       LYS  14  -6.579   6.435 -13.513
   70   1HE   LYS  14          2HE       LYS  14  -7.843   7.241 -11.819
   71   2HE   LYS  14          1HE       LYS  14  -9.273   6.435 -12.494
   72   1HZ   LYS  14          1HZ       LYS  14  -8.095   4.325 -11.554
   73   2HZ   LYS  14          2HZ       LYS  14  -9.036   5.302 -10.531
   74   3HZ   LYS  14          3HZ       LYS  14  -7.341   5.436 -10.519
   75    H    ALA  15           H        ALA  15 -10.309   2.102 -15.907
   76    HA   ALA  15           HA       ALA  15 -12.444   3.669 -14.653
   77   1HB   ALA  15          1HB       ALA  15 -13.697   2.766 -16.371
   78   2HB   ALA  15          2HB       ALA  15 -12.986   1.163 -16.175
   79   3HB   ALA  15          3HB       ALA  15 -12.103   2.420 -17.040
   80    H    LYS  16           H        LYS  16 -11.176   0.354 -14.497
   81    HA   LYS  16           HA       LYS  16 -13.118  -0.472 -12.468
   82   1HB   LYS  16          2HB       LYS  16 -12.272  -2.558 -12.942
   83   2HB   LYS  16          1HB       LYS  16 -11.636  -1.731 -14.361
   84   1HG   LYS  16          2HG       LYS  16  -9.511  -1.363 -13.251
   85   2HG   LYS  16          1HG       LYS  16 -10.138  -2.061 -11.757
   86   1HD   LYS  16          2HD       LYS  16  -9.332  -4.037 -12.508
   87   2HD   LYS  16          1HD       LYS  16 -10.675  -4.017 -13.652
   88   1HE   LYS  16          2HE       LYS  16  -8.299  -2.414 -14.443
   89   2HE   LYS  16          1HE       LYS  16  -8.093  -4.178 -14.455
   90   1HZ   LYS  16          1HZ       LYS  16 -10.505  -2.894 -15.582
   91   2HZ   LYS  16          2HZ       LYS  16  -9.911  -4.460 -15.866
   92   3HZ   LYS  16          3HZ       LYS  16  -9.110  -3.111 -16.522
   93    H    TYR  17           H        TYR  17  -9.989   1.025 -12.614
   94    HA   TYR  17           HA       TYR  17  -9.232   0.490  -9.830
   95   1HB   TYR  17          2HB       TYR  17  -8.289   2.498 -11.913
   96   2HB   TYR  17          1HB       TYR  17  -7.478   2.181 -10.385
   97    HD1  TYR  17           HD1      TYR  17  -8.820  -0.873 -11.321
   98    HD2  TYR  17           HD2      TYR  17  -5.681   1.835 -12.427
   99    HE1  TYR  17           HE1      TYR  17  -7.582  -2.744 -12.376
  100    HE2  TYR  17           HE2      TYR  17  -4.428  -0.035 -13.475
  101    HH   TYR  17           HH       TYR  17  -5.738  -2.864 -14.332
  102    H    ASP  18           H        ASP  18 -10.861   2.994 -11.693
  103    HA   ASP  18           HA       ASP  18 -10.982   4.930  -9.501
  104   1HB   ASP  18          2HB       ASP  18 -10.940   5.346 -12.025
  105   2HB   ASP  18          1HB       ASP  18 -12.614   4.789 -12.049
  106    H    ALA  19           H        ALA  19 -12.640   2.072 -10.215
  107    HA   ALA  19           HA       ALA  19 -15.215   2.960  -9.014
  108   1HB   ALA  19          1HB       ALA  19 -14.139   0.493 -10.389
  109   2HB   ALA  19          2HB       ALA  19 -15.495   1.512 -10.874
  110   3HB   ALA  19          3HB       ALA  19 -15.657   0.427  -9.493
  111    H    ILE  20           H        ILE  20 -12.402   0.950  -8.487
  112    HA   ILE  20           HA       ILE  20 -13.239  -0.094  -5.901
  113    HB   ILE  20           HB       ILE  20 -10.679   0.064  -7.524
  114   1HG1  ILE  20          2HG1      ILE  20 -12.190  -2.431  -6.791
  115   2HG1  ILE  20          1HG1      ILE  20 -12.750  -1.427  -8.129
  116   1HG2  ILE  20          1HG2      ILE  20 -10.906  -1.825  -5.252
  117   2HG2  ILE  20          2HG2      ILE  20 -10.630  -0.131  -4.854
  118   3HG2  ILE  20          3HG2      ILE  20  -9.493  -0.988  -5.890
  119   1HD1  ILE  20          1HD1      ILE  20 -10.104  -2.852  -7.843
  120   2HD1  ILE  20          2HD1      ILE  20 -10.318  -1.524  -8.985
  121   3HD1  ILE  20          3HD1      ILE  20 -11.286  -2.990  -9.145
  122    H    PHE  21           H        PHE  21 -11.428   2.609  -7.214
  123    HA   PHE  21           HA       PHE  21 -10.318   3.521  -4.702
  124   1HB   PHE  21          2HB       PHE  21  -9.121   4.346  -6.490
  125   2HB   PHE  21          1HB       PHE  21 -10.534   4.379  -7.540
  126    HD1  PHE  21           HD1      PHE  21  -8.343   6.322  -5.458
  127    HD2  PHE  21           HD2      PHE  21 -12.303   6.200  -7.115
  128    HE1  PHE  21           HE1      PHE  21  -8.582   8.760  -5.064
  129    HE2  PHE  21           HE2      PHE  21 -12.544   8.636  -6.721
  130    HZ   PHE  21           HZ       PHE  21 -10.684   9.915  -5.697
  131    H    ASP  22           H        ASP  22 -13.194   4.218  -6.620
  132    HA   ASP  22           HA       ASP  22 -14.163   6.242  -4.699
  133   1HB   ASP  22          2HB       ASP  22 -14.520   6.711  -7.012
  134   2HB   ASP  22          1HB       ASP  22 -15.110   5.078  -7.326
  135    H    SER  23           H        SER  23 -14.041   2.963  -4.675
  136    HA   SER  23           HA       SER  23 -16.816   2.464  -3.752
  137   1HB   SER  23          2HB       SER  23 -16.088   0.641  -4.975
  138   2HB   SER  23          1HB       SER  23 -14.397   0.919  -4.565
  139    HG   SER  23           HG       SER  23 -14.619  -0.392  -2.943
  140    H    LEU  24           H        LEU  24 -13.926   3.587  -2.507
  141    HA   LEU  24           HA       LEU  24 -14.428   2.509   0.241
  142   1HB   LEU  24          2HB       LEU  24 -11.989   4.072  -0.455
  143   2HB   LEU  24          1HB       LEU  24 -12.133   2.622   0.532
  144    HG   LEU  24           HG       LEU  24 -12.386   2.656  -2.486
  145   1HD1  LEU  24          1HD1      LEU  24 -10.087   3.145  -1.095
  146   2HD1  LEU  24          2HD1      LEU  24 -10.134   2.349  -2.669
  147   3HD1  LEU  24          3HD1      LEU  24 -10.050   1.386  -1.194
  148   1HD2  LEU  24          1HD2      LEU  24 -13.381   0.799  -0.867
  149   2HD2  LEU  24          2HD2      LEU  24 -11.696   0.275  -0.809
  150   3HD2  LEU  24          3HD2      LEU  24 -12.544   0.343  -2.353
  151    H    SER  25           H        SER  25 -14.938   5.164  -1.728
  152    HA   SER  25           HA       SER  25 -15.912   7.266  -1.168
  153   1HB   SER  25          2HB       SER  25 -16.545   7.629   1.023
  154   2HB   SER  25          1HB       SER  25 -16.219   5.903   1.133
  155    HG   SER  25           HG       SER  25 -14.607   8.089   1.912
  156    HA   PRO  26           HA       PRO  26 -11.648   8.706  -1.631
  157   1HB   PRO  26          2HB       PRO  26 -12.240  10.453  -3.644
  158   2HB   PRO  26          1HB       PRO  26 -11.959   8.723  -3.921
  159   1HG   PRO  26          2HG       PRO  26 -14.517  10.224  -3.761
  160   2HG   PRO  26          1HG       PRO  26 -14.062   8.879  -4.817
  161   1HD   PRO  26          2HD       PRO  26 -15.622   8.607  -2.587
  162   2HD   PRO  26          1HD       PRO  26 -14.621   7.302  -3.260
  163    H    VAL  27           H        VAL  27 -10.732  10.652  -0.913
  164    HA   VAL  27           HA       VAL  27 -12.660  12.657   0.204
  165    HB   VAL  27           HB       VAL  27  -9.893  11.776   1.097
  166   1HG1  VAL  27          1HG1      VAL  27 -11.209  14.221   1.541
  167   2HG1  VAL  27          2HG1      VAL  27  -9.822  13.593   2.431
  168   3HG1  VAL  27          3HG1      VAL  27 -11.457  13.287   3.017
  169   1HG2  VAL  27          1HG2      VAL  27 -12.311  11.494   2.806
  170   2HG2  VAL  27          2HG2      VAL  27 -10.926  10.417   2.633
  171   3HG2  VAL  27          3HG2      VAL  27 -12.206  10.409   1.418
  172    H    ASN  28           H        ASN  28 -12.661  14.219  -1.425
  173    HA   ASN  28           HA       ASN  28 -11.816  15.991  -2.734
  174   1HB   ASN  28          2HB       ASN  28 -10.764  16.463  -0.493
  175   2HB   ASN  28          1HB       ASN  28  -9.352  15.548  -1.019
  176   1HD2  ASN  28          1HD2      ASN  28  -8.126  16.415  -2.898
  177   2HD2  ASN  28          2HD2      ASN  28  -8.214  18.069  -3.273
  178    H    GLY  29           H        GLY  29 -11.103  12.956  -3.153
  179   1HA   GLY  29          2HA       GLY  29 -10.301  12.095  -5.277
  180   2HA   GLY  29          1HA       GLY  29  -9.230  13.489  -5.400
  181    H    PHE  30           H        PHE  30  -9.608  11.478  -2.512
  182    HA   PHE  30           HA       PHE  30  -6.985  10.193  -3.033
  183   1HB   PHE  30          2HB       PHE  30  -7.618  12.113  -0.786
  184   2HB   PHE  30          1HB       PHE  30  -6.188  11.070  -0.801
  185    HD1  PHE  30           HD1      PHE  30  -7.568  14.176  -1.881
  186    HD2  PHE  30           HD2      PHE  30  -4.717  11.145  -2.929
  187    HE1  PHE  30           HE1      PHE  30  -6.431  15.774  -3.384
  188    HE2  PHE  30           HE2      PHE  30  -3.569  12.747  -4.437
  189    HZ   PHE  30           HZ       PHE  30  -4.424  15.066  -4.664
  190    H    LEU  31           H        LEU  31  -6.704   8.290  -1.953
  191    HA   LEU  31           HA       LEU  31  -8.907   7.411  -0.106
  192   1HB   LEU  31          2HB       LEU  31  -7.165   5.998  -2.132
  193   2HB   LEU  31          1HB       LEU  31  -7.946   5.098  -0.832
  194    HG   LEU  31           HG       LEU  31  -9.272   6.710  -3.012
  195   1HD1  LEU  31          1HD1      LEU  31  -9.021   4.600  -3.877
  196   2HD1  LEU  31          2HD1      LEU  31 -10.460   4.283  -2.903
  197   3HD1  LEU  31          3HD1      LEU  31  -8.859   3.862  -2.281
  198   1HD2  LEU  31          1HD2      LEU  31 -10.363   5.615  -0.407
  199   2HD2  LEU  31          2HD2      LEU  31 -11.398   5.877  -1.813
  200   3HD2  LEU  31          3HD2      LEU  31 -10.557   7.240  -1.070
  201    H    SER  32           H        SER  32  -8.215   6.739   1.933
  202    HA   SER  32           HA       SER  32  -5.387   7.207   2.583
  203   1HB   SER  32          2HB       SER  32  -6.141   7.036   4.842
  204   2HB   SER  32          1HB       SER  32  -7.455   7.831   3.977
  205    HG   SER  32           HG       SER  32  -8.238   6.126   5.252
  206    H    GLY  33           H        GLY  33  -3.887   5.617   3.036
  207   1HA   GLY  33          2HA       GLY  33  -3.937   3.119   1.867
  208   2HA   GLY  33          1HA       GLY  33  -3.056   3.410   3.368
  209    H    ASP  34           H        ASP  34  -5.572   4.093   4.786
  210    HA   ASP  34           HA       ASP  34  -6.223   1.535   5.875
  211   1HB   ASP  34          2HB       ASP  34  -6.462   3.823   6.918
  212   2HB   ASP  34          1HB       ASP  34  -7.874   4.078   5.891
  213    H    LYS  35           H        LYS  35  -7.502   3.267   3.098
  214    HA   LYS  35           HA       LYS  35  -9.829   1.418   2.920
  215   1HB   LYS  35          2HB       LYS  35  -8.931   3.926   1.466
  216   2HB   LYS  35          1HB       LYS  35 -10.362   3.005   0.998
  217   1HG   LYS  35          2HG       LYS  35 -11.294   3.301   3.267
  218   2HG   LYS  35          1HG       LYS  35  -9.875   4.242   3.723
  219   1HD   LYS  35          2HD       LYS  35 -10.434   6.010   2.245
  220   2HD   LYS  35          1HD       LYS  35 -11.594   5.015   1.365
  221   1HE   LYS  35          2HE       LYS  35 -12.583   6.710   3.044
  222   2HE   LYS  35          1HE       LYS  35 -13.143   5.034   3.207
  223   1HZ   LYS  35          1HZ       LYS  35 -11.732   4.638   4.982
  224   2HZ   LYS  35          2HZ       LYS  35 -12.243   6.230   5.289
  225   3HZ   LYS  35          3HZ       LYS  35 -10.712   5.941   4.610
  226    H    VAL  36           H        VAL  36  -6.837   2.395   1.357
  227    HA   VAL  36           HA       VAL  36  -7.112   0.620  -0.940
  228    HB   VAL  36           HB       VAL  36  -4.778   2.052   0.360
  229   1HG1  VAL  36          1HG1      VAL  36  -5.014   1.001  -2.469
  230   2HG1  VAL  36          2HG1      VAL  36  -4.178   0.140  -1.174
  231   3HG1  VAL  36          3HG1      VAL  36  -3.594   1.716  -1.706
  232   1HG2  VAL  36          1HG2      VAL  36  -5.395   3.380  -1.951
  233   2HG2  VAL  36          2HG2      VAL  36  -5.985   3.843  -0.355
  234   3HG2  VAL  36          3HG2      VAL  36  -6.992   2.859  -1.418
  235    H    LYS  37           H        LYS  37  -5.479   0.467   2.224
  236    HA   LYS  37           HA       LYS  37  -3.852  -1.739   1.959
  237   1HB   LYS  37          2HB       LYS  37  -4.225  -0.340   3.993
  238   2HB   LYS  37          1HB       LYS  37  -5.729  -1.210   4.274
  239   1HG   LYS  37          2HG       LYS  37  -4.013  -3.293   3.954
  240   2HG   LYS  37          1HG       LYS  37  -2.936  -2.095   4.673
  241   1HD   LYS  37          2HD       LYS  37  -5.611  -2.341   5.932
  242   2HD   LYS  37          1HD       LYS  37  -4.532  -3.722   6.142
  243   1HE   LYS  37          2HE       LYS  37  -2.904  -1.462   6.571
  244   2HE   LYS  37          1HE       LYS  37  -4.417  -1.127   7.437
  245   1HZ   LYS  37          1HZ       LYS  37  -2.919  -3.690   7.577
  246   2HZ   LYS  37          2HZ       LYS  37  -4.318  -3.288   8.454
  247   3HZ   LYS  37          3HZ       LYS  37  -2.857  -2.477   8.760
  248    HA   PRO  38           HA       PRO  38  -7.515  -4.771   2.654
  249   1HB   PRO  38          2HB       PRO  38 -10.033  -3.793   2.178
  250   2HB   PRO  38          1HB       PRO  38  -9.284  -3.794   3.787
  251   1HG   PRO  38          2HG       PRO  38  -9.507  -1.577   1.806
  252   2HG   PRO  38          1HG       PRO  38  -9.727  -1.543   3.563
  253   1HD   PRO  38          2HD       PRO  38  -7.465  -0.676   2.388
  254   2HD   PRO  38          1HD       PRO  38  -7.470  -1.460   3.983
  255    H    VAL  39           H        VAL  39  -7.888  -2.211   0.262
  256    HA   VAL  39           HA       VAL  39  -9.093  -3.696  -1.849
  257    HB   VAL  39           HB       VAL  39  -7.545  -1.185  -1.449
  258   1HG1  VAL  39          1HG1      VAL  39  -7.327  -0.736  -3.836
  259   2HG1  VAL  39          2HG1      VAL  39  -8.018  -2.311  -4.226
  260   3HG1  VAL  39          3HG1      VAL  39  -6.440  -2.207  -3.446
  261   1HG2  VAL  39          1HG2      VAL  39 -10.187  -1.874  -1.657
  262   2HG2  VAL  39          2HG2      VAL  39  -9.840  -1.329  -3.297
  263   3HG2  VAL  39          3HG2      VAL  39  -9.559  -0.249  -1.933
  264    H    LEU  40           H        LEU  40  -5.736  -3.449  -0.766
  265    HA   LEU  40           HA       LEU  40  -4.758  -4.954  -3.123
  266   1HB   LEU  40          2HB       LEU  40  -3.259  -4.084  -0.644
  267   2HB   LEU  40          1HB       LEU  40  -2.606  -4.380  -2.254
  268    HG   LEU  40           HG       LEU  40  -4.616  -2.207  -1.634
  269   1HD1  LEU  40          1HD1      LEU  40  -2.836  -1.210  -0.626
  270   2HD1  LEU  40          2HD1      LEU  40  -2.282  -0.938  -2.279
  271   3HD1  LEU  40          3HD1      LEU  40  -1.678  -2.319  -1.363
  272   1HD2  LEU  40          1HD2      LEU  40  -4.196  -3.339  -4.003
  273   2HD2  LEU  40          2HD2      LEU  40  -2.790  -2.271  -4.005
  274   3HD2  LEU  40          3HD2      LEU  40  -4.411  -1.594  -3.859
  275    H    LEU  41           H        LEU  41  -5.657  -5.488   0.207
  276    HA   LEU  41           HA       LEU  41  -4.226  -7.995   0.553
  277   1HB   LEU  41          2HB       LEU  41  -6.575  -6.655   1.927
  278   2HB   LEU  41          1HB       LEU  41  -5.820  -8.137   2.514
  279    HG   LEU  41           HG       LEU  41  -4.210  -5.649   1.972
  280   1HD1  LEU  41          1HD1      LEU  41  -6.145  -6.145   4.089
  281   2HD1  LEU  41          2HD1      LEU  41  -5.251  -4.670   3.721
  282   3HD1  LEU  41          3HD1      LEU  41  -4.522  -5.912   4.740
  283   1HD2  LEU  41          1HD2      LEU  41  -2.484  -6.858   2.831
  284   2HD2  LEU  41          2HD2      LEU  41  -3.509  -8.260   2.522
  285   3HD2  LEU  41          3HD2      LEU  41  -3.484  -7.521   4.124
  286    H    ASN  42           H        ASN  42  -7.044  -7.029  -1.149
  287    HA   ASN  42           HA       ASN  42  -8.358  -9.650  -0.897
  288   1HB   ASN  42          2HB       ASN  42 -10.166  -8.571  -1.907
  289   2HB   ASN  42          1HB       ASN  42  -9.339  -7.205  -1.162
  290   1HD2  ASN  42          1HD2      ASN  42 -10.987  -7.601  -3.811
  291   2HD2  ASN  42          2HD2      ASN  42 -10.015  -6.843  -4.978
  292    H    SER  43           H        SER  43  -5.757  -8.552  -2.633
  293    HA   SER  43           HA       SER  43  -6.382  -9.924  -5.177
  294   1HB   SER  43          2HB       SER  43  -4.522  -8.763  -5.956
  295   2HB   SER  43          1HB       SER  43  -5.051  -7.705  -4.652
  296    HG   SER  43           HG       SER  43  -2.828  -8.155  -4.500
  297    H    LYS  44           H        LYS  44  -5.728 -11.175  -2.292
  298    HA   LYS  44           HA       LYS  44  -4.793 -13.256  -1.639
  299   1HB   LYS  44          2HB       LYS  44  -5.506 -13.423  -4.311
  300   2HB   LYS  44          1HB       LYS  44  -3.811 -13.915  -4.331
  301   1HG   LYS  44          2HG       LYS  44  -4.606 -15.336  -2.204
  302   2HG   LYS  44          1HG       LYS  44  -6.155 -15.235  -3.043
  303   1HD   LYS  44          2HD       LYS  44  -5.376 -16.398  -4.908
  304   2HD   LYS  44          1HD       LYS  44  -3.690 -15.988  -4.586
  305   1HE   LYS  44          2HE       LYS  44  -4.392 -17.411  -2.316
  306   2HE   LYS  44          1HE       LYS  44  -5.258 -18.269  -3.606
  307   1HZ   LYS  44          1HZ       LYS  44  -3.325 -18.633  -4.790
  308   2HZ   LYS  44          2HZ       LYS  44  -2.785 -18.829  -3.191
  309   3HZ   LYS  44          3HZ       LYS  44  -2.480 -17.379  -4.023
  310    H    LEU  45           H        LEU  45  -3.161 -10.631  -2.369
  311    HA   LEU  45           HA       LEU  45  -0.453 -11.849  -2.641
  312   1HB   LEU  45          2HB       LEU  45  -1.729  -9.165  -3.030
  313   2HB   LEU  45          1HB       LEU  45   0.008  -9.241  -2.743
  314    HG   LEU  45           HG       LEU  45  -1.455 -10.789  -4.903
  315   1HD1  LEU  45          1HD1      LEU  45  -0.976  -9.110  -6.383
  316   2HD1  LEU  45          2HD1      LEU  45   0.525  -8.679  -5.564
  317   3HD1  LEU  45          3HD1      LEU  45  -1.019  -8.111  -4.931
  318   1HD2  LEU  45          1HD2      LEU  45   1.465 -10.347  -5.022
  319   2HD2  LEU  45          2HD2      LEU  45   0.535 -11.801  -5.375
  320   3HD2  LEU  45          3HD2      LEU  45   0.937 -11.396  -3.707
  321    HA   PRO  46           HA       PRO  46   0.396 -11.162   1.610
  322   1HB   PRO  46          2HB       PRO  46   3.126 -11.078   1.492
  323   2HB   PRO  46          1HB       PRO  46   2.197 -12.577   1.310
  324   1HG   PRO  46          2HG       PRO  46   3.519 -10.913  -0.745
  325   2HG   PRO  46          1HG       PRO  46   3.287 -12.664  -0.682
  326   1HD   PRO  46          2HD       PRO  46   1.783 -10.914  -2.202
  327   2HD   PRO  46          1HD       PRO  46   1.286 -12.552  -1.742
  328    H    VAL  47           H        VAL  47   1.747  -9.551   2.997
  329    HA   VAL  47           HA       VAL  47   1.148  -6.849   2.214
  330    HB   VAL  47           HB       VAL  47   2.267  -8.403   4.473
  331   1HG1  VAL  47          1HG1      VAL  47   3.093  -6.306   5.617
  332   2HG1  VAL  47          2HG1      VAL  47   3.051  -5.507   4.045
  333   3HG1  VAL  47          3HG1      VAL  47   4.125  -6.882   4.308
  334   1HG2  VAL  47          1HG2      VAL  47   0.560  -7.384   5.634
  335   2HG2  VAL  47          2HG2      VAL  47  -0.081  -7.242   3.997
  336   3HG2  VAL  47          3HG2      VAL  47   0.722  -5.865   4.753
  337    H    ASP  48           H        ASP  48   3.637  -8.912   1.270
  338    HA   ASP  48           HA       ASP  48   5.787  -6.936   1.239
  339   1HB   ASP  48          2HB       ASP  48   5.414  -9.682   0.001
  340   2HB   ASP  48          1HB       ASP  48   6.934  -8.787  -0.023
  341    H    ILE  49           H        ILE  49   3.312  -8.149  -0.920
  342    HA   ILE  49           HA       ILE  49   4.416  -6.775  -3.278
  343    HB   ILE  49           HB       ILE  49   1.657  -7.954  -2.924
  344   1HG1  ILE  49          2HG1      ILE  49   3.131  -9.635  -2.029
  345   2HG1  ILE  49          1HG1      ILE  49   2.717 -10.128  -3.671
  346   1HG2  ILE  49          1HG2      ILE  49   1.674  -7.227  -5.076
  347   2HG2  ILE  49          2HG2      ILE  49   2.613  -8.690  -5.374
  348   3HG2  ILE  49          3HG2      ILE  49   3.433  -7.146  -5.137
  349   1HD1  ILE  49          1HD1      ILE  49   5.283  -8.903  -2.673
  350   2HD1  ILE  49          2HD1      ILE  49   4.854  -8.885  -4.386
  351   3HD1  ILE  49          3HD1      ILE  49   5.056 -10.422  -3.543
  352    H    LEU  50           H        LEU  50   1.844  -6.422  -0.919
  353    HA   LEU  50           HA       LEU  50   0.645  -4.074  -2.152
  354   1HB   LEU  50          2HB       LEU  50   0.461  -5.042   0.704
  355   2HB   LEU  50          1HB       LEU  50  -0.748  -4.155  -0.220
  356    HG   LEU  50           HG       LEU  50   0.144  -7.010  -0.664
  357   1HD1  LEU  50          1HD1      LEU  50  -2.295  -7.437  -0.261
  358   2HD1  LEU  50          2HD1      LEU  50  -2.473  -5.732   0.155
  359   3HD1  LEU  50          3HD1      LEU  50  -1.448  -6.778   1.141
  360   1HD2  LEU  50          1HD2      LEU  50  -2.091  -6.345  -2.274
  361   2HD2  LEU  50          2HD2      LEU  50  -0.470  -6.778  -2.817
  362   3HD2  LEU  50          3HD2      LEU  50  -0.886  -5.086  -2.542
  363    H    GLY  51           H        GLY  51   3.170  -4.733   0.204
  364   1HA   GLY  51          2HA       GLY  51   3.282  -2.014   1.247
  365   2HA   GLY  51          1HA       GLY  51   4.527  -3.253   1.457
  366    H    ARG  52           H        ARG  52   4.466  -3.756  -1.474
  367    HA   ARG  52           HA       ARG  52   6.304  -1.554  -2.266
  368   1HB   ARG  52          2HB       ARG  52   7.026  -3.937  -2.254
  369   2HB   ARG  52          1HB       ARG  52   5.774  -4.291  -3.445
  370   1HG   ARG  52          2HG       ARG  52   6.865  -3.162  -5.141
  371   2HG   ARG  52          1HG       ARG  52   7.683  -2.065  -4.029
  372   1HD   ARG  52          2HD       ARG  52   8.351  -4.984  -4.531
  373   2HD   ARG  52          1HD       ARG  52   9.365  -3.570  -4.882
  374    HE   ARG  52           HE       ARG  52   9.005  -3.204  -2.252
  375   1HH1  ARG  52          1HH2      ARG  52  10.219  -5.764  -4.157
  376   2HH1  ARG  52          2HH2      ARG  52  10.728  -6.724  -2.808
  377   1HH2  ARG  52          2HH1      ARG  52   9.371  -4.589  -0.437
  378   2HH2  ARG  52          1HH1      ARG  52  10.248  -6.059  -0.703
  379    H    VAL  53           H        VAL  53   3.293  -3.200  -3.213
  380    HA   VAL  53           HA       VAL  53   3.117  -1.890  -5.807
  381    HB   VAL  53           HB       VAL  53   1.248  -3.386  -3.964
  382   1HG1  VAL  53          1HG1      VAL  53   0.457  -1.445  -5.912
  383   2HG1  VAL  53          2HG1      VAL  53  -0.571  -2.547  -4.997
  384   3HG1  VAL  53          3HG1      VAL  53   0.085  -3.041  -6.556
  385   1HG2  VAL  53          1HG2      VAL  53   3.132  -4.215  -5.765
  386   2HG2  VAL  53          2HG2      VAL  53   1.692  -4.171  -6.790
  387   3HG2  VAL  53          3HG2      VAL  53   1.710  -5.163  -5.326
  388    H    TRP  54           H        TRP  54   1.970  -1.200  -2.526
  389    HA   TRP  54           HA       TRP  54   0.339   1.071  -3.192
  390   1HB   TRP  54          2HB       TRP  54   0.050   0.212  -1.015
  391   2HB   TRP  54          1HB       TRP  54   1.790   0.043  -0.757
  392    HD1  TRP  54           HD1      TRP  54   3.199   2.316  -0.429
  393    HE1  TRP  54           HE1      TRP  54   2.528   4.583   0.556
  394    HE3  TRP  54           HE3      TRP  54  -1.889   1.863  -0.586
  395    HZ2  TRP  54           HZ2      TRP  54   0.138   6.024   1.225
  396    HZ3  TRP  54           HZ3      TRP  54  -3.341   3.704   0.245
  397    HH2  TRP  54           HH2      TRP  54  -2.330   5.775   1.144
  398    H    GLU  55           H        GLU  55   3.741   0.833  -2.032
  399    HA   GLU  55           HA       GLU  55   4.435   3.536  -2.051
  400   1HB   GLU  55          2HB       GLU  55   5.906   1.024  -2.819
  401   2HB   GLU  55          1HB       GLU  55   6.716   2.588  -2.726
  402   1HG   GLU  55          2HG       GLU  55   5.062   2.132  -0.393
  403   2HG   GLU  55          1HG       GLU  55   6.241   0.836  -0.605
  404    H    LEU  56           H        LEU  56   5.020   1.343  -4.813
  405    HA   LEU  56           HA       LEU  56   5.631   3.417  -6.677
  406   1HB   LEU  56          2HB       LEU  56   4.387   0.684  -7.144
  407   2HB   LEU  56          1HB       LEU  56   5.280   1.631  -8.335
  408    HG   LEU  56           HG       LEU  56   6.707   1.185  -5.784
  409   1HD1  LEU  56          1HD1      LEU  56   6.762  -1.150  -7.626
  410   2HD1  LEU  56          2HD1      LEU  56   5.333  -0.986  -6.606
  411   3HD1  LEU  56          3HD1      LEU  56   6.932  -1.095  -5.871
  412   1HD2  LEU  56          1HD2      LEU  56   8.441   1.675  -7.164
  413   2HD2  LEU  56          2HD2      LEU  56   7.282   1.854  -8.479
  414   3HD2  LEU  56          3HD2      LEU  56   8.047   0.295  -8.190
  415    H    SER  57           H        SER  57   2.666   2.429  -5.261
  416    HA   SER  57           HA       SER  57   0.951   3.588  -7.388
  417   1HB   SER  57          2HB       SER  57   0.540   2.177  -4.747
  418   2HB   SER  57          1HB       SER  57  -0.801   2.924  -5.607
  419    HG   SER  57           HG       SER  57   0.590   0.625  -6.141
  420    H    ASP  58           H        ASP  58   2.283   4.320  -4.236
  421    HA   ASP  58           HA       ASP  58   0.610   6.636  -3.685
  422   1HB   ASP  58          2HB       ASP  58   1.937   5.054  -2.117
  423   2HB   ASP  58          1HB       ASP  58   3.343   6.024  -2.562
  424    H    ILE  59           H        ILE  59   0.805   8.206  -5.335
  425    HA   ILE  59           HA       ILE  59   3.468   8.918  -6.386
  426    HB   ILE  59           HB       ILE  59   0.722  10.104  -6.876
  427   1HG1  ILE  59          2HG1      ILE  59   0.959   7.603  -7.298
  428   2HG1  ILE  59          1HG1      ILE  59   0.502   8.563  -8.705
  429   1HG2  ILE  59          1HG2      ILE  59   3.274  10.149  -8.510
  430   2HG2  ILE  59          2HG2      ILE  59   2.615  11.509  -7.602
  431   3HG2  ILE  59          3HG2      ILE  59   1.734  10.866  -8.989
  432   1HD1  ILE  59          1HD1      ILE  59   3.240   7.460  -8.033
  433   2HD1  ILE  59          2HD1      ILE  59   2.980   8.675  -9.285
  434   3HD1  ILE  59          3HD1      ILE  59   2.240   7.081  -9.436
  435    H    ASP  60           H        ASP  60   1.334   9.980  -3.877
  436    HA   ASP  60           HA       ASP  60   2.676  12.648  -3.738
  437   1HB   ASP  60          2HB       ASP  60   0.337  11.649  -2.106
  438   2HB   ASP  60          1HB       ASP  60   0.761  13.316  -2.491
  439    H    HIS  61           H        HIS  61   2.800   9.545  -2.358
  440    HA   HIS  61           HA       HIS  61   3.879   8.706  -0.419
  441   1HB   HIS  61          2HB       HIS  61   5.343  11.350  -0.445
  442   2HB   HIS  61          1HB       HIS  61   5.974   9.757  -0.036
  443    HD1  HIS  61           HD1      HIS  61   7.444  11.363  -2.172
  444    HD2  HIS  61           HD2      HIS  61   4.347   8.725  -3.061
  445    HE1  HIS  61           HE1      HIS  61   7.735  10.713  -4.603
  446    H    ASP  62           H        ASP  62   1.409   9.868   0.227
  447    HA   ASP  62           HA       ASP  62   2.052  11.303   2.783
  448   1HB   ASP  62          2HB       ASP  62  -0.116  12.516   2.351
  449   2HB   ASP  62          1HB       ASP  62   1.128  12.840   1.143
  450    H    GLY  63           H        GLY  63   1.215   8.400   1.769
  451   1HA   GLY  63          2HA       GLY  63   0.169   6.638   2.960
  452   2HA   GLY  63          1HA       GLY  63  -0.403   7.821   4.135
  453    H    MET  64           H        MET  64  -0.935   8.128   0.660
  454    HA   MET  64           HA       MET  64  -3.756   7.245   0.937
  455   1HB   MET  64          2HB       MET  64  -2.810  10.053   0.325
  456   2HB   MET  64          1HB       MET  64  -4.442   9.498  -0.030
  457   1HG   MET  64          2HG       MET  64  -4.895   9.078   2.281
  458   2HG   MET  64          1HG       MET  64  -3.203   9.330   2.719
  459   1HE   MET  64          1HE       MET  64  -6.591  11.277   1.512
  460   2HE   MET  64          2HE       MET  64  -6.471  12.117   3.055
  461   3HE   MET  64          3HE       MET  64  -6.352  10.360   3.006
  462    H    LEU  65           H        LEU  65  -4.837   7.136  -1.202
  463    HA   LEU  65           HA       LEU  65  -2.909   7.088  -3.503
  464   1HB   LEU  65          2HB       LEU  65  -4.836   5.094  -2.399
  465   2HB   LEU  65          1HB       LEU  65  -4.700   5.177  -4.152
  466    HG   LEU  65           HG       LEU  65  -2.504   4.588  -2.155
  467   1HD1  LEU  65          1HD1      LEU  65  -2.536   2.451  -3.026
  468   2HD1  LEU  65          2HD1      LEU  65  -3.057   2.997  -4.618
  469   3HD1  LEU  65          3HD1      LEU  65  -4.225   2.877  -3.303
  470   1HD2  LEU  65          1HD2      LEU  65  -1.180   4.359  -4.429
  471   2HD2  LEU  65          2HD2      LEU  65  -1.327   5.939  -3.657
  472   3HD2  LEU  65          3HD2      LEU  65  -2.377   5.517  -5.010
  473    H    ASP  66           H        ASP  66  -3.595   8.877  -4.707
  474    HA   ASP  66           HA       ASP  66  -6.339   9.793  -4.796
  475   1HB   ASP  66          2HB       ASP  66  -4.141  11.044  -5.254
  476   2HB   ASP  66          1HB       ASP  66  -4.168  10.273  -6.835
  477    H    ARG  67           H        ARG  67  -7.576   9.846  -6.895
  478    HA   ARG  67           HA       ARG  67  -8.297   7.351  -7.892
  479   1HB   ARG  67          2HB       ARG  67  -9.376   8.588  -9.629
  480   2HB   ARG  67          1HB       ARG  67  -9.298   9.683  -8.250
  481   1HG   ARG  67          2HG       ARG  67  -7.228  10.687  -9.190
  482   2HG   ARG  67          1HG       ARG  67  -7.374   9.629 -10.593
  483   1HD   ARG  67          2HD       ARG  67  -8.529  11.419 -11.467
  484   2HD   ARG  67          1HD       ARG  67  -9.876  10.732 -10.537
  485    HE   ARG  67           HE       ARG  67  -9.488  12.373  -8.817
  486   1HH1  ARG  67          1HH2      ARG  67  -6.561  12.147 -10.416
  487   2HH1  ARG  67          2HH2      ARG  67  -6.230  13.846 -10.435
  488   1HH2  ARG  67          2HH1      ARG  67  -9.371  14.738  -9.269
  489   2HH2  ARG  67          1HH1      ARG  67  -7.822  15.315  -9.784
  490    H    ASP  68           H        ASP  68  -5.766   9.500  -9.161
  491    HA   ASP  68           HA       ASP  68  -5.021   7.709 -11.334
  492   1HB   ASP  68          2HB       ASP  68  -4.001  10.227 -10.047
  493   2HB   ASP  68          1HB       ASP  68  -2.978   9.379 -11.206
  494    H    GLU  69           H        GLU  69  -3.826   8.349  -8.052
  495    HA   GLU  69           HA       GLU  69  -1.464   6.670  -8.279
  496   1HB   GLU  69          2HB       GLU  69  -3.067   7.487  -5.833
  497   2HB   GLU  69          1HB       GLU  69  -1.367   7.020  -5.871
  498   1HG   GLU  69          2HG       GLU  69  -0.888   8.966  -7.333
  499   2HG   GLU  69          1HG       GLU  69  -2.577   9.450  -7.208
  500    H    PHE  70           H        PHE  70  -4.710   6.247  -6.889
  501    HA   PHE  70           HA       PHE  70  -4.466   3.601  -5.943
  502   1HB   PHE  70          2HB       PHE  70  -6.351   5.325  -5.715
  503   2HB   PHE  70          1HB       PHE  70  -6.875   4.820  -7.321
  504    HD1  PHE  70           HD1      PHE  70  -6.754   3.969  -3.790
  505    HD2  PHE  70           HD2      PHE  70  -7.551   2.442  -7.725
  506    HE1  PHE  70           HE1      PHE  70  -7.932   2.027  -2.799
  507    HE2  PHE  70           HE2      PHE  70  -8.729   0.499  -6.731
  508    HZ   PHE  70           HZ       PHE  70  -8.916   0.293  -4.267
  509    H    ALA  71           H        ALA  71  -4.913   4.878  -9.201
  510    HA   ALA  71           HA       ALA  71  -5.684   2.453 -10.517
  511   1HB   ALA  71          1HB       ALA  71  -4.062   4.809 -11.520
  512   2HB   ALA  71          2HB       ALA  71  -5.822   4.770 -11.421
  513   3HB   ALA  71          3HB       ALA  71  -4.975   3.682 -12.522
  514    H    VAL  72           H        VAL  72  -2.477   3.944 -10.100
  515    HA   VAL  72           HA       VAL  72  -0.939   1.960 -11.420
  516    HB   VAL  72           HB       VAL  72  -0.284   3.651  -8.984
  517   1HG1  VAL  72          1HG1      VAL  72   1.439   2.297 -11.079
  518   2HG1  VAL  72          2HG1      VAL  72   1.449   2.015  -9.338
  519   3HG1  VAL  72          3HG1      VAL  72   2.041   3.544  -9.987
  520   1HG2  VAL  72          1HG2      VAL  72   0.061   5.458 -10.387
  521   2HG2  VAL  72          2HG2      VAL  72  -1.227   4.653 -11.284
  522   3HG2  VAL  72          3HG2      VAL  72   0.454   4.438 -11.771
  523    H    ALA  73           H        ALA  73  -2.530   1.917  -8.317
  524    HA   ALA  73           HA       ALA  73  -0.944  -0.363  -7.304
  525   1HB   ALA  73          1HB       ALA  73  -3.439   0.585  -5.995
  526   2HB   ALA  73          2HB       ALA  73  -2.135   1.768  -6.166
  527   3HB   ALA  73          3HB       ALA  73  -1.851   0.261  -5.293
  528    H    MET  74           H        MET  74  -3.707  -0.022  -9.307
  529    HA   MET  74           HA       MET  74  -4.994  -2.484  -8.296
  530   1HB   MET  74          2HB       MET  74  -5.653  -0.899 -10.782
  531   2HB   MET  74          1HB       MET  74  -6.733  -1.930  -9.851
  532   1HG   MET  74          2HG       MET  74  -5.806   0.850  -9.297
  533   2HG   MET  74          1HG       MET  74  -7.396   0.142  -9.076
  534   1HE   MET  74          1HE       MET  74  -6.115  -2.572  -6.558
  535   2HE   MET  74          2HE       MET  74  -7.139  -2.216  -7.948
  536   3HE   MET  74          3HE       MET  74  -7.661  -1.743  -6.333
  537    H    PHE  75           H        PHE  75  -3.203  -1.440 -11.199
  538    HA   PHE  75           HA       PHE  75  -3.377  -4.117 -12.379
  539   1HB   PHE  75          2HB       PHE  75  -2.380  -3.086 -14.218
  540   2HB   PHE  75          1HB       PHE  75  -3.098  -1.685 -13.429
  541    HD1  PHE  75           HD1      PHE  75   0.021  -3.509 -14.114
  542    HD2  PHE  75           HD2      PHE  75  -1.725  -0.074 -12.223
  543    HE1  PHE  75           HE1      PHE  75   2.273  -2.506 -13.860
  544    HE2  PHE  75           HE2      PHE  75   0.518   0.930 -11.970
  545    HZ   PHE  75           HZ       PHE  75   2.524  -0.287 -12.790
  546    H    LEU  76           H        LEU  76  -1.206  -2.290 -10.330
  547    HA   LEU  76           HA       LEU  76   1.117  -3.990 -10.520
  548   1HB   LEU  76          2HB       LEU  76   0.017  -1.827  -8.812
  549   2HB   LEU  76          1HB       LEU  76   1.205  -2.874  -8.036
  550    HG   LEU  76           HG       LEU  76   1.610  -1.443 -10.678
  551   1HD1  LEU  76          1HD1      LEU  76   2.472   0.298  -9.525
  552   2HD1  LEU  76          2HD1      LEU  76   3.388  -0.769  -8.463
  553   3HD1  LEU  76          3HD1      LEU  76   1.705  -0.393  -8.096
  554   1HD2  LEU  76          1HD2      LEU  76   4.065  -2.223  -9.648
  555   2HD2  LEU  76          2HD2      LEU  76   3.192  -3.048 -10.940
  556   3HD2  LEU  76          3HD2      LEU  76   3.024  -3.594  -9.271
  557    H    VAL  77           H        VAL  77  -1.908  -4.118  -8.799
  558    HA   VAL  77           HA       VAL  77  -1.048  -6.337  -7.041
  559    HB   VAL  77           HB       VAL  77  -3.526  -4.654  -7.466
  560   1HG1  VAL  77          1HG1      VAL  77  -3.811  -6.203  -5.106
  561   2HG1  VAL  77          2HG1      VAL  77  -3.402  -7.331  -6.397
  562   3HG1  VAL  77          3HG1      VAL  77  -4.803  -6.273  -6.561
  563   1HG2  VAL  77          1HG2      VAL  77  -1.246  -4.205  -6.027
  564   2HG2  VAL  77          2HG2      VAL  77  -2.265  -4.965  -4.808
  565   3HG2  VAL  77          3HG2      VAL  77  -2.813  -3.505  -5.628
  566    H    TYR  78           H        TYR  78  -2.619  -5.838 -10.091
  567    HA   TYR  78           HA       TYR  78  -3.914  -8.494 -10.086
  568   1HB   TYR  78          2HB       TYR  78  -3.990  -5.972 -11.571
  569   2HB   TYR  78          1HB       TYR  78  -4.026  -7.376 -12.638
  570    HD1  TYR  78           HD1      TYR  78  -6.074  -5.182 -10.901
  571    HD2  TYR  78           HD2      TYR  78  -5.549  -9.392 -11.579
  572    HE1  TYR  78           HE1      TYR  78  -8.451  -5.571 -10.311
  573    HE2  TYR  78           HE2      TYR  78  -7.930  -9.781 -10.994
  574    HH   TYR  78           HH       TYR  78 -10.178  -7.177 -10.616
  575    H    CYS  79           H        CYS  79  -0.973  -6.964 -11.175
  576    HA   CYS  79           HA       CYS  79  -0.281  -9.121 -13.062
  577   1HB   CYS  79          2HB       CYS  79   0.831  -6.522 -12.097
  578   2HB   CYS  79          1HB       CYS  79   1.986  -7.696 -12.731
  579    HG   CYS  79           HG       CYS  79  -0.048  -6.142 -14.391
  580    H    ALA  80           H        ALA  80   0.007  -8.500  -9.675
  581    HA   ALA  80           HA       ALA  80   2.357 -10.234  -9.289
  582   1HB   ALA  80          1HB       ALA  80   1.317  -9.884  -6.830
  583   2HB   ALA  80          2HB       ALA  80   0.481  -8.572  -7.658
  584   3HB   ALA  80          3HB       ALA  80   2.244  -8.618  -7.632
  585    H    LEU  81           H        LEU  81  -0.972 -10.595  -9.799
  586    HA   LEU  81           HA       LEU  81  -1.266 -13.103  -8.270
  587   1HB   LEU  81          2HB       LEU  81  -3.202 -11.899 -10.242
  588   2HB   LEU  81          1HB       LEU  81  -3.563 -12.848  -8.801
  589    HG   LEU  81           HG       LEU  81  -2.451 -10.038  -8.874
  590   1HD1  LEU  81          1HD1      LEU  81  -4.919 -10.419  -9.382
  591   2HD1  LEU  81          2HD1      LEU  81  -4.577  -9.356  -8.017
  592   3HD1  LEU  81          3HD1      LEU  81  -5.070 -11.025  -7.732
  593   1HD2  LEU  81          1HD2      LEU  81  -2.726 -12.075  -6.707
  594   2HD2  LEU  81          2HD2      LEU  81  -3.093 -10.397  -6.304
  595   3HD2  LEU  81          3HD2      LEU  81  -1.498 -10.827  -6.921
  596    H    GLU  82           H        GLU  82  -1.217 -12.009 -11.669
  597    HA   GLU  82           HA       GLU  82  -0.754 -14.866 -12.452
  598   1HB   GLU  82          2HB       GLU  82  -2.897 -14.634 -13.211
  599   2HB   GLU  82          1HB       GLU  82  -2.806 -12.875 -13.208
  600   1HG   GLU  82          2HG       GLU  82  -1.506 -12.926 -15.300
  601   2HG   GLU  82          1HG       GLU  82  -1.577 -14.690 -15.306
  602    H    LYS  83           H        LYS  83   0.563 -11.739 -12.567
  603    HA   LYS  83           HA       LYS  83   1.922 -12.347 -15.171
  604   1HB   LYS  83          2HB       LYS  83   1.384  -9.794 -13.649
  605   2HB   LYS  83          1HB       LYS  83   2.414  -9.861 -15.076
  606   1HG   LYS  83          2HG       LYS  83  -0.263 -11.141 -15.301
  607   2HG   LYS  83          1HG       LYS  83  -0.228  -9.378 -15.237
  608   1HD   LYS  83          2HD       LYS  83   1.800 -10.571 -17.017
  609   2HD   LYS  83          1HD       LYS  83   0.134 -10.844 -17.525
  610   1HE   LYS  83          2HE       LYS  83  -0.311  -8.548 -17.759
  611   2HE   LYS  83          1HE       LYS  83   1.023  -8.086 -16.684
  612   1HZ   LYS  83          1HZ       LYS  83   1.960  -7.751 -18.747
  613   2HZ   LYS  83          2HZ       LYS  83   1.130  -9.049 -19.464
  614   3HZ   LYS  83          3HZ       LYS  83   2.443  -9.344 -18.428
  615    H    GLU  84           H        GLU  84   3.079 -10.086 -12.743
  616    HA   GLU  84           HA       GLU  84   5.326 -11.915 -12.035
  617   1HB   GLU  84          2HB       GLU  84   6.944 -10.445 -12.953
  618   2HB   GLU  84          1HB       GLU  84   5.659 -10.429 -14.154
  619   1HG   GLU  84          2HG       GLU  84   4.789  -8.422 -12.584
  620   2HG   GLU  84          1HG       GLU  84   6.521  -8.287 -12.280
  621    HA   PRO  85           HA       PRO  85   5.146  -9.912  -8.136
  622   1HB   PRO  85          2HB       PRO  85   7.769  -9.413  -7.501
  623   2HB   PRO  85          1HB       PRO  85   7.052 -11.038  -7.464
  624   1HG   PRO  85          2HG       PRO  85   8.743  -9.766  -9.563
  625   2HG   PRO  85          1HG       PRO  85   8.769 -11.426  -8.944
  626   1HD   PRO  85          2HD       PRO  85   7.606 -10.759 -11.295
  627   2HD   PRO  85          1HD       PRO  85   7.024 -12.097 -10.281
  628    H    VAL  86           H        VAL  86   6.769  -7.828  -7.072
  629    HA   VAL  86           HA       VAL  86   6.402  -5.632  -9.081
  630    HB   VAL  86           HB       VAL  86   5.559  -5.728  -6.166
  631   1HG1  VAL  86          1HG1      VAL  86   6.418  -3.497  -7.126
  632   2HG1  VAL  86          2HG1      VAL  86   4.807  -3.489  -6.410
  633   3HG1  VAL  86          3HG1      VAL  86   4.992  -3.533  -8.164
  634   1HG2  VAL  86          1HG2      VAL  86   3.387  -6.031  -6.902
  635   2HG2  VAL  86          2HG2      VAL  86   4.242  -6.892  -8.180
  636   3HG2  VAL  86          3HG2      VAL  86   3.688  -5.240  -8.448
  637    HA   PRO  87           HA       PRO  87  10.414  -4.618  -7.447
  638   1HB   PRO  87          2HB       PRO  87  10.936  -2.589  -9.202
  639   2HB   PRO  87          1HB       PRO  87  11.048  -4.299  -9.656
  640   1HG   PRO  87          2HG       PRO  87   9.008  -2.304 -10.359
  641   2HG   PRO  87          1HG       PRO  87   9.483  -3.782 -11.203
  642   1HD   PRO  87          2HD       PRO  87   7.204  -3.401  -9.561
  643   2HD   PRO  87          1HD       PRO  87   7.777  -4.926 -10.272
  644    H    MET  88           H        MET  88  11.443  -2.341  -6.784
  645    HA   MET  88           HA       MET  88   9.289  -0.822  -5.366
  646   1HB   MET  88          2HB       MET  88  12.286  -0.711  -5.010
  647   2HB   MET  88          1HB       MET  88  11.053  -0.160  -3.881
  648   1HG   MET  88          2HG       MET  88  10.455  -2.342  -3.268
  649   2HG   MET  88          1HG       MET  88  11.126  -3.043  -4.740
  650   1HE   MET  88          1HE       MET  88  13.770  -4.804  -3.092
  651   2HE   MET  88          2HE       MET  88  12.329  -4.725  -4.100
  652   3HE   MET  88          3HE       MET  88  12.166  -4.769  -2.347
  653    H    SER  89           H        SER  89  10.562  -0.505  -8.291
  654    HA   SER  89           HA       SER  89  11.245   2.381  -7.919
  655   1HB   SER  89          2HB       SER  89  12.099   0.263  -9.872
  656   2HB   SER  89          1HB       SER  89  12.381   1.974 -10.176
  657    HG   SER  89           HG       SER  89  13.696   2.075  -8.435
  658    H    LEU  90           H        LEU  90   9.322   3.365  -8.228
  659    HA   LEU  90           HA       LEU  90   7.269   2.727 -10.085
  660   1HB   LEU  90          2HB       LEU  90   7.958   4.760  -8.243
  661   2HB   LEU  90          1HB       LEU  90   7.664   5.580  -9.779
  662    HG   LEU  90           HG       LEU  90   5.787   3.562  -8.528
  663   1HD1  LEU  90          1HD1      LEU  90   6.051   6.521  -8.282
  664   2HD1  LEU  90          2HD1      LEU  90   5.420   5.349  -7.124
  665   3HD1  LEU  90          3HD1      LEU  90   4.417   5.881  -8.475
  666   1HD2  LEU  90          1HD2      LEU  90   5.116   5.536 -10.697
  667   2HD2  LEU  90          2HD2      LEU  90   4.344   3.996 -10.324
  668   3HD2  LEU  90          3HD2      LEU  90   5.922   4.023 -11.112
  669    HA   PRO  91           HA       PRO  91   9.852   3.514 -13.696
  670   1HB   PRO  91          2HB       PRO  91   8.036   2.483 -15.481
  671   2HB   PRO  91          1HB       PRO  91   9.165   1.483 -14.546
  672   1HG   PRO  91          2HG       PRO  91   6.286   2.062 -14.030
  673   2HG   PRO  91          1HG       PRO  91   7.176   0.539 -13.870
  674   1HD   PRO  91          2HD       PRO  91   6.553   2.084 -11.741
  675   2HD   PRO  91          1HD       PRO  91   8.037   1.103 -11.807
  676    HA   PRO  92           HA       PRO  92   8.099   7.278 -15.075
  677   1HB   PRO  92          2HB       PRO  92   8.967   7.383 -17.671
  678   2HB   PRO  92          1HB       PRO  92  10.043   7.625 -16.280
  679   1HG   PRO  92          2HG       PRO  92   9.635   5.194 -17.954
  680   2HG   PRO  92          1HG       PRO  92  11.132   5.867 -17.289
  681   1HD   PRO  92          2HD       PRO  92   9.846   3.745 -16.186
  682   2HD   PRO  92          1HD       PRO  92  10.812   4.895 -15.233
  683    H    ALA  93           H        ALA  93   7.328   4.337 -16.782
  684    HA   ALA  93           HA       ALA  93   5.224   5.559 -18.433
  685   1HB   ALA  93          1HB       ALA  93   6.772   3.190 -18.358
  686   2HB   ALA  93          2HB       ALA  93   5.548   3.619 -19.554
  687   3HB   ALA  93          3HB       ALA  93   5.097   2.682 -18.127
  688    H    LEU  94           H        LEU  94   5.495   4.831 -15.195
  689    HA   LEU  94           HA       LEU  94   2.621   4.044 -14.951
  690   1HB   LEU  94          2HB       LEU  94   5.137   3.575 -13.368
  691   2HB   LEU  94          1HB       LEU  94   3.571   3.448 -12.570
  692    HG   LEU  94           HG       LEU  94   4.430   1.272 -13.487
  693   1HD1  LEU  94          1HD1      LEU  94   2.067   1.517 -13.091
  694   2HD1  LEU  94          2HD1      LEU  94   2.256   0.721 -14.653
  695   3HD1  LEU  94          3HD1      LEU  94   1.852   2.433 -14.576
  696   1HD2  LEU  94          1HD2      LEU  94   3.735   2.392 -16.197
  697   2HD2  LEU  94          2HD2      LEU  94   4.633   0.928 -15.816
  698   3HD2  LEU  94          3HD2      LEU  94   5.374   2.509 -15.570
  699    H    VAL  95           H        VAL  95   4.137   6.852 -15.058
  700    HA   VAL  95           HA       VAL  95   2.953   7.909 -12.519
  701    HB   VAL  95           HB       VAL  95   4.613   9.807 -13.068
  702   1HG1  VAL  95          1HG1      VAL  95   5.959   7.157 -12.595
  703   2HG1  VAL  95          2HG1      VAL  95   4.850   7.827 -11.400
  704   3HG1  VAL  95          3HG1      VAL  95   6.305   8.717 -11.850
  705   1HG2  VAL  95          1HG2      VAL  95   6.356   9.360 -14.616
  706   2HG2  VAL  95          2HG2      VAL  95   4.878   8.903 -15.463
  707   3HG2  VAL  95          3HG2      VAL  95   5.906   7.660 -14.750
  708    HA   PRO  96           HA       PRO  96   0.061  10.074 -15.063
  709   1HB   PRO  96          2HB       PRO  96  -0.754  11.894 -13.177
  710   2HB   PRO  96          1HB       PRO  96  -1.291  10.202 -13.189
  711   1HG   PRO  96          2HG       PRO  96   0.841  11.501 -11.555
  712   2HG   PRO  96          1HG       PRO  96  -0.370  10.298 -11.079
  713   1HD   PRO  96          2HD       PRO  96   2.202   9.641 -11.596
  714   2HD   PRO  96          1HD       PRO  96   0.846   8.535 -11.927
  715    HA   PRO  97           HA       PRO  97   2.040  13.733 -16.459
  716   1HB   PRO  97          2HB       PRO  97   0.019  15.560 -16.743
  717   2HB   PRO  97          1HB       PRO  97   0.228  14.172 -17.830
  718   1HG   PRO  97          2HG       PRO  97  -1.642  14.514 -15.536
  719   2HG   PRO  97          1HG       PRO  97  -1.917  13.754 -17.112
  720   1HD   PRO  97          2HD       PRO  97  -1.453  12.334 -14.841
  721   2HD   PRO  97          1HD       PRO  97  -0.994  11.756 -16.459
  722    H    SER  98           H        SER  98   0.116  14.030 -13.549
  723    HA   SER  98           HA       SER  98   1.134  16.675 -12.844
  724   1HB   SER  98          2HB       SER  98  -0.119  16.284 -10.807
  725   2HB   SER  98          1HB       SER  98  -1.064  15.613 -12.134
  726    HG   SER  98           HG       SER  98  -0.198  13.571 -11.612
  727    H    LYS  99           H        LYS  99   2.473  13.587 -12.889
  728    HA   LYS  99           HA       LYS  99   4.225  14.002 -10.536
  729   1HB   LYS  99          2HB       LYS  99   3.071  11.821 -11.740
  730   2HB   LYS  99          1HB       LYS  99   4.699  11.773 -12.420
  731   1HG   LYS  99          2HG       LYS  99   4.115  12.023  -9.456
  732   2HG   LYS  99          1HG       LYS  99   4.469  10.496 -10.265
  733   1HD   LYS  99          2HD       LYS  99   6.582  11.781 -11.156
  734   2HD   LYS  99          1HD       LYS  99   6.279  12.842  -9.780
  735   1HE   LYS  99          2HE       LYS  99   6.048  10.102  -8.913
  736   2HE   LYS  99          1HE       LYS  99   7.604  10.335  -9.737
  737   1HZ   LYS  99          1HZ       LYS  99   6.498  12.173  -7.680
  738   2HZ   LYS  99          2HZ       LYS  99   8.025  12.275  -8.416
  739   3HZ   LYS  99          3HZ       LYS  99   7.670  10.987  -7.367
  740    H    ARG 100           H        ARG 100   4.145  14.897 -13.803
  741    HA   ARG 100           HA       ARG 100   6.686  14.503 -14.864
  742   1HB   ARG 100          2HB       ARG 100   4.506  16.421 -15.053
  743   2HB   ARG 100          1HB       ARG 100   6.063  17.199 -15.349
  744   1HG   ARG 100          2HG       ARG 100   5.679  16.418 -17.475
  745   2HG   ARG 100          1HG       ARG 100   6.431  14.971 -16.804
  746   1HD   ARG 100          2HD       ARG 100   3.453  15.352 -16.547
  747   2HD   ARG 100          1HD       ARG 100   4.143  14.712 -18.052
  748    HE   ARG 100           HE       ARG 100   4.273  13.396 -15.400
  749   1HH1  ARG 100          1HH2      ARG 100   3.327  12.005 -17.878
  750   2HH1  ARG 100          2HH2      ARG 100   4.712  11.062 -18.317
  751   1HH2  ARG 100          2HH1      ARG 100   6.899  12.854 -16.313
  752   2HH2  ARG 100          1HH1      ARG 100   6.732  11.542 -17.432
  753    H    SER 107           1H       SER 107   7.022   4.887   1.405
  754    HA   SER 107           HA       SER 107   8.370   4.352   4.005
  755   1HB   SER 107          2HB       SER 107   7.628   7.059   3.574
  756   2HB   SER 107          1HB       SER 107   9.256   6.394   3.631
  757    HG   SER 107           HG       SER 107   9.240   7.054   1.614
  758    H    THR 108           H        THR 108   6.970   4.339   5.736
  759    HA   THR 108           HA       THR 108   4.916   4.285   6.895
  760    HB   THR 108           HB       THR 108   3.761   6.357   6.765
  761    HG1  THR 108           HG1      THR 108   4.355   7.609   4.677
  762   1HG2  THR 108          1HG2      THR 108   6.351   6.403   7.145
  763   2HG2  THR 108          2HG2      THR 108   5.486   7.922   6.907
  764   3HG2  THR 108          3HG2      THR 108   6.385   7.199   5.571
  765    H    ASN 109           H        ASN 109   4.979   2.414   4.814
  766    HA   ASN 109           HA       ASN 109   2.678   2.681   3.040
  767   1HB   ASN 109          2HB       ASN 109   4.161   0.193   3.915
  768   2HB   ASN 109          1HB       ASN 109   3.306   0.445   2.398
  769   1HD2  ASN 109          1HD2      ASN 109   5.378  -0.130   1.300
  770   2HD2  ASN 109          2HD2      ASN 109   6.624   1.021   1.196
  771    HA   PRO 110           HA       PRO 110  -0.274   1.045   5.903
  772   1HB   PRO 110          2HB       PRO 110  -2.147   0.103   4.148
  773   2HB   PRO 110          1HB       PRO 110  -1.904   1.831   4.462
  774   1HG   PRO 110          2HG       PRO 110  -1.112   0.211   2.131
  775   2HG   PRO 110          1HG       PRO 110  -1.493   1.934   2.239
  776   1HD   PRO 110          2HD       PRO 110   1.072   0.797   2.090
  777   2HD   PRO 110          1HD       PRO 110   0.686   2.481   2.500
  778    H    PHE 111           H        PHE 111   1.808  -0.797   4.190
  779    HA   PHE 111           HA       PHE 111   0.577  -3.385   5.074
  780   1HB   PHE 111          2HB       PHE 111   2.394  -2.699   2.736
  781   2HB   PHE 111          1HB       PHE 111   1.915  -4.343   3.166
  782    HD1  PHE 111           HD1      PHE 111   0.888  -1.237   1.573
  783    HD2  PHE 111           HD2      PHE 111  -0.505  -4.980   3.149
  784    HE1  PHE 111           HE1      PHE 111  -1.247  -0.956   0.351
  785    HE2  PHE 111           HE2      PHE 111  -2.639  -4.697   1.925
  786    HZ   PHE 111           HZ       PHE 111  -3.012  -2.684   0.528
  787    H    LEU 112           HN       LEU 112   3.261  -1.229   5.349
  788    HA   LEU 112           HA       LEU 112   4.699  -3.273   6.998
  789   1HB   LEU 112          2HB       LEU 112   6.738  -2.758   5.909
  790   2HB   LEU 112          1HB       LEU 112   5.567  -2.810   4.593
  791    HG   LEU 112           HG       LEU 112   5.342  -0.208   5.297
  792   1HD1  LEU 112          1HD1      LEU 112   7.458   0.724   5.913
  793   2HD1  LEU 112          2HD1      LEU 112   8.282  -0.817   5.675
  794   3HD1  LEU 112          3HD1      LEU 112   7.171  -0.612   7.030
  795   1HD2  LEU 112          1HD2      LEU 112   5.746  -0.941   3.030
  796   2HD2  LEU 112          2HD2      LEU 112   7.366  -1.502   3.444
  797   3HD2  LEU 112          3HD2      LEU 112   7.006   0.225   3.435
  Start of MODEL    7
    1    HA   PRO   6           HA       PRO   6   1.996   6.570 -23.410
    2   1HB   PRO   6          2HB       PRO   6   1.101   3.986 -23.324
    3   2HB   PRO   6          1HB       PRO   6   1.394   4.857 -24.843
    4   1HG   PRO   6          2HG       PRO   6   3.082   2.832 -23.465
    5   2HG   PRO   6          1HG       PRO   6   2.797   3.076 -25.194
    6   1HD   PRO   6          2HD       PRO   6   5.058   3.898 -23.891
    7   2HD   PRO   6          1HD       PRO   6   4.436   4.656 -25.373
    8    H    TRP   7           H        TRP   7   0.403   5.553 -21.652
    9    HA   TRP   7           HA       TRP   7   1.914   5.501 -19.098
   10   1HB   TRP   7          2HB       TRP   7  -0.036   6.998 -19.504
   11   2HB   TRP   7          1HB       TRP   7  -1.056   5.577 -19.727
   12    HD1  TRP   7           HD1      TRP   7   1.583   5.186 -17.131
   13    HE1  TRP   7           HE1      TRP   7   0.534   5.267 -14.777
   14    HE3  TRP   7           HE3      TRP   7  -3.104   6.804 -18.327
   15    HZ2  TRP   7           HZ2      TRP   7  -1.973   5.935 -13.566
   16    HZ3  TRP   7           HZ3      TRP   7  -4.804   7.156 -16.559
   17    HH2  TRP   7           HH2      TRP   7  -4.245   6.725 -14.181
   18    H    ALA   8           H        ALA   8   2.327   3.587 -18.079
   19    HA   ALA   8           HA       ALA   8   1.843   1.017 -18.991
   20   1HB   ALA   8          1HB       ALA   8   3.258   1.728 -17.060
   21   2HB   ALA   8          2HB       ALA   8   2.225   0.356 -16.656
   22   3HB   ALA   8          3HB       ALA   8   1.793   1.975 -16.111
   23    H    VAL   9           H        VAL   9  -0.423   3.165 -17.389
   24    HA   VAL   9           HA       VAL   9  -2.450   0.970 -17.243
   25    HB   VAL   9           HB       VAL   9  -2.136   3.696 -15.964
   26   1HG1  VAL   9          1HG1      VAL   9  -4.470   3.565 -16.380
   27   2HG1  VAL   9          2HG1      VAL   9  -4.274   2.993 -14.724
   28   3HG1  VAL   9          3HG1      VAL   9  -4.516   1.837 -16.034
   29   1HG2  VAL   9          1HG2      VAL   9  -1.164   1.232 -15.239
   30   2HG2  VAL   9          2HG2      VAL   9  -2.693   1.283 -14.360
   31   3HG2  VAL   9          3HG2      VAL   9  -1.487   2.546 -14.109
   32    H    LYS  10           H        LYS  10  -4.325   1.106 -18.490
   33    HA   LYS  10           HA       LYS  10  -4.413   3.285 -20.525
   34   1HB   LYS  10          2HB       LYS  10  -4.912   0.456 -20.414
   35   2HB   LYS  10          1HB       LYS  10  -6.397   1.270 -20.908
   36   1HG   LYS  10          2HG       LYS  10  -5.536   1.486 -22.974
   37   2HG   LYS  10          1HG       LYS  10  -4.302   2.555 -22.305
   38   1HD   LYS  10          2HD       LYS  10  -2.935   0.923 -23.197
   39   2HD   LYS  10          1HD       LYS  10  -3.200   0.229 -21.597
   40   1HE   LYS  10          2HE       LYS  10  -5.154  -1.057 -22.556
   41   2HE   LYS  10          1HE       LYS  10  -4.659  -0.488 -24.162
   42   1HZ   LYS  10          1HZ       LYS  10  -3.441  -2.411 -23.976
   43   2HZ   LYS  10          2HZ       LYS  10  -3.225  -2.253 -22.298
   44   3HZ   LYS  10          3HZ       LYS  10  -2.335  -1.279 -23.369
   45    HA   PRO  11           HA       PRO  11  -8.134   5.049 -18.993
   46   1HB   PRO  11          2HB       PRO  11  -9.951   4.908 -21.037
   47   2HB   PRO  11          1HB       PRO  11  -8.564   6.016 -21.049
   48   1HG   PRO  11          2HG       PRO  11  -8.911   3.399 -22.421
   49   2HG   PRO  11          1HG       PRO  11  -8.127   4.879 -22.995
   50   1HD   PRO  11          2HD       PRO  11  -6.758   2.719 -22.064
   51   2HD   PRO  11          1HD       PRO  11  -6.143   4.383 -21.962
   52    H    GLU  12           H        GLU  12  -8.674   1.933 -20.593
   53    HA   GLU  12           HA       GLU  12 -11.189   1.386 -19.227
   54   1HB   GLU  12          2HB       GLU  12 -10.926  -0.789 -20.323
   55   2HB   GLU  12          1HB       GLU  12 -10.480   0.489 -21.454
   56   1HG   GLU  12          2HG       GLU  12  -8.064   0.128 -20.522
   57   2HG   GLU  12          1HG       GLU  12  -8.693  -1.426 -19.974
   58    H    ASP  13           H        ASP  13  -7.785   0.805 -18.572
   59    HA   ASP  13           HA       ASP  13  -8.327  -1.119 -16.413
   60   1HB   ASP  13          2HB       ASP  13  -5.939   0.219 -17.671
   61   2HB   ASP  13          1HB       ASP  13  -5.758  -0.648 -16.145
   62    H    LYS  14           H        LYS  14  -7.674   2.318 -16.795
   63    HA   LYS  14           HA       LYS  14  -7.271   2.771 -13.921
   64   1HB   LYS  14          2HB       LYS  14  -6.274   4.071 -15.895
   65   2HB   LYS  14          1HB       LYS  14  -7.877   4.775 -16.105
   66   1HG   LYS  14          2HG       LYS  14  -7.407   5.058 -13.383
   67   2HG   LYS  14          1HG       LYS  14  -5.833   5.394 -14.109
   68   1HD   LYS  14          2HD       LYS  14  -6.999   6.964 -15.704
   69   2HD   LYS  14          1HD       LYS  14  -8.469   6.741 -14.757
   70   1HE   LYS  14          2HE       LYS  14  -6.516   7.320 -12.837
   71   2HE   LYS  14          1HE       LYS  14  -6.162   8.428 -14.179
   72   1HZ   LYS  14          1HZ       LYS  14  -8.621   8.844 -14.274
   73   2HZ   LYS  14          2HZ       LYS  14  -7.843   9.459 -12.895
   74   3HZ   LYS  14          3HZ       LYS  14  -8.755   8.030 -12.792
   75    H    ALA  15           H        ALA  15  -9.883   2.569 -16.157
   76    HA   ALA  15           HA       ALA  15 -11.801   4.194 -14.678
   77   1HB   ALA  15          1HB       ALA  15 -13.221   2.449 -16.274
   78   2HB   ALA  15          2HB       ALA  15 -11.651   2.479 -17.077
   79   3HB   ALA  15          3HB       ALA  15 -12.544   3.979 -16.829
   80    H    LYS  16           H        LYS  16 -10.937   0.751 -14.870
   81    HA   LYS  16           HA       LYS  16 -13.053  -0.105 -13.065
   82   1HB   LYS  16          2HB       LYS  16 -12.147  -2.223 -13.460
   83   2HB   LYS  16          1HB       LYS  16 -11.611  -1.353 -14.898
   84   1HG   LYS  16          2HG       LYS  16  -9.485  -0.812 -13.645
   85   2HG   LYS  16          1HG       LYS  16 -10.018  -1.948 -12.406
   86   1HD   LYS  16          2HD       LYS  16 -10.212  -3.050 -15.113
   87   2HD   LYS  16          1HD       LYS  16  -8.561  -2.617 -14.667
   88   1HE   LYS  16          2HE       LYS  16  -9.115  -3.850 -12.418
   89   2HE   LYS  16          1HE       LYS  16 -10.399  -4.617 -13.374
   90   1HZ   LYS  16          1HZ       LYS  16  -8.470  -5.931 -13.679
   91   2HZ   LYS  16          2HZ       LYS  16  -7.489  -4.571 -13.953
   92   3HZ   LYS  16          3HZ       LYS  16  -8.653  -5.032 -15.103
   93    H    TYR  17           H        TYR  17  -9.872   1.228 -12.809
   94    HA   TYR  17           HA       TYR  17  -9.357   0.426 -10.047
   95   1HB   TYR  17          2HB       TYR  17  -8.225   2.611 -11.837
   96   2HB   TYR  17          1HB       TYR  17  -7.525   2.097 -10.306
   97    HD1  TYR  17           HD1      TYR  17  -5.672   1.944 -12.376
   98    HD2  TYR  17           HD2      TYR  17  -8.850  -0.820 -11.538
   99    HE1  TYR  17           HE1      TYR  17  -4.400   0.152 -13.524
  100    HE2  TYR  17           HE2      TYR  17  -7.592  -2.613 -12.703
  101    HH   TYR  17           HH       TYR  17  -5.788  -2.727 -14.504
  102    H    ASP  18           H        ASP  18 -10.723   3.198 -11.761
  103    HA   ASP  18           HA       ASP  18 -10.943   4.932  -9.442
  104   1HB   ASP  18          2HB       ASP  18 -10.933   5.421 -11.996
  105   2HB   ASP  18          1HB       ASP  18 -12.649   5.017 -11.931
  106    H    ALA  19           H        ALA  19 -12.661   2.143 -10.383
  107    HA   ALA  19           HA       ALA  19 -15.206   2.993  -9.102
  108   1HB   ALA  19          1HB       ALA  19 -14.391   1.164 -11.110
  109   2HB   ALA  19          2HB       ALA  19 -16.025   1.388 -10.485
  110   3HB   ALA  19          3HB       ALA  19 -14.962   0.182  -9.761
  111    H    ILE  20           H        ILE  20 -12.417   0.923  -8.672
  112    HA   ILE  20           HA       ILE  20 -13.285  -0.260  -6.155
  113    HB   ILE  20           HB       ILE  20 -10.749  -0.042  -7.796
  114   1HG1  ILE  20          2HG1      ILE  20 -12.139  -2.571  -6.952
  115   2HG1  ILE  20          1HG1      ILE  20 -12.799  -1.616  -8.281
  116   1HG2  ILE  20          1HG2      ILE  20  -9.626  -1.466  -6.200
  117   2HG2  ILE  20          2HG2      ILE  20 -11.078  -1.557  -5.202
  118   3HG2  ILE  20          3HG2      ILE  20 -10.215  -0.030  -5.365
  119   1HD1  ILE  20          1HD1      ILE  20 -11.223  -3.361  -9.090
  120   2HD1  ILE  20          2HD1      ILE  20  -9.943  -2.630  -8.122
  121   3HD1  ILE  20          3HD1      ILE  20 -10.651  -1.734  -9.468
  122    H    PHE  21           H        PHE  21 -11.383   2.474  -7.285
  123    HA   PHE  21           HA       PHE  21 -10.343   3.256  -4.708
  124   1HB   PHE  21          2HB       PHE  21  -9.098   4.180  -6.408
  125   2HB   PHE  21          1HB       PHE  21 -10.475   4.243  -7.504
  126    HD1  PHE  21           HD1      PHE  21  -8.460   6.076  -5.105
  127    HD2  PHE  21           HD2      PHE  21 -12.189   6.074  -7.236
  128    HE1  PHE  21           HE1      PHE  21  -8.744   8.490  -4.614
  129    HE2  PHE  21           HE2      PHE  21 -12.471   8.486  -6.747
  130    HZ   PHE  21           HZ       PHE  21 -10.750   9.694  -5.435
  131    H    ASP  22           H        ASP  22 -13.142   4.164  -6.676
  132    HA   ASP  22           HA       ASP  22 -14.125   6.075  -4.667
  133   1HB   ASP  22          2HB       ASP  22 -14.301   6.354  -7.162
  134   2HB   ASP  22          1HB       ASP  22 -15.411   4.983  -7.191
  135    H    SER  23           H        SER  23 -14.025   2.802  -4.740
  136    HA   SER  23           HA       SER  23 -16.816   2.288  -3.870
  137   1HB   SER  23          2HB       SER  23 -14.509   0.815  -4.910
  138   2HB   SER  23          1HB       SER  23 -15.252  -0.003  -3.538
  139    HG   SER  23           HG       SER  23 -17.227   0.088  -4.620
  140    H    LEU  24           H        LEU  24 -13.861   3.256  -2.557
  141    HA   LEU  24           HA       LEU  24 -14.412   2.085   0.137
  142   1HB   LEU  24          2HB       LEU  24 -12.036   3.787  -0.463
  143   2HB   LEU  24          1HB       LEU  24 -12.132   2.316   0.496
  144    HG   LEU  24           HG       LEU  24 -12.278   2.435  -2.526
  145   1HD1  LEU  24          1HD1      LEU  24 -10.058   2.903  -1.071
  146   2HD1  LEU  24          2HD1      LEU  24 -10.018   2.023  -2.600
  147   3HD1  LEU  24          3HD1      LEU  24 -10.027   1.142  -1.072
  148   1HD2  LEU  24          1HD2      LEU  24 -13.372   0.454  -1.955
  149   2HD2  LEU  24          2HD2      LEU  24 -12.435   0.251  -0.474
  150   3HD2  LEU  24          3HD2      LEU  24 -11.697  -0.092  -2.038
  151    H    SER  25           H        SER  25 -14.865   4.874  -1.712
  152    HA   SER  25           HA       SER  25 -15.981   6.890  -1.057
  153   1HB   SER  25          2HB       SER  25 -16.667   7.124   1.133
  154   2HB   SER  25          1HB       SER  25 -16.264   5.412   1.179
  155    HG   SER  25           HG       SER  25 -14.661   7.616   1.971
  156    HA   PRO  26           HA       PRO  26 -11.737   8.469  -1.360
  157   1HB   PRO  26          2HB       PRO  26 -12.296  10.166  -3.424
  158   2HB   PRO  26          1HB       PRO  26 -11.936   8.443  -3.662
  159   1HG   PRO  26          2HG       PRO  26 -14.552   9.848  -3.658
  160   2HG   PRO  26          1HG       PRO  26 -13.996   8.500  -4.660
  161   1HD   PRO  26          2HD       PRO  26 -15.655   8.222  -2.497
  162   2HD   PRO  26          1HD       PRO  26 -14.593   6.937  -3.108
  163    H    VAL  27           H        VAL  27 -10.926  10.485  -0.679
  164    HA   VAL  27           HA       VAL  27 -12.974  12.453   0.285
  165    HB   VAL  27           HB       VAL  27 -10.244  11.764   1.428
  166   1HG1  VAL  27          1HG1      VAL  27 -12.564  13.377   2.538
  167   2HG1  VAL  27          2HG1      VAL  27 -11.055  14.052   1.922
  168   3HG1  VAL  27          3HG1      VAL  27 -11.045  13.050   3.373
  169   1HG2  VAL  27          1HG2      VAL  27 -13.036  10.919   2.272
  170   2HG2  VAL  27          2HG2      VAL  27 -11.572  10.627   3.212
  171   3HG2  VAL  27          3HG2      VAL  27 -11.776   9.861   1.635
  172    H    ASN  28           H        ASN  28 -12.857  14.188  -1.099
  173    HA   ASN  28           HA       ASN  28 -11.918  15.917  -2.403
  174   1HB   ASN  28          2HB       ASN  28 -10.875  16.582  -0.349
  175   2HB   ASN  28          1HB       ASN  28  -9.726  15.248  -0.422
  176   1HD2  ASN  28          1HD2      ASN  28  -7.688  15.918  -1.090
  177   2HD2  ASN  28          2HD2      ASN  28  -7.381  17.196  -2.164
  178    H    GLY  29           H        GLY  29 -11.385  12.864  -2.906
  179   1HA   GLY  29          2HA       GLY  29 -10.617  11.958  -5.003
  180   2HA   GLY  29          1HA       GLY  29  -9.532  13.338  -5.172
  181    H    PHE  30           H        PHE  30  -9.856  11.335  -2.263
  182    HA   PHE  30           HA       PHE  30  -7.221  10.071  -2.842
  183   1HB   PHE  30          2HB       PHE  30  -7.907  11.917  -0.550
  184   2HB   PHE  30          1HB       PHE  30  -6.498  10.847  -0.522
  185    HD1  PHE  30           HD1      PHE  30  -7.924  13.908  -1.826
  186    HD2  PHE  30           HD2      PHE  30  -4.773  11.041  -2.333
  187    HE1  PHE  30           HE1      PHE  30  -6.687  15.528  -3.219
  188    HE2  PHE  30           HE2      PHE  30  -3.514  12.674  -3.722
  189    HZ   PHE  30           HZ       PHE  30  -4.473  14.920  -4.169
  190    H    LEU  31           H        LEU  31  -6.880   8.158  -1.771
  191    HA   LEU  31           HA       LEU  31  -9.109   7.147  -0.029
  192   1HB   LEU  31          2HB       LEU  31  -7.305   5.894  -2.096
  193   2HB   LEU  31          1HB       LEU  31  -8.017   4.895  -0.830
  194    HG   LEU  31           HG       LEU  31  -9.440   6.492  -2.957
  195   1HD1  LEU  31          1HD1      LEU  31  -9.169   4.407  -3.852
  196   2HD1  LEU  31          2HD1      LEU  31 -10.537   4.005  -2.810
  197   3HD1  LEU  31          3HD1      LEU  31  -8.889   3.668  -2.274
  198   1HD2  LEU  31          1HD2      LEU  31 -10.485   5.327  -0.362
  199   2HD2  LEU  31          2HD2      LEU  31 -11.531   5.608  -1.755
  200   3HD2  LEU  31          3HD2      LEU  31 -10.709   6.962  -0.983
  201    H    SER  32           H        SER  32  -8.450   6.368   1.989
  202    HA   SER  32           HA       SER  32  -5.691   6.976   2.784
  203   1HB   SER  32          2HB       SER  32  -6.947   5.723   4.898
  204   2HB   SER  32          1HB       SER  32  -7.009   7.454   4.577
  205    HG   SER  32           HG       SER  32  -9.042   5.948   4.709
  206    H    GLY  33           H        GLY  33  -4.112   5.460   3.313
  207   1HA   GLY  33          2HA       GLY  33  -3.935   3.013   2.007
  208   2HA   GLY  33          1HA       GLY  33  -3.128   3.314   3.550
  209    H    ASP  34           H        ASP  34  -5.787   3.819   4.836
  210    HA   ASP  34           HA       ASP  34  -6.303   1.152   5.798
  211   1HB   ASP  34          2HB       ASP  34  -7.957   3.690   6.010
  212   2HB   ASP  34          1HB       ASP  34  -8.025   2.304   7.099
  213    H    LYS  35           H        LYS  35  -7.615   3.045   3.141
  214    HA   LYS  35           HA       LYS  35  -9.942   1.217   2.854
  215   1HB   LYS  35          2HB       LYS  35  -8.974   3.762   1.512
  216   2HB   LYS  35          1HB       LYS  35 -10.388   2.871   0.944
  217   1HG   LYS  35          2HG       LYS  35 -11.365   3.065   3.246
  218   2HG   LYS  35          1HG       LYS  35 -10.002   4.096   3.689
  219   1HD   LYS  35          2HD       LYS  35 -10.619   5.732   2.006
  220   2HD   LYS  35          1HD       LYS  35 -11.891   4.675   1.392
  221   1HE   LYS  35          2HE       LYS  35 -11.795   5.903   4.174
  222   2HE   LYS  35          1HE       LYS  35 -12.899   6.363   2.860
  223   1HZ   LYS  35          1HZ       LYS  35 -12.886   3.962   4.512
  224   2HZ   LYS  35          2HZ       LYS  35 -13.242   3.737   2.865
  225   3HZ   LYS  35          3HZ       LYS  35 -14.192   4.784   3.807
  226    H    VAL  36           H        VAL  36  -6.895   2.172   1.379
  227    HA   VAL  36           HA       VAL  36  -7.157   0.432  -0.958
  228    HB   VAL  36           HB       VAL  36  -4.827   1.831   0.376
  229   1HG1  VAL  36          1HG1      VAL  36  -4.362  -0.125  -1.234
  230   2HG1  VAL  36          2HG1      VAL  36  -3.559   1.410  -1.564
  231   3HG1  VAL  36          3HG1      VAL  36  -4.981   0.943  -2.497
  232   1HG2  VAL  36          1HG2      VAL  36  -6.106   2.772  -2.154
  233   2HG2  VAL  36          2HG2      VAL  36  -5.343   3.706  -0.868
  234   3HG2  VAL  36          3HG2      VAL  36  -6.968   3.061  -0.642
  235    H    LYS  37           H        LYS  37  -5.527   0.324   2.185
  236    HA   LYS  37           HA       LYS  37  -3.897  -1.873   2.063
  237   1HB   LYS  37          2HB       LYS  37  -4.055  -0.782   4.124
  238   2HB   LYS  37          1HB       LYS  37  -5.815  -0.778   4.097
  239   1HG   LYS  37          2HG       LYS  37  -5.788  -3.251   4.446
  240   2HG   LYS  37          1HG       LYS  37  -4.031  -3.180   4.592
  241   1HD   LYS  37          2HD       LYS  37  -4.296  -1.573   6.487
  242   2HD   LYS  37          1HD       LYS  37  -6.044  -1.785   6.382
  243   1HE   LYS  37          2HE       LYS  37  -5.830  -3.578   7.754
  244   2HE   LYS  37          1HE       LYS  37  -4.942  -4.398   6.455
  245   1HZ   LYS  37          1HZ       LYS  37  -3.743  -3.971   8.684
  246   2HZ   LYS  37          2HZ       LYS  37  -3.603  -2.372   8.126
  247   3HZ   LYS  37          3HZ       LYS  37  -2.917  -3.649   7.239
  248    HA   PRO  38           HA       PRO  38  -7.565  -4.923   2.695
  249   1HB   PRO  38          2HB       PRO  38 -10.085  -3.939   2.241
  250   2HB   PRO  38          1HB       PRO  38  -9.320  -3.955   3.844
  251   1HG   PRO  38          2HG       PRO  38  -9.561  -1.722   1.882
  252   2HG   PRO  38          1HG       PRO  38  -9.754  -1.701   3.643
  253   1HD   PRO  38          2HD       PRO  38  -7.509  -0.836   2.432
  254   2HD   PRO  38          1HD       PRO  38  -7.483  -1.620   4.027
  255    H    VAL  39           H        VAL  39  -7.993  -2.365   0.291
  256    HA   VAL  39           HA       VAL  39  -9.157  -3.922  -1.801
  257    HB   VAL  39           HB       VAL  39  -7.598  -1.389  -1.464
  258   1HG1  VAL  39          1HG1      VAL  39  -6.851  -2.673  -3.638
  259   2HG1  VAL  39          2HG1      VAL  39  -7.272  -0.971  -3.731
  260   3HG1  VAL  39          3HG1      VAL  39  -8.438  -2.195  -4.234
  261   1HG2  VAL  39          1HG2      VAL  39  -9.906  -1.144  -3.100
  262   2HG2  VAL  39          2HG2      VAL  39  -9.710  -0.630  -1.426
  263   3HG2  VAL  39          3HG2      VAL  39 -10.320  -2.243  -1.785
  264    H    LEU  40           H        LEU  40  -5.834  -3.482  -0.700
  265    HA   LEU  40           HA       LEU  40  -4.706  -5.002  -2.961
  266   1HB   LEU  40          2HB       LEU  40  -3.465  -3.957  -0.396
  267   2HB   LEU  40          1HB       LEU  40  -2.605  -4.427  -1.863
  268    HG   LEU  40           HG       LEU  40  -4.681  -2.235  -1.762
  269   1HD1  LEU  40          1HD1      LEU  40  -2.498  -0.830  -2.141
  270   2HD1  LEU  40          2HD1      LEU  40  -1.697  -2.213  -1.394
  271   3HD1  LEU  40          3HD1      LEU  40  -2.930  -1.322  -0.502
  272   1HD2  LEU  40          1HD2      LEU  40  -2.624  -3.017  -3.847
  273   2HD2  LEU  40          2HD2      LEU  40  -3.755  -1.669  -3.974
  274   3HD2  LEU  40          3HD2      LEU  40  -4.359  -3.327  -3.950
  275    H    LEU  41           H        LEU  41  -5.689  -5.516   0.361
  276    HA   LEU  41           HA       LEU  41  -4.277  -8.029   0.734
  277   1HB   LEU  41          2HB       LEU  41  -6.548  -6.555   2.072
  278   2HB   LEU  41          1HB       LEU  41  -6.018  -8.139   2.635
  279    HG   LEU  41           HG       LEU  41  -4.081  -5.858   2.250
  280   1HD1  LEU  41          1HD1      LEU  41  -5.564  -6.636   4.782
  281   2HD1  LEU  41          2HD1      LEU  41  -5.851  -5.167   3.848
  282   3HD1  LEU  41          3HD1      LEU  41  -4.302  -5.410   4.658
  283   1HD2  LEU  41          1HD2      LEU  41  -3.712  -8.546   2.670
  284   2HD2  LEU  41          2HD2      LEU  41  -3.698  -7.927   4.322
  285   3HD2  LEU  41          3HD2      LEU  41  -2.552  -7.300   3.136
  286    H    ASN  42           H        ASN  42  -7.049  -7.031  -1.000
  287    HA   ASN  42           HA       ASN  42  -8.445  -9.608  -0.830
  288   1HB   ASN  42          2HB       ASN  42  -9.180  -7.014  -1.257
  289   2HB   ASN  42          1HB       ASN  42  -9.126  -7.612  -2.915
  290   1HD2  ASN  42          1HD2      ASN  42 -11.638  -6.970  -2.056
  291   2HD2  ASN  42          2HD2      ASN  42 -12.540  -8.359  -1.687
  292    H    SER  43           H        SER  43  -5.871  -8.283  -2.603
  293    HA   SER  43           HA       SER  43  -6.303  -9.659  -5.139
  294   1HB   SER  43          2HB       SER  43  -3.720  -8.596  -3.995
  295   2HB   SER  43          1HB       SER  43  -4.212  -8.665  -5.684
  296    HG   SER  43           HG       SER  43  -5.049  -6.943  -3.623
  297    H    LYS  44           H        LYS  44  -5.717 -10.882  -2.146
  298    HA   LYS  44           HA       LYS  44  -4.948 -13.011  -1.450
  299   1HB   LYS  44          2HB       LYS  44  -5.897 -13.440  -3.853
  300   2HB   LYS  44          1HB       LYS  44  -4.199 -13.525  -4.324
  301   1HG   LYS  44          2HG       LYS  44  -3.930 -15.554  -3.367
  302   2HG   LYS  44          1HG       LYS  44  -4.775 -15.059  -1.900
  303   1HD   LYS  44          2HD       LYS  44  -6.937 -15.254  -3.255
  304   2HD   LYS  44          1HD       LYS  44  -5.974 -16.087  -4.477
  305   1HE   LYS  44          2HE       LYS  44  -6.093 -16.945  -1.565
  306   2HE   LYS  44          1HE       LYS  44  -7.077 -17.668  -2.853
  307   1HZ   LYS  44          1HZ       LYS  44  -4.897 -18.801  -2.447
  308   2HZ   LYS  44          2HZ       LYS  44  -4.127 -17.396  -3.011
  309   3HZ   LYS  44          3HZ       LYS  44  -5.141 -18.285  -4.045
  310    H    LEU  45           H        LEU  45  -3.151 -10.534  -2.502
  311    HA   LEU  45           HA       LEU  45  -0.526 -11.897  -2.646
  312   1HB   LEU  45          2HB       LEU  45  -1.636  -9.131  -3.037
  313   2HB   LEU  45          1HB       LEU  45   0.098  -9.341  -2.802
  314    HG   LEU  45           HG       LEU  45  -1.560 -10.739  -4.918
  315   1HD1  LEU  45          1HD1      LEU  45   0.628  -8.819  -5.555
  316   2HD1  LEU  45          2HD1      LEU  45  -0.884  -8.136  -4.958
  317   3HD1  LEU  45          3HD1      LEU  45  -0.878  -9.129  -6.413
  318   1HD2  LEU  45          1HD2      LEU  45   1.354 -10.661  -5.201
  319   2HD2  LEU  45          2HD2      LEU  45   0.254 -12.035  -5.335
  320   3HD2  LEU  45          3HD2      LEU  45   0.846 -11.524  -3.750
  321    HA   PRO  46           HA       PRO  46   0.406 -11.170   1.573
  322   1HB   PRO  46          2HB       PRO  46   3.135 -11.025   1.426
  323   2HB   PRO  46          1HB       PRO  46   2.237 -12.545   1.264
  324   1HG   PRO  46          2HG       PRO  46   3.484 -10.860  -0.822
  325   2HG   PRO  46          1HG       PRO  46   3.315 -12.618  -0.736
  326   1HD   PRO  46          2HD       PRO  46   1.732 -10.965  -2.270
  327   2HD   PRO  46          1HD       PRO  46   1.276 -12.594  -1.736
  328    H    VAL  47           H        VAL  47   1.600  -9.493   2.961
  329    HA   VAL  47           HA       VAL  47   0.961  -6.823   2.141
  330    HB   VAL  47           HB       VAL  47   2.383  -8.221   4.403
  331   1HG1  VAL  47          1HG1      VAL  47   2.888  -6.232   5.529
  332   2HG1  VAL  47          2HG1      VAL  47   1.836  -5.267   4.498
  333   3HG1  VAL  47          3HG1      VAL  47   3.376  -5.864   3.879
  334   1HG2  VAL  47          1HG2      VAL  47  -0.288  -7.386   3.772
  335   2HG2  VAL  47          2HG2      VAL  47   0.253  -6.531   5.217
  336   3HG2  VAL  47          3HG2      VAL  47   0.278  -8.295   5.175
  337    H    ASP  48           H        ASP  48   3.565  -8.842   1.364
  338    HA   ASP  48           HA       ASP  48   5.664  -6.840   1.306
  339   1HB   ASP  48          2HB       ASP  48   5.219  -9.677   0.540
  340   2HB   ASP  48          1HB       ASP  48   6.534  -8.831  -0.275
  341    H    ILE  49           H        ILE  49   3.260  -8.136  -0.922
  342    HA   ILE  49           HA       ILE  49   4.378  -6.748  -3.247
  343    HB   ILE  49           HB       ILE  49   1.588  -7.864  -2.927
  344   1HG1  ILE  49          2HG1      ILE  49   3.028  -9.586  -2.040
  345   2HG1  ILE  49          1HG1      ILE  49   2.586 -10.054  -3.680
  346   1HG2  ILE  49          1HG2      ILE  49   2.671  -8.595  -5.376
  347   2HG2  ILE  49          2HG2      ILE  49   3.330  -6.982  -5.100
  348   3HG2  ILE  49          3HG2      ILE  49   1.585  -7.233  -5.094
  349   1HD1  ILE  49          1HD1      ILE  49   5.015 -10.357  -3.210
  350   2HD1  ILE  49          2HD1      ILE  49   5.147  -8.618  -2.943
  351   3HD1  ILE  49          3HD1      ILE  49   4.708  -9.237  -4.537
  352    H    LEU  50           H        LEU  50   1.704  -6.383  -0.981
  353    HA   LEU  50           HA       LEU  50   0.556  -4.015  -2.170
  354   1HB   LEU  50          2HB       LEU  50   0.487  -4.900   0.718
  355   2HB   LEU  50          1HB       LEU  50  -0.758  -4.026  -0.173
  356    HG   LEU  50           HG       LEU  50   0.055  -6.920  -0.463
  357   1HD1  LEU  50          1HD1      LEU  50  -1.618  -6.709   1.171
  358   2HD1  LEU  50          2HD1      LEU  50  -2.527  -7.080  -0.295
  359   3HD1  LEU  50          3HD1      LEU  50  -2.441  -5.419   0.294
  360   1HD2  LEU  50          1HD2      LEU  50  -0.315  -6.696  -2.687
  361   2HD2  LEU  50          2HD2      LEU  50  -0.969  -5.071  -2.490
  362   3HD2  LEU  50          3HD2      LEU  50  -2.011  -6.474  -2.258
  363    H    GLY  51           H        GLY  51   3.138  -4.655   0.131
  364   1HA   GLY  51          2HA       GLY  51   3.342  -1.925   1.105
  365   2HA   GLY  51          1HA       GLY  51   4.567  -3.183   1.303
  366    H    ARG  52           H        ARG  52   4.409  -3.673  -1.659
  367    HA   ARG  52           HA       ARG  52   6.302  -1.517  -2.447
  368   1HB   ARG  52          2HB       ARG  52   6.262  -4.305  -2.587
  369   2HB   ARG  52          1HB       ARG  52   5.945  -3.783  -4.240
  370   1HG   ARG  52          2HG       ARG  52   7.919  -2.143  -3.869
  371   2HG   ARG  52          1HG       ARG  52   8.334  -3.188  -2.510
  372   1HD   ARG  52          2HD       ARG  52   7.778  -4.407  -5.204
  373   2HD   ARG  52          1HD       ARG  52   9.375  -3.728  -4.852
  374    HE   ARG  52           HE       ARG  52   8.172  -5.635  -2.905
  375   1HH1  ARG  52          1HH2      ARG  52   9.279  -7.009  -5.340
  376   2HH1  ARG  52          2HH2      ARG  52  10.917  -7.315  -4.865
  377   1HH2  ARG  52          2HH1      ARG  52  10.854  -5.063  -2.230
  378   2HH2  ARG  52          1HH1      ARG  52  11.808  -6.213  -3.107
  379    H    VAL  53           H        VAL  53   3.206  -3.010  -3.318
  380    HA   VAL  53           HA       VAL  53   3.029  -1.666  -5.904
  381    HB   VAL  53           HB       VAL  53   1.136  -3.127  -4.050
  382   1HG1  VAL  53          1HG1      VAL  53  -0.702  -2.430  -5.173
  383   2HG1  VAL  53          2HG1      VAL  53   0.100  -2.617  -6.732
  384   3HG1  VAL  53          3HG1      VAL  53   0.296  -1.129  -5.817
  385   1HG2  VAL  53          1HG2      VAL  53   1.507  -4.911  -5.437
  386   2HG2  VAL  53          2HG2      VAL  53   2.987  -4.033  -5.826
  387   3HG2  VAL  53          3HG2      VAL  53   1.580  -3.903  -6.884
  388    H    TRP  54           H        TRP  54   1.935  -0.994  -2.596
  389    HA   TRP  54           HA       TRP  54   0.373   1.339  -3.239
  390   1HB   TRP  54          2HB       TRP  54   0.023   0.388  -1.106
  391   2HB   TRP  54          1HB       TRP  54   1.755   0.235  -0.793
  392    HD1  TRP  54           HD1      TRP  54   3.116   2.589  -0.480
  393    HE1  TRP  54           HE1      TRP  54   2.362   4.792   0.581
  394    HE3  TRP  54           HE3      TRP  54  -1.937   1.899  -0.575
  395    HZ2  TRP  54           HZ2      TRP  54  -0.092   6.100   1.338
  396    HZ3  TRP  54           HZ3      TRP  54  -3.467   3.640   0.334
  397    HH2  TRP  54           HH2      TRP  54  -2.547   5.725   1.282
  398    H    GLU  55           H        GLU  55   3.765   0.946  -2.085
  399    HA   GLU  55           HA       GLU  55   4.446   3.689  -2.011
  400   1HB   GLU  55          2HB       GLU  55   5.977   1.158  -2.571
  401   2HB   GLU  55          1HB       GLU  55   6.778   2.724  -2.459
  402   1HG   GLU  55          2HG       GLU  55   5.032   2.555  -0.242
  403   2HG   GLU  55          1HG       GLU  55   5.888   1.015  -0.329
  404    H    LEU  56           H        LEU  56   5.109   1.406  -4.685
  405    HA   LEU  56           HA       LEU  56   5.924   3.419  -6.549
  406   1HB   LEU  56          2HB       LEU  56   4.671   0.670  -6.905
  407   2HB   LEU  56          1HB       LEU  56   5.430   1.586  -8.207
  408    HG   LEU  56           HG       LEU  56   7.069   1.309  -5.761
  409   1HD1  LEU  56          1HD1      LEU  56   7.225  -1.096  -7.441
  410   2HD1  LEU  56          2HD1      LEU  56   5.717  -0.964  -6.536
  411   3HD1  LEU  56          3HD1      LEU  56   7.261  -0.948  -5.683
  412   1HD2  LEU  56          1HD2      LEU  56   8.334   2.188  -7.480
  413   2HD2  LEU  56          2HD2      LEU  56   7.384   1.381  -8.726
  414   3HD2  LEU  56          3HD2      LEU  56   8.607   0.482  -7.831
  415    H    SER  57           H        SER  57   2.869   2.602  -5.228
  416    HA   SER  57           HA       SER  57   1.294   3.767  -7.459
  417   1HB   SER  57          2HB       SER  57   0.735   2.328  -4.872
  418   2HB   SER  57          1HB       SER  57  -0.557   3.128  -5.765
  419    HG   SER  57           HG       SER  57   1.210   1.113  -6.709
  420    H    ASP  58           H        ASP  58   2.516   4.546  -4.269
  421    HA   ASP  58           HA       ASP  58   0.767   6.826  -3.781
  422   1HB   ASP  58          2HB       ASP  58   2.422   5.203  -2.322
  423   2HB   ASP  58          1HB       ASP  58   3.405   6.662  -2.460
  424    H    ILE  59           H        ILE  59   1.084   8.021  -5.830
  425    HA   ILE  59           HA       ILE  59   3.611   8.895  -6.811
  426    HB   ILE  59           HB       ILE  59   0.844  10.134  -6.936
  427   1HG1  ILE  59          2HG1      ILE  59   1.045   7.782  -7.770
  428   2HG1  ILE  59          1HG1      ILE  59   0.653   8.926  -9.051
  429   1HG2  ILE  59          1HG2      ILE  59   3.291  10.573  -8.674
  430   2HG2  ILE  59          2HG2      ILE  59   2.593  11.747  -7.558
  431   3HG2  ILE  59          3HG2      ILE  59   1.689  11.240  -8.985
  432   1HD1  ILE  59          1HD1      ILE  59   3.068   9.037  -9.652
  433   2HD1  ILE  59          2HD1      ILE  59   2.405   7.410  -9.824
  434   3HD1  ILE  59          3HD1      ILE  59   3.403   7.813  -8.426
  435    H    ASP  60           H        ASP  60   1.547  10.185  -4.234
  436    HA   ASP  60           HA       ASP  60   3.464  12.465  -3.897
  437   1HB   ASP  60          2HB       ASP  60   1.586  13.504  -2.672
  438   2HB   ASP  60          1HB       ASP  60   1.084  13.005  -4.288
  439    H    HIS  61           H        HIS  61   2.454   9.490  -2.509
  440    HA   HIS  61           HA       HIS  61   3.091   8.418  -0.504
  441   1HB   HIS  61          2HB       HIS  61   5.057  10.732  -0.424
  442   2HB   HIS  61          1HB       HIS  61   5.213   9.207   0.441
  443    HD1  HIS  61           HD1      HIS  61   6.659   7.557  -0.718
  444    HD2  HIS  61           HD2      HIS  61   4.807  10.126  -3.430
  445    HE1  HIS  61           HE1      HIS  61   7.501   6.902  -3.015
  446    H    ASP  62           H        ASP  62   0.858  10.118  -0.307
  447    HA   ASP  62           HA       ASP  62   1.279  11.649   2.224
  448   1HB   ASP  62          2HB       ASP  62  -0.835  12.714   1.596
  449   2HB   ASP  62          1HB       ASP  62   0.249  12.724   0.204
  450    H    GLY  63           H        GLY  63   0.975   8.611   1.798
  451   1HA   GLY  63          2HA       GLY  63  -0.002   6.872   3.040
  452   2HA   GLY  63          1HA       GLY  63  -0.668   8.108   4.111
  453    H    MET  64           H        MET  64  -1.292   8.222   0.672
  454    HA   MET  64           HA       MET  64  -3.958   6.970   1.000
  455   1HB   MET  64          2HB       MET  64  -3.495   9.857   0.189
  456   2HB   MET  64          1HB       MET  64  -5.049   9.034   0.145
  457   1HG   MET  64          2HG       MET  64  -5.061   8.763   2.530
  458   2HG   MET  64          1HG       MET  64  -3.402   9.352   2.658
  459   1HE   MET  64          1HE       MET  64  -6.933  11.299   3.564
  460   2HE   MET  64          2HE       MET  64  -6.718   9.675   2.917
  461   3HE   MET  64          3HE       MET  64  -7.302  10.963   1.866
  462    H    LEU  65           H        LEU  65  -5.044   6.717  -1.126
  463    HA   LEU  65           HA       LEU  65  -3.154   6.901  -3.453
  464   1HB   LEU  65          2HB       LEU  65  -4.887   4.701  -2.374
  465   2HB   LEU  65          1HB       LEU  65  -4.651   4.796  -4.119
  466    HG   LEU  65           HG       LEU  65  -2.484   4.576  -2.012
  467   1HD1  LEU  65          1HD1      LEU  65  -2.714   2.682  -4.282
  468   2HD1  LEU  65          2HD1      LEU  65  -4.000   2.587  -3.079
  469   3HD1  LEU  65          3HD1      LEU  65  -2.318   2.371  -2.592
  470   1HD2  LEU  65          1HD2      LEU  65  -1.094   4.313  -4.228
  471   2HD2  LEU  65          2HD2      LEU  65  -1.486   5.930  -3.644
  472   3HD2  LEU  65          3HD2      LEU  65  -2.427   5.213  -4.951
  473    H    ASP  66           H        ASP  66  -4.127   8.781  -4.396
  474    HA   ASP  66           HA       ASP  66  -6.990   9.161  -4.474
  475   1HB   ASP  66          2HB       ASP  66  -6.382  11.015  -6.005
  476   2HB   ASP  66          1HB       ASP  66  -5.356  10.990  -4.575
  477    H    ARG  67           H        ARG  67  -8.188   9.339  -6.597
  478    HA   ARG  67           HA       ARG  67  -8.621   7.006  -7.929
  479   1HB   ARG  67          2HB       ARG  67  -9.118   8.586  -9.950
  480   2HB   ARG  67          1HB       ARG  67 -10.026   8.791  -8.456
  481   1HG   ARG  67          2HG       ARG  67  -7.568  10.313  -8.338
  482   2HG   ARG  67          1HG       ARG  67  -8.476  10.735  -9.789
  483   1HD   ARG  67          2HD       ARG  67  -9.563  10.732  -6.950
  484   2HD   ARG  67          1HD       ARG  67  -9.221  12.163  -7.943
  485    HE   ARG  67           HE       ARG  67 -11.415  10.220  -8.419
  486   1HH1  ARG  67          1HH2      ARG  67 -11.425  13.337  -8.187
  487   2HH1  ARG  67          2HH2      ARG  67 -11.787  13.753  -9.828
  488   1HH2  ARG  67          2HH1      ARG  67 -11.093  10.581 -11.059
  489   2HH2  ARG  67          1HH1      ARG  67 -11.597  12.189 -11.458
  490    H    ASP  68           H        ASP  68  -6.135   9.356  -8.965
  491    HA   ASP  68           HA       ASP  68  -5.271   7.731 -11.207
  492   1HB   ASP  68          2HB       ASP  68  -5.075  10.179 -11.107
  493   2HB   ASP  68          1HB       ASP  68  -4.000  10.048  -9.715
  494    H    GLU  69           H        GLU  69  -3.988   8.303  -7.931
  495    HA   GLU  69           HA       GLU  69  -1.650   6.624  -8.304
  496   1HB   GLU  69          2HB       GLU  69  -3.165   7.631  -5.875
  497   2HB   GLU  69          1HB       GLU  69  -1.602   6.816  -5.785
  498   1HG   GLU  69          2HG       GLU  69  -0.551   8.541  -7.103
  499   2HG   GLU  69          1HG       GLU  69  -2.105   9.298  -7.446
  500    H    PHE  70           H        PHE  70  -4.854   6.138  -6.830
  501    HA   PHE  70           HA       PHE  70  -4.528   3.454  -5.963
  502   1HB   PHE  70          2HB       PHE  70  -6.420   5.201  -5.645
  503   2HB   PHE  70          1HB       PHE  70  -7.028   4.629  -7.199
  504    HD1  PHE  70           HD1      PHE  70  -6.856   4.004  -3.664
  505    HD2  PHE  70           HD2      PHE  70  -7.468   2.122  -7.474
  506    HE1  PHE  70           HE1      PHE  70  -7.920   2.069  -2.538
  507    HE2  PHE  70           HE2      PHE  70  -8.529   0.190  -6.349
  508    HZ   PHE  70           HZ       PHE  70  -8.756   0.161  -3.881
  509    H    ALA  71           H        ALA  71  -4.851   4.854  -9.142
  510    HA   ALA  71           HA       ALA  71  -5.720   2.436 -10.517
  511   1HB   ALA  71          1HB       ALA  71  -4.183   4.744 -11.713
  512   2HB   ALA  71          2HB       ALA  71  -5.845   4.963 -11.164
  513   3HB   ALA  71          3HB       ALA  71  -5.484   3.801 -12.439
  514    H    VAL  72           H        VAL  72  -2.619   4.112 -10.111
  515    HA   VAL  72           HA       VAL  72  -0.973   2.318 -11.573
  516    HB   VAL  72           HB       VAL  72  -0.440   4.019  -9.114
  517   1HG1  VAL  72          1HG1      VAL  72   1.391   2.477  -9.431
  518   2HG1  VAL  72          2HG1      VAL  72   1.903   4.062 -10.007
  519   3HG1  VAL  72          3HG1      VAL  72   1.439   2.813 -11.161
  520   1HG2  VAL  72          1HG2      VAL  72   0.203   5.757 -10.690
  521   2HG2  VAL  72          2HG2      VAL  72  -1.429   5.213 -11.085
  522   3HG2  VAL  72          3HG2      VAL  72  -0.061   4.673 -12.057
  523    H    ALA  73           H        ALA  73  -2.400   2.097  -8.385
  524    HA   ALA  73           HA       ALA  73  -0.659  -0.136  -7.545
  525   1HB   ALA  73          1HB       ALA  73  -1.457   0.396  -5.458
  526   2HB   ALA  73          2HB       ALA  73  -3.098   0.671  -6.045
  527   3HB   ALA  73          3HB       ALA  73  -1.861   1.913  -6.265
  528    H    MET  74           H        MET  74  -3.470   0.158  -9.421
  529    HA   MET  74           HA       MET  74  -4.748  -2.323  -8.461
  530   1HB   MET  74          2HB       MET  74  -5.241  -0.424 -10.776
  531   2HB   MET  74          1HB       MET  74  -6.287  -1.789 -10.392
  532   1HG   MET  74          2HG       MET  74  -5.675  -0.048  -8.095
  533   2HG   MET  74          1HG       MET  74  -6.605   0.734  -9.372
  534   1HE   MET  74          1HE       MET  74  -7.767  -1.719  -6.074
  535   2HE   MET  74          2HE       MET  74  -6.149  -1.394  -6.691
  536   3HE   MET  74          3HE       MET  74  -6.951  -2.909  -7.099
  537    H    PHE  75           H        PHE  75  -3.027  -1.236 -11.401
  538    HA   PHE  75           HA       PHE  75  -3.059  -3.911 -12.563
  539   1HB   PHE  75          2HB       PHE  75  -2.020  -2.846 -14.376
  540   2HB   PHE  75          1HB       PHE  75  -2.866  -1.494 -13.626
  541    HD1  PHE  75           HD1      PHE  75   0.391  -3.022 -14.308
  542    HD2  PHE  75           HD2      PHE  75  -1.647   0.142 -12.242
  543    HE1  PHE  75           HE1      PHE  75   2.550  -1.853 -13.973
  544    HE2  PHE  75           HE2      PHE  75   0.507   1.309 -11.910
  545    HZ   PHE  75           HZ       PHE  75   2.610   0.313 -12.772
  546    H    LEU  76           H        LEU  76  -0.997  -2.031 -10.460
  547    HA   LEU  76           HA       LEU  76   1.386  -3.639 -10.639
  548   1HB   LEU  76          2HB       LEU  76   0.192  -1.535  -8.927
  549   2HB   LEU  76          1HB       LEU  76   1.371  -2.567  -8.122
  550    HG   LEU  76           HG       LEU  76   1.917  -1.267 -10.795
  551   1HD1  LEU  76          1HD1      LEU  76   1.452   0.211  -8.586
  552   2HD1  LEU  76          2HD1      LEU  76   2.674   0.647  -9.781
  553   3HD1  LEU  76          3HD1      LEU  76   3.145  -0.196  -8.305
  554   1HD2  LEU  76          1HD2      LEU  76   3.884  -2.369 -10.659
  555   2HD2  LEU  76          2HD2      LEU  76   3.240  -3.233  -9.263
  556   3HD2  LEU  76          3HD2      LEU  76   4.167  -1.752  -9.031
  557    H    VAL  77           H        VAL  77  -1.690  -3.970  -9.081
  558    HA   VAL  77           HA       VAL  77  -0.803  -6.178  -7.315
  559    HB   VAL  77           HB       VAL  77  -3.425  -4.721  -7.849
  560   1HG1  VAL  77          1HG1      VAL  77  -4.380  -5.920  -5.994
  561   2HG1  VAL  77          2HG1      VAL  77  -2.838  -6.688  -5.615
  562   3HG1  VAL  77          3HG1      VAL  77  -3.706  -7.130  -7.086
  563   1HG2  VAL  77          1HG2      VAL  77  -3.002  -3.589  -5.799
  564   2HG2  VAL  77          2HG2      VAL  77  -1.468  -3.564  -6.665
  565   3HG2  VAL  77          3HG2      VAL  77  -1.717  -4.713  -5.352
  566    H    TYR  78           H        TYR  78  -3.332  -5.679  -9.791
  567    HA   TYR  78           HA       TYR  78  -4.120  -8.310 -10.207
  568   1HB   TYR  78          2HB       TYR  78  -4.005  -5.784 -11.744
  569   2HB   TYR  78          1HB       TYR  78  -4.258  -7.242 -12.704
  570    HD1  TYR  78           HD1      TYR  78  -6.115  -4.742 -11.566
  571    HD2  TYR  78           HD2      TYR  78  -5.767  -8.971 -10.900
  572    HE1  TYR  78           HE1      TYR  78  -8.482  -4.820 -10.831
  573    HE2  TYR  78           HE2      TYR  78  -8.134  -9.052 -10.166
  574    HH   TYR  78           HH       TYR  78 -10.144  -6.101 -10.119
  575    H    CYS  79           H        CYS  79  -1.064  -6.874 -11.126
  576    HA   CYS  79           HA       CYS  79  -0.445  -8.966 -13.103
  577   1HB   CYS  79          2HB       CYS  79   0.304  -6.381 -12.738
  578   2HB   CYS  79          1HB       CYS  79   1.659  -7.203 -11.964
  579    HG   CYS  79           HG       CYS  79   1.930  -6.892 -14.670
  580    H    ALA  80           H        ALA  80  -0.283  -8.656  -9.706
  581    HA   ALA  80           HA       ALA  80   2.033 -10.467  -9.412
  582   1HB   ALA  80          1HB       ALA  80   2.086  -8.990  -7.661
  583   2HB   ALA  80          2HB       ALA  80   0.954 -10.128  -6.932
  584   3HB   ALA  80          3HB       ALA  80   0.351  -8.685  -7.748
  585    H    LEU  81           H        LEU  81  -1.397 -10.621  -9.688
  586    HA   LEU  81           HA       LEU  81  -1.587 -13.224  -8.322
  587   1HB   LEU  81          2HB       LEU  81  -3.575 -11.487  -9.812
  588   2HB   LEU  81          1HB       LEU  81  -4.001 -12.974  -8.965
  589    HG   LEU  81           HG       LEU  81  -2.947 -11.933  -6.889
  590   1HD1  LEU  81          1HD1      LEU  81  -2.867  -9.654  -8.830
  591   2HD1  LEU  81          2HD1      LEU  81  -1.643 -10.182  -7.679
  592   3HD1  LEU  81          3HD1      LEU  81  -3.079  -9.332  -7.107
  593   1HD2  LEU  81          1HD2      LEU  81  -4.978 -10.176  -6.815
  594   2HD2  LEU  81          2HD2      LEU  81  -5.249 -11.916  -6.709
  595   3HD2  LEU  81          3HD2      LEU  81  -5.464 -11.081  -8.248
  596    H    GLU  82           H        GLU  82  -1.792 -11.873 -11.586
  597    HA   GLU  82           HA       GLU  82  -2.421 -14.377 -12.880
  598   1HB   GLU  82          2HB       GLU  82  -1.703 -11.594 -13.559
  599   2HB   GLU  82          1HB       GLU  82  -1.228 -12.788 -14.769
  600   1HG   GLU  82          2HG       GLU  82  -3.850 -13.471 -13.904
  601   2HG   GLU  82          1HG       GLU  82  -3.846 -11.739 -14.239
  602    H    LYS  83           H        LYS  83   0.564 -12.440 -12.932
  603    HA   LYS  83           HA       LYS  83   2.365 -14.567 -12.301
  604   1HB   LYS  83          2HB       LYS  83   1.214 -15.236 -14.556
  605   2HB   LYS  83          1HB       LYS  83   2.298 -14.043 -15.262
  606   1HG   LYS  83          2HG       LYS  83   3.609 -15.957 -15.406
  607   2HG   LYS  83          1HG       LYS  83   4.125 -15.321 -13.843
  608   1HD   LYS  83          2HD       LYS  83   2.264 -16.768 -12.823
  609   2HD   LYS  83          1HD       LYS  83   2.183 -17.572 -14.392
  610   1HE   LYS  83          2HE       LYS  83   4.245 -18.585 -14.130
  611   2HE   LYS  83          1HE       LYS  83   4.891 -17.249 -13.158
  612   1HZ   LYS  83          1HZ       LYS  83   4.413 -18.514 -11.396
  613   2HZ   LYS  83          2HZ       LYS  83   3.467 -19.592 -12.305
  614   3HZ   LYS  83          3HZ       LYS  83   2.782 -18.164 -11.696
  615    H    GLU  84           H        GLU  84   2.826 -12.214 -11.324
  616    HA   GLU  84           HA       GLU  84   5.258 -11.246 -12.528
  617   1HB   GLU  84          2HB       GLU  84   2.839 -10.370 -13.698
  618   2HB   GLU  84          1HB       GLU  84   3.456  -8.999 -12.775
  619   1HG   GLU  84          2HG       GLU  84   5.674 -10.213 -14.092
  620   2HG   GLU  84          1HG       GLU  84   4.393 -10.005 -15.286
  621    HA   PRO  85           HA       PRO  85   4.951 -10.069  -8.179
  622   1HB   PRO  85          2HB       PRO  85   7.660  -9.733  -7.876
  623   2HB   PRO  85          1HB       PRO  85   6.860 -11.316  -7.787
  624   1HG   PRO  85          2HG       PRO  85   8.300 -10.052 -10.078
  625   2HG   PRO  85          1HG       PRO  85   8.372 -11.722  -9.489
  626   1HD   PRO  85          2HD       PRO  85   6.910 -11.041 -11.642
  627   2HD   PRO  85          1HD       PRO  85   6.383 -12.311 -10.512
  628    H    VAL  86           H        VAL  86   6.204  -8.068  -7.056
  629    HA   VAL  86           HA       VAL  86   6.071  -5.793  -9.009
  630    HB   VAL  86           HB       VAL  86   5.305  -5.967  -6.078
  631   1HG1  VAL  86          1HG1      VAL  86   5.056  -3.708  -6.059
  632   2HG1  VAL  86          2HG1      VAL  86   4.404  -3.677  -7.697
  633   3HG1  VAL  86          3HG1      VAL  86   6.149  -3.732  -7.442
  634   1HG2  VAL  86          1HG2      VAL  86   3.470  -5.432  -8.413
  635   2HG2  VAL  86          2HG2      VAL  86   3.057  -5.993  -6.791
  636   3HG2  VAL  86          3HG2      VAL  86   3.852  -7.084  -7.926
  637    HA   PRO  87           HA       PRO  87  10.174  -5.052  -7.432
  638   1HB   PRO  87          2HB       PRO  87  10.790  -3.064  -9.197
  639   2HB   PRO  87          1HB       PRO  87  10.788  -4.779  -9.650
  640   1HG   PRO  87          2HG       PRO  87   8.866  -2.659 -10.325
  641   2HG   PRO  87          1HG       PRO  87   9.232  -4.168 -11.171
  642   1HD   PRO  87          2HD       PRO  87   7.014  -3.634  -9.486
  643   2HD   PRO  87          1HD       PRO  87   7.467  -5.189 -10.213
  644    H    MET  88           H        MET  88  11.339  -2.617  -7.184
  645    HA   MET  88           HA       MET  88   9.367  -1.017  -5.575
  646   1HB   MET  88          2HB       MET  88  12.379  -1.199  -5.347
  647   2HB   MET  88          1HB       MET  88  11.284  -0.407  -4.218
  648   1HG   MET  88          2HG       MET  88  10.267  -2.546  -3.634
  649   2HG   MET  88          1HG       MET  88  11.232  -3.373  -4.858
  650   1HE   MET  88          1HE       MET  88  14.465  -4.136  -3.413
  651   2HE   MET  88          2HE       MET  88  14.068  -3.102  -4.782
  652   3HE   MET  88          3HE       MET  88  13.101  -4.540  -4.465
  653    H    SER  89           H        SER  89  10.578  -0.877  -8.550
  654    HA   SER  89           HA       SER  89  11.475   1.959  -8.309
  655   1HB   SER  89          2HB       SER  89  12.007  -0.268 -10.254
  656   2HB   SER  89          1HB       SER  89  12.394   1.405 -10.640
  657    HG   SER  89           HG       SER  89  14.126   1.121  -9.496
  658    H    LEU  90           H        LEU  90   9.678   3.148  -8.544
  659    HA   LEU  90           HA       LEU  90   7.378   2.646 -10.115
  660   1HB   LEU  90          2HB       LEU  90   8.562   4.756  -8.613
  661   2HB   LEU  90          1HB       LEU  90   8.114   5.437 -10.177
  662    HG   LEU  90           HG       LEU  90   6.283   3.889  -8.321
  663   1HD1  LEU  90          1HD1      LEU  90   5.086   6.222  -8.499
  664   2HD1  LEU  90          2HD1      LEU  90   6.689   6.799  -8.951
  665   3HD1  LEU  90          3HD1      LEU  90   6.440   6.026  -7.385
  666   1HD2  LEU  90          1HD2      LEU  90   4.936   5.313 -10.414
  667   2HD2  LEU  90          2HD2      LEU  90   4.945   3.576 -10.107
  668   3HD2  LEU  90          3HD2      LEU  90   6.178   4.296 -11.144
  669    HA   PRO  91           HA       PRO  91   9.635   2.719 -14.023
  670   1HB   PRO  91          2HB       PRO  91   7.502   1.850 -15.530
  671   2HB   PRO  91          1HB       PRO  91   8.580   0.767 -14.628
  672   1HG   PRO  91          2HG       PRO  91   5.886   1.798 -13.885
  673   2HG   PRO  91          1HG       PRO  91   6.570   0.180 -13.671
  674   1HD   PRO  91          2HD       PRO  91   6.408   1.951 -11.638
  675   2HD   PRO  91          1HD       PRO  91   7.736   0.772 -11.767
  676    HA   PRO  92           HA       PRO  92   8.353   6.721 -15.283
  677   1HB   PRO  92          2HB       PRO  92   9.687   6.817 -17.658
  678   2HB   PRO  92          1HB       PRO  92  10.499   6.961 -16.087
  679   1HG   PRO  92          2HG       PRO  92  10.283   4.616 -17.905
  680   2HG   PRO  92          1HG       PRO  92  11.652   5.158 -16.923
  681   1HD   PRO  92          2HD       PRO  92  10.017   3.098 -16.218
  682   2HD   PRO  92          1HD       PRO  92  10.884   4.108 -15.041
  683    H    ALA  93           H        ALA  93   7.203   3.952 -16.659
  684    HA   ALA  93           HA       ALA  93   5.768   5.370 -18.871
  685   1HB   ALA  93          1HB       ALA  93   6.283   3.454 -19.966
  686   2HB   ALA  93          2HB       ALA  93   5.266   2.566 -18.832
  687   3HB   ALA  93          3HB       ALA  93   6.983   2.779 -18.496
  688    H    LEU  94           H        LEU  94   5.491   4.046 -15.745
  689    HA   LEU  94           HA       LEU  94   2.557   3.675 -15.841
  690   1HB   LEU  94          2HB       LEU  94   3.882   2.030 -14.690
  691   2HB   LEU  94          1HB       LEU  94   4.817   3.274 -13.865
  692    HG   LEU  94           HG       LEU  94   3.034   2.080 -12.482
  693   1HD1  LEU  94          1HD1      LEU  94   3.313   3.877 -11.173
  694   2HD1  LEU  94          2HD1      LEU  94   2.218   4.822 -12.183
  695   3HD1  LEU  94          3HD1      LEU  94   3.942   4.755 -12.568
  696   1HD2  LEU  94          1HD2      LEU  94   1.184   1.976 -13.963
  697   2HD2  LEU  94          2HD2      LEU  94   1.325   3.674 -14.397
  698   3HD2  LEU  94          3HD2      LEU  94   0.741   3.223 -12.803
  699    H    VAL  95           H        VAL  95   4.894   6.097 -15.075
  700    HA   VAL  95           HA       VAL  95   3.366   7.531 -13.061
  701    HB   VAL  95           HB       VAL  95   5.600   8.390 -14.932
  702   1HG1  VAL  95          1HG1      VAL  95   4.544   9.550 -12.337
  703   2HG1  VAL  95          2HG1      VAL  95   4.516  10.317 -13.925
  704   3HG1  VAL  95          3HG1      VAL  95   6.052  10.049 -13.101
  705   1HG2  VAL  95          1HG2      VAL  95   6.893   7.001 -13.714
  706   2HG2  VAL  95          2HG2      VAL  95   5.517   6.555 -12.705
  707   3HG2  VAL  95          3HG2      VAL  95   6.504   7.955 -12.283
  708    HA   PRO  96           HA       PRO  96   0.535   9.500 -15.819
  709   1HB   PRO  96          2HB       PRO  96  -0.316  11.470 -14.119
  710   2HB   PRO  96          1HB       PRO  96  -0.834   9.779 -13.973
  711   1HG   PRO  96          2HG       PRO  96   1.239  11.262 -12.434
  712   2HG   PRO  96          1HG       PRO  96   0.065  10.061 -11.877
  713   1HD   PRO  96          2HD       PRO  96   2.685   9.486 -12.335
  714   2HD   PRO  96          1HD       PRO  96   1.380   8.291 -12.496
  715    HA   PRO  97           HA       PRO  97   2.531  13.034 -17.483
  716   1HB   PRO  97          2HB       PRO  97   0.461  14.709 -18.118
  717   2HB   PRO  97          1HB       PRO  97   0.803  13.214 -19.013
  718   1HG   PRO  97          2HG       PRO  97  -1.249  13.738 -16.921
  719   2HG   PRO  97          1HG       PRO  97  -1.362  12.767 -18.397
  720   1HD   PRO  97          2HD       PRO  97  -1.004  11.697 -15.913
  721   2HD   PRO  97          1HD       PRO  97  -0.442  10.920 -17.408
  722    H    SER  98           H        SER  98   0.515  13.446 -14.689
  723    HA   SER  98           HA       SER  98   1.080  16.251 -14.224
  724   1HB   SER  98          2HB       SER  98   0.445  15.277 -11.794
  725   2HB   SER  98          1HB       SER  98  -0.772  15.525 -13.043
  726    HG   SER  98           HG       SER  98   0.321  13.190 -12.031
  727    H    LYS  99           H        LYS  99   2.973  13.440 -14.021
  728    HA   LYS  99           HA       LYS  99   4.725  14.442 -11.860
  729   1HB   LYS  99          2HB       LYS  99   4.059  11.959 -13.128
  730   2HB   LYS  99          1HB       LYS  99   5.795  12.217 -13.307
  731   1HG   LYS  99          2HG       LYS  99   4.683  12.853 -10.637
  732   2HG   LYS  99          1HG       LYS  99   4.669  11.145 -11.078
  733   1HD   LYS  99          2HD       LYS  99   6.919  10.973 -10.904
  734   2HD   LYS  99          1HD       LYS  99   7.181  12.484 -11.775
  735   1HE   LYS  99          2HE       LYS  99   6.152  13.437  -9.430
  736   2HE   LYS  99          1HE       LYS  99   7.031  12.006  -8.857
  737   1HZ   LYS  99          1HZ       LYS  99   9.012  12.781  -9.646
  738   2HZ   LYS  99          2HZ       LYS  99   8.274  14.267  -9.281
  739   3HZ   LYS  99          3HZ       LYS  99   8.302  13.700 -10.882
  740    H    ARG 100           H        ARG 100   4.322  15.017 -15.153
  741    HA   ARG 100           HA       ARG 100   7.179  15.246 -15.838
  742   1HB   ARG 100          2HB       ARG 100   4.522  15.369 -17.136
  743   2HB   ARG 100          1HB       ARG 100   5.751  16.410 -17.858
  744   1HG   ARG 100          2HG       ARG 100   6.304  14.500 -18.984
  745   2HG   ARG 100          1HG       ARG 100   7.204  14.158 -17.507
  746   1HD   ARG 100          2HD       ARG 100   4.831  13.173 -16.737
  747   2HD   ARG 100          1HD       ARG 100   4.664  12.939 -18.489
  748    HE   ARG 100           HE       ARG 100   7.144  12.026 -17.092
  749   1HH1  ARG 100          1HH2      ARG 100   4.770  10.148 -16.962
  750   2HH1  ARG 100          2HH2      ARG 100   5.051   9.139 -18.342
  751   1HH2  ARG 100          2HH1      ARG 100   7.347  11.304 -19.784
  752   2HH2  ARG 100          1HH1      ARG 100   6.512   9.794 -19.941
  753    H    SER 107           1H       SER 107   7.499   9.249   4.703
  754    HA   SER 107           HA       SER 107   6.431   8.467   2.408
  755   1HB   SER 107          2HB       SER 107   9.232   7.459   2.633
  756   2HB   SER 107          1HB       SER 107   8.023   6.336   2.018
  757    HG   SER 107           HG       SER 107   9.200   8.406   0.785
  758    H    THR 108           H        THR 108   4.843   7.064   3.107
  759    HA   THR 108           HA       THR 108   5.485   5.225   5.384
  760    HB   THR 108           HB       THR 108   4.385   7.375   6.088
  761    HG1  THR 108           HG1      THR 108   2.828   5.016   6.327
  762   1HG2  THR 108          1HG2      THR 108   2.394   8.090   5.205
  763   2HG2  THR 108          2HG2      THR 108   1.819   6.450   4.905
  764   3HG2  THR 108          3HG2      THR 108   2.978   7.192   3.803
  765    H    ASN 109           H        ASN 109   4.546   3.194   5.172
  766    HA   ASN 109           HA       ASN 109   2.586   2.805   2.932
  767   1HB   ASN 109          2HB       ASN 109   4.895   2.067   2.405
  768   2HB   ASN 109          1HB       ASN 109   4.877   1.032   3.832
  769   1HD2  ASN 109          1HD2      ASN 109   3.937   1.241   0.503
  770   2HD2  ASN 109          2HD2      ASN 109   3.096  -0.229   0.425
  771    HA   PRO 110           HA       PRO 110   0.217   0.926   6.157
  772   1HB   PRO 110          2HB       PRO 110  -1.738  -0.156   4.585
  773   2HB   PRO 110          1HB       PRO 110  -1.634   1.577   4.951
  774   1HG   PRO 110          2HG       PRO 110  -0.880   0.119   2.485
  775   2HG   PRO 110          1HG       PRO 110  -1.541   1.748   2.681
  776   1HD   PRO 110          2HD       PRO 110   1.118   1.157   2.188
  777   2HD   PRO 110          1HD       PRO 110   0.519   2.681   2.875
  778    H    PHE 111           H        PHE 111   2.236  -0.744   4.143
  779    HA   PHE 111           HA       PHE 111   1.307  -3.392   5.219
  780   1HB   PHE 111          2HB       PHE 111   2.480  -2.597   2.546
  781   2HB   PHE 111          1HB       PHE 111   2.399  -4.279   3.068
  782    HD1  PHE 111           HD1      PHE 111   0.571  -1.480   1.693
  783    HD2  PHE 111           HD2      PHE 111   0.139  -5.265   3.673
  784    HE1  PHE 111           HE1      PHE 111  -1.798  -1.586   0.970
  785    HE2  PHE 111           HE2      PHE 111  -2.231  -5.372   2.951
  786    HZ   PHE 111           HZ       PHE 111  -3.197  -3.534   1.599
  787    H    LEU 112           HN       LEU 112   4.057  -1.312   4.397
  788    HA   LEU 112           HA       LEU 112   6.067  -3.231   5.309
  789   1HB   LEU 112          2HB       LEU 112   5.963  -0.354   4.426
  790   2HB   LEU 112          1HB       LEU 112   7.440  -0.997   5.144
  791    HG   LEU 112           HG       LEU 112   6.743  -2.974   3.348
  792   1HD1  LEU 112          1HD1      LEU 112   4.988  -1.576   2.366
  793   2HD1  LEU 112          2HD1      LEU 112   6.315  -1.759   1.219
  794   3HD1  LEU 112          3HD1      LEU 112   6.137  -0.261   2.132
  795   1HD2  LEU 112          1HD2      LEU 112   8.999  -2.290   3.534
  796   2HD2  LEU 112          2HD2      LEU 112   8.606  -0.603   3.203
  797   3HD2  LEU 112          3HD2      LEU 112   8.547  -1.793   1.903
  Start of MODEL    8
    1    HA   PRO   6           HA       PRO   6   1.555   7.278 -22.968
    2   1HB   PRO   6          2HB       PRO   6   1.110   4.585 -23.182
    3   2HB   PRO   6          1HB       PRO   6   1.174   5.667 -24.589
    4   1HG   PRO   6          2HG       PRO   6   3.266   3.840 -23.510
    5   2HG   PRO   6          1HG       PRO   6   2.831   4.189 -25.190
    6   1HD   PRO   6          2HD       PRO   6   4.995   5.280 -23.953
    7   2HD   PRO   6          1HD       PRO   6   4.110   6.089 -25.267
    8    H    TRP   7           H        TRP   7   0.287   5.564 -21.356
    9    HA   TRP   7           HA       TRP   7   2.050   5.359 -18.942
   10   1HB   TRP   7          2HB       TRP   7   0.220   7.009 -18.854
   11   2HB   TRP   7          1HB       TRP   7  -0.945   5.743 -19.240
   12    HD1  TRP   7           HD1      TRP   7   1.879   4.803 -16.945
   13    HE1  TRP   7           HE1      TRP   7   0.972   4.477 -14.552
   14    HE3  TRP   7           HE3      TRP   7  -2.836   6.644 -17.545
   15    HZ2  TRP   7           HZ2      TRP   7  -1.442   4.944 -13.088
   16    HZ3  TRP   7           HZ3      TRP   7  -4.419   6.699 -15.638
   17    HH2  TRP   7           HH2      TRP   7  -3.730   5.851 -13.412
   18    H    ALA   8           H        ALA   8   2.282   3.362 -18.035
   19    HA   ALA   8           HA       ALA   8   1.748   0.934 -19.216
   20   1HB   ALA   8          1HB       ALA   8   2.463   1.999 -16.667
   21   2HB   ALA   8          2HB       ALA   8   2.898   0.437 -17.351
   22   3HB   ALA   8          3HB       ALA   8   1.407   0.609 -16.416
   23    H    VAL   9           H        VAL   9  -0.461   2.820 -17.202
   24    HA   VAL   9           HA       VAL   9  -2.516   0.711 -17.244
   25    HB   VAL   9           HB       VAL   9  -2.338   3.539 -16.162
   26   1HG1  VAL   9          1HG1      VAL   9  -4.559   1.490 -15.879
   27   2HG1  VAL   9          2HG1      VAL   9  -4.674   3.048 -16.699
   28   3HG1  VAL   9          3HG1      VAL   9  -4.443   2.987 -14.952
   29   1HG2  VAL   9          1HG2      VAL   9  -0.943   1.774 -15.068
   30   2HG2  VAL   9          2HG2      VAL   9  -2.409   0.831 -14.783
   31   3HG2  VAL   9          3HG2      VAL   9  -2.201   2.398 -13.998
   32    H    LYS  10           H        LYS  10  -4.679   1.154 -18.146
   33    HA   LYS  10           HA       LYS  10  -4.549   2.934 -20.557
   34   1HB   LYS  10          2HB       LYS  10  -5.339   0.167 -20.018
   35   2HB   LYS  10          1HB       LYS  10  -6.575   1.056 -20.905
   36   1HG   LYS  10          2HG       LYS  10  -5.154   0.165 -22.584
   37   2HG   LYS  10          1HG       LYS  10  -4.656   1.850 -22.430
   38   1HD   LYS  10          2HD       LYS  10  -2.742   1.274 -21.135
   39   2HD   LYS  10          1HD       LYS  10  -3.329  -0.366 -20.862
   40   1HE   LYS  10          2HE       LYS  10  -3.014  -0.933 -23.210
   41   2HE   LYS  10          1HE       LYS  10  -2.574   0.746 -23.589
   42   1HZ   LYS  10          1HZ       LYS  10  -0.511  -0.132 -23.201
   43   2HZ   LYS  10          2HZ       LYS  10  -1.074  -1.272 -22.073
   44   3HZ   LYS  10          3HZ       LYS  10  -0.904   0.358 -21.626
   45    HA   PRO  11           HA       PRO  11  -8.195   5.043 -19.300
   46   1HB   PRO  11          2HB       PRO  11  -9.920   4.823 -21.418
   47   2HB   PRO  11          1HB       PRO  11  -8.478   5.858 -21.451
   48   1HG   PRO  11          2HG       PRO  11  -8.887   3.142 -22.606
   49   2HG   PRO  11          1HG       PRO  11  -8.025   4.536 -23.277
   50   1HD   PRO  11          2HD       PRO  11  -6.756   2.437 -22.117
   51   2HD   PRO  11          1HD       PRO  11  -6.109   4.092 -22.091
   52    H    GLU  12           H        GLU  12  -8.803   1.839 -20.676
   53    HA   GLU  12           HA       GLU  12 -11.400   1.513 -19.379
   54   1HB   GLU  12          2HB       GLU  12 -11.300  -0.663 -20.401
   55   2HB   GLU  12          1HB       GLU  12 -10.550   0.458 -21.536
   56   1HG   GLU  12          2HG       GLU  12  -8.319  -0.155 -20.434
   57   2HG   GLU  12          1HG       GLU  12  -9.186  -1.490 -19.674
   58    H    ASP  13           H        ASP  13  -8.050   0.842 -18.568
   59    HA   ASP  13           HA       ASP  13  -8.700  -0.955 -16.334
   60   1HB   ASP  13          2HB       ASP  13  -6.234   0.405 -17.442
   61   2HB   ASP  13          1HB       ASP  13  -6.172  -0.491 -15.925
   62    H    LYS  14           H        LYS  14  -8.008   2.453 -16.872
   63    HA   LYS  14           HA       LYS  14  -7.755   3.133 -14.053
   64   1HB   LYS  14          2HB       LYS  14  -7.278   4.297 -16.559
   65   2HB   LYS  14          1HB       LYS  14  -8.571   5.271 -15.858
   66   1HG   LYS  14          2HG       LYS  14  -6.351   4.558 -14.023
   67   2HG   LYS  14          1HG       LYS  14  -5.948   5.686 -15.317
   68   1HD   LYS  14          2HD       LYS  14  -8.409   6.601 -14.393
   69   2HD   LYS  14          1HD       LYS  14  -7.562   6.121 -12.922
   70   1HE   LYS  14          2HE       LYS  14  -5.567   7.460 -13.737
   71   2HE   LYS  14          1HE       LYS  14  -6.610   8.090 -15.027
   72   1HZ   LYS  14          1HZ       LYS  14  -8.237   8.448 -13.027
   73   2HZ   LYS  14          2HZ       LYS  14  -7.043   9.601 -13.384
   74   3HZ   LYS  14          3HZ       LYS  14  -6.801   8.486 -12.125
   75    H    ALA  15           H        ALA  15 -10.333   2.387 -16.145
   76    HA   ALA  15           HA       ALA  15 -12.375   4.039 -14.830
   77   1HB   ALA  15          1HB       ALA  15 -13.089   3.617 -16.963
   78   2HB   ALA  15          2HB       ALA  15 -13.662   2.092 -16.290
   79   3HB   ALA  15          3HB       ALA  15 -12.098   2.165 -17.100
   80    H    LYS  16           H        LYS  16 -11.313   0.640 -14.842
   81    HA   LYS  16           HA       LYS  16 -13.333  -0.228 -12.939
   82   1HB   LYS  16          2HB       LYS  16 -12.281  -2.317 -13.207
   83   2HB   LYS  16          1HB       LYS  16 -11.922  -1.511 -14.735
   84   1HG   LYS  16          2HG       LYS  16  -9.805  -0.656 -13.499
   85   2HG   LYS  16          1HG       LYS  16 -10.116  -1.991 -12.391
   86   1HD   LYS  16          2HD       LYS  16 -10.168  -2.538 -15.335
   87   2HD   LYS  16          1HD       LYS  16  -8.602  -2.348 -14.545
   88   1HE   LYS  16          2HE       LYS  16  -8.876  -4.605 -14.146
   89   2HE   LYS  16          1HE       LYS  16  -9.827  -4.012 -12.771
   90   1HZ   LYS  16          1HZ       LYS  16 -11.393  -3.922 -15.119
   91   2HZ   LYS  16          2HZ       LYS  16 -11.669  -4.804 -13.695
   92   3HZ   LYS  16          3HZ       LYS  16 -10.747  -5.481 -14.951
   93    H    TYR  17           H        TYR  17 -10.132   1.165 -12.797
   94    HA   TYR  17           HA       TYR  17  -9.559   0.522 -10.022
   95   1HB   TYR  17          2HB       TYR  17  -8.580   2.716 -11.889
   96   2HB   TYR  17          1HB       TYR  17  -7.825   2.291 -10.355
   97    HD1  TYR  17           HD1      TYR  17  -5.949   2.163 -12.359
   98    HD2  TYR  17           HD2      TYR  17  -9.037  -0.716 -11.578
   99    HE1  TYR  17           HE1      TYR  17  -4.595   0.416 -13.487
  100    HE2  TYR  17           HE2      TYR  17  -7.698  -2.459 -12.720
  101    HH   TYR  17           HH       TYR  17  -5.413  -2.927 -13.317
  102    H    ASP  18           H        ASP  18 -11.138   3.165 -11.758
  103    HA   ASP  18           HA       ASP  18 -11.395   4.941  -9.474
  104   1HB   ASP  18          2HB       ASP  18 -12.379   4.708 -12.284
  105   2HB   ASP  18          1HB       ASP  18 -13.263   5.788 -11.207
  106    H    ALA  19           H        ALA  19 -12.956   2.048 -10.339
  107    HA   ALA  19           HA       ALA  19 -15.527   2.743  -9.016
  108   1HB   ALA  19          1HB       ALA  19 -15.403   0.002  -9.588
  109   2HB   ALA  19          2HB       ALA  19 -14.467   0.752 -10.880
  110   3HB   ALA  19          3HB       ALA  19 -16.141   1.234 -10.609
  111    H    ILE  20           H        ILE  20 -12.557   0.990  -8.620
  112    HA   ILE  20           HA       ILE  20 -13.265  -0.249  -6.059
  113    HB   ILE  20           HB       ILE  20 -10.802   0.077  -7.801
  114   1HG1  ILE  20          2HG1      ILE  20 -12.261  -2.456  -7.033
  115   2HG1  ILE  20          1HG1      ILE  20 -12.742  -1.488  -8.428
  116   1HG2  ILE  20          1HG2      ILE  20  -9.576  -1.304  -6.300
  117   2HG2  ILE  20          2HG2      ILE  20 -11.004  -1.625  -5.319
  118   3HG2  ILE  20          3HG2      ILE  20 -10.285  -0.014  -5.332
  119   1HD1  ILE  20          1HD1      ILE  20 -10.000  -2.702  -7.959
  120   2HD1  ILE  20          2HD1      ILE  20 -10.432  -1.674  -9.328
  121   3HD1  ILE  20          3HD1      ILE  20 -11.193  -3.254  -9.135
  122    H    PHE  21           H        PHE  21 -11.486   2.514  -7.336
  123    HA   PHE  21           HA       PHE  21 -10.383   3.395  -4.812
  124   1HB   PHE  21          2HB       PHE  21  -9.214   4.278  -6.598
  125   2HB   PHE  21          1HB       PHE  21 -10.638   4.300  -7.635
  126    HD1  PHE  21           HD1      PHE  21  -8.476   6.246  -5.523
  127    HD2  PHE  21           HD2      PHE  21 -12.426   6.082  -7.197
  128    HE1  PHE  21           HE1      PHE  21  -8.760   8.672  -5.090
  129    HE2  PHE  21           HE2      PHE  21 -12.712   8.506  -6.765
  130    HZ   PHE  21           HZ       PHE  21 -10.882   9.800  -5.712
  131    H    ASP  22           H        ASP  22 -13.286   4.086  -6.697
  132    HA   ASP  22           HA       ASP  22 -14.258   6.072  -4.744
  133   1HB   ASP  22          2HB       ASP  22 -14.604   6.466  -7.109
  134   2HB   ASP  22          1HB       ASP  22 -15.332   4.871  -7.312
  135    H    SER  23           H        SER  23 -14.109   2.776  -4.778
  136    HA   SER  23           HA       SER  23 -16.848   2.238  -3.787
  137   1HB   SER  23          2HB       SER  23 -14.516   0.779  -4.815
  138   2HB   SER  23          1HB       SER  23 -15.256  -0.014  -3.428
  139    HG   SER  23           HG       SER  23 -16.452  -0.729  -5.080
  140    H    LEU  24           H        LEU  24 -13.935   3.396  -2.599
  141    HA   LEU  24           HA       LEU  24 -14.376   2.313   0.156
  142   1HB   LEU  24          2HB       LEU  24 -11.999   3.955  -0.560
  143   2HB   LEU  24          1HB       LEU  24 -12.091   2.500   0.425
  144    HG   LEU  24           HG       LEU  24 -12.376   2.510  -2.588
  145   1HD1  LEU  24          1HD1      LEU  24  -9.953   1.409  -1.285
  146   2HD1  LEU  24          2HD1      LEU  24 -10.092   3.165  -1.273
  147   3HD1  LEU  24          3HD1      LEU  24 -10.109   2.289  -2.805
  148   1HD2  LEU  24          1HD2      LEU  24 -13.326   0.604  -1.163
  149   2HD2  LEU  24          2HD2      LEU  24 -11.657   0.255  -0.712
  150   3HD2  LEU  24          3HD2      LEU  24 -12.157   0.139  -2.399
  151    H    SER  25           H        SER  25 -14.893   5.007  -1.805
  152    HA   SER  25           HA       SER  25 -15.955   7.069  -1.211
  153   1HB   SER  25          2HB       SER  25 -14.990   6.700   1.616
  154   2HB   SER  25          1HB       SER  25 -16.440   7.519   1.043
  155    HG   SER  25           HG       SER  25 -16.629   5.306   2.006
  156    HA   PRO  26           HA       PRO  26 -11.740   8.690  -1.683
  157   1HB   PRO  26          2HB       PRO  26 -12.442  10.501  -3.602
  158   2HB   PRO  26          1HB       PRO  26 -12.106   8.797  -3.968
  159   1HG   PRO  26          2HG       PRO  26 -14.718  10.185  -3.644
  160   2HG   PRO  26          1HG       PRO  26 -14.238   8.946  -4.814
  161   1HD   PRO  26          2HD       PRO  26 -15.724   8.408  -2.601
  162   2HD   PRO  26          1HD       PRO  26 -14.626   7.225  -3.343
  163    H    VAL  27           H        VAL  27 -10.895  10.626  -0.867
  164    HA   VAL  27           HA       VAL  27 -12.879  12.492   0.379
  165    HB   VAL  27           HB       VAL  27 -10.004  11.841   1.115
  166   1HG1  VAL  27          1HG1      VAL  27 -10.282  13.224   2.978
  167   2HG1  VAL  27          2HG1      VAL  27 -12.042  13.117   2.919
  168   3HG1  VAL  27          3HG1      VAL  27 -11.179  14.113   1.745
  169   1HG2  VAL  27          1HG2      VAL  27 -10.815  10.006   2.145
  170   2HG2  VAL  27          2HG2      VAL  27 -12.420  10.361   1.502
  171   3HG2  VAL  27          3HG2      VAL  27 -11.932  11.014   3.067
  172    H    ASN  28           H        ASN  28 -13.033  13.982  -1.353
  173    HA   ASN  28           HA       ASN  28 -12.353  15.878  -2.591
  174   1HB   ASN  28          2HB       ASN  28 -11.194  16.260  -0.332
  175   2HB   ASN  28          1HB       ASN  28  -9.743  15.597  -1.083
  176   1HD2  ASN  28          1HD2      ASN  28  -9.166  16.701  -3.281
  177   2HD2  ASN  28          2HD2      ASN  28  -9.382  18.384  -3.360
  178    H    GLY  29           H        GLY  29 -11.314  12.852  -2.961
  179   1HA   GLY  29          2HA       GLY  29 -10.619  12.110  -5.208
  180   2HA   GLY  29          1HA       GLY  29  -9.592  13.541  -5.300
  181    H    PHE  30           H        PHE  30  -9.794  11.621  -2.370
  182    HA   PHE  30           HA       PHE  30  -7.136  10.401  -2.971
  183   1HB   PHE  30          2HB       PHE  30  -7.927  12.062  -0.562
  184   2HB   PHE  30          1HB       PHE  30  -6.388  11.203  -0.722
  185    HD1  PHE  30           HD1      PHE  30  -7.587  14.349  -0.859
  186    HD2  PHE  30           HD2      PHE  30  -5.595  11.554  -3.428
  187    HE1  PHE  30           HE1      PHE  30  -6.697  16.232  -2.204
  188    HE2  PHE  30           HE2      PHE  30  -4.701  13.435  -4.784
  189    HZ   PHE  30           HZ       PHE  30  -5.252  15.776  -4.170
  190    H    LEU  31           H        LEU  31  -6.824   8.420  -2.054
  191    HA   LEU  31           HA       LEU  31  -9.006   7.355  -0.283
  192   1HB   LEU  31          2HB       LEU  31  -7.239   6.155  -2.413
  193   2HB   LEU  31          1HB       LEU  31  -7.912   5.122  -1.152
  194    HG   LEU  31           HG       LEU  31  -9.369   6.695  -3.262
  195   1HD1  LEU  31          1HD1      LEU  31  -9.147   4.568  -4.070
  196   2HD1  LEU  31          2HD1      LEU  31 -10.518   4.247  -3.005
  197   3HD1  LEU  31          3HD1      LEU  31  -8.877   3.889  -2.462
  198   1HD2  LEU  31          1HD2      LEU  31 -10.428   5.628  -0.629
  199   2HD2  LEU  31          2HD2      LEU  31 -11.466   5.934  -2.022
  200   3HD2  LEU  31          3HD2      LEU  31 -10.590   7.265  -1.267
  201    H    SER  32           H        SER  32  -8.324   6.515   1.689
  202    HA   SER  32           HA       SER  32  -5.500   7.029   2.397
  203   1HB   SER  32          2HB       SER  32  -6.308   7.009   4.621
  204   2HB   SER  32          1HB       SER  32  -7.643   7.698   3.701
  205    HG   SER  32           HG       SER  32  -8.163   5.935   5.200
  206    H    GLY  33           H        GLY  33  -4.076   5.431   3.064
  207   1HA   GLY  33          2HA       GLY  33  -4.081   2.902   1.939
  208   2HA   GLY  33          1HA       GLY  33  -3.302   3.225   3.490
  209    H    ASP  34           H        ASP  34  -5.917   4.002   4.700
  210    HA   ASP  34           HA       ASP  34  -6.688   1.487   5.819
  211   1HB   ASP  34          2HB       ASP  34  -8.198   4.118   5.647
  212   2HB   ASP  34          1HB       ASP  34  -8.461   2.848   6.842
  213    H    LYS  35           H        LYS  35  -7.761   3.236   2.963
  214    HA   LYS  35           HA       LYS  35 -10.105   1.451   2.609
  215   1HB   LYS  35          2HB       LYS  35  -8.978   3.928   1.280
  216   2HB   LYS  35          1HB       LYS  35 -10.326   3.035   0.577
  217   1HG   LYS  35          2HG       LYS  35 -11.579   3.303   2.710
  218   2HG   LYS  35          1HG       LYS  35 -10.246   4.268   3.345
  219   1HD   LYS  35          2HD       LYS  35 -10.556   5.749   1.261
  220   2HD   LYS  35          1HD       LYS  35 -12.104   4.928   1.060
  221   1HE   LYS  35          2HE       LYS  35 -13.024   6.284   2.620
  222   2HE   LYS  35          1HE       LYS  35 -11.837   5.719   3.813
  223   1HZ   LYS  35          1HZ       LYS  35 -10.323   7.346   3.208
  224   2HZ   LYS  35          2HZ       LYS  35 -11.797   8.186   3.133
  225   3HZ   LYS  35          3HZ       LYS  35 -11.058   7.633   1.707
  226    H    VAL  36           H        VAL  36  -6.955   2.268   1.251
  227    HA   VAL  36           HA       VAL  36  -7.161   0.442  -1.017
  228    HB   VAL  36           HB       VAL  36  -4.837   1.827   0.340
  229   1HG1  VAL  36          1HG1      VAL  36  -4.725  -0.234  -1.470
  230   2HG1  VAL  36          2HG1      VAL  36  -3.466   0.975  -1.242
  231   3HG1  VAL  36          3HG1      VAL  36  -4.664   1.183  -2.520
  232   1HG2  VAL  36          1HG2      VAL  36  -6.910   3.078  -0.795
  233   2HG2  VAL  36          2HG2      VAL  36  -6.000   2.708  -2.262
  234   3HG2  VAL  36          3HG2      VAL  36  -5.259   3.669  -0.983
  235    H    LYS  37           H        LYS  37  -5.354   0.439   2.063
  236    HA   LYS  37           HA       LYS  37  -3.869  -1.814   2.027
  237   1HB   LYS  37          2HB       LYS  37  -3.996  -0.579   4.030
  238   2HB   LYS  37          1HB       LYS  37  -5.750  -0.722   4.112
  239   1HG   LYS  37          2HG       LYS  37  -5.662  -2.957   4.839
  240   2HG   LYS  37          1HG       LYS  37  -4.015  -3.180   4.251
  241   1HD   LYS  37          2HD       LYS  37  -3.130  -1.759   6.001
  242   2HD   LYS  37          1HD       LYS  37  -4.756  -1.317   6.524
  243   1HE   LYS  37          2HE       LYS  37  -3.811  -4.196   6.507
  244   2HE   LYS  37          1HE       LYS  37  -3.616  -3.139   7.920
  245   1HZ   LYS  37          1HZ       LYS  37  -6.124  -2.595   7.255
  246   2HZ   LYS  37          2HZ       LYS  37  -5.713  -3.827   8.349
  247   3HZ   LYS  37          3HZ       LYS  37  -6.050  -4.207   6.729
  248    HA   PRO  38           HA       PRO  38  -7.560  -4.793   2.848
  249   1HB   PRO  38          2HB       PRO  38 -10.078  -3.784   2.426
  250   2HB   PRO  38          1HB       PRO  38  -9.277  -3.761   4.011
  251   1HG   PRO  38          2HG       PRO  38  -9.509  -1.587   1.977
  252   2HG   PRO  38          1HG       PRO  38  -9.692  -1.505   3.739
  253   1HD   PRO  38          2HD       PRO  38  -7.437  -0.709   2.514
  254   2HD   PRO  38          1HD       PRO  38  -7.416  -1.489   4.112
  255    H    VAL  39           H        VAL  39  -8.048  -2.284   0.400
  256    HA   VAL  39           HA       VAL  39  -9.280  -3.889  -1.620
  257    HB   VAL  39           HB       VAL  39  -7.734  -1.329  -1.409
  258   1HG1  VAL  39          1HG1      VAL  39  -7.822  -2.955  -3.815
  259   2HG1  VAL  39          2HG1      VAL  39  -6.983  -1.430  -3.526
  260   3HG1  VAL  39          3HG1      VAL  39  -8.666  -1.431  -4.051
  261   1HG2  VAL  39          1HG2      VAL  39 -10.283  -1.495  -2.877
  262   2HG2  VAL  39          2HG2      VAL  39  -9.793  -0.397  -1.588
  263   3HG2  VAL  39          3HG2      VAL  39 -10.378  -2.013  -1.194
  264    H    LEU  40           H        LEU  40  -5.897  -3.418  -0.686
  265    HA   LEU  40           HA       LEU  40  -4.914  -4.924  -3.033
  266   1HB   LEU  40          2HB       LEU  40  -3.387  -3.956  -0.607
  267   2HB   LEU  40          1HB       LEU  40  -2.770  -4.238  -2.232
  268    HG   LEU  40           HG       LEU  40  -4.859  -2.154  -1.580
  269   1HD1  LEU  40          1HD1      LEU  40  -3.051  -1.164  -0.565
  270   2HD1  LEU  40          2HD1      LEU  40  -2.668  -0.726  -2.230
  271   3HD1  LEU  40          3HD1      LEU  40  -1.884  -2.119  -1.481
  272   1HD2  LEU  40          1HD2      LEU  40  -3.064  -2.315  -3.996
  273   2HD2  LEU  40          2HD2      LEU  40  -4.591  -1.450  -3.818
  274   3HD2  LEU  40          3HD2      LEU  40  -4.583  -3.210  -3.937
  275    H    LEU  41           H        LEU  41  -5.662  -5.459   0.350
  276    HA   LEU  41           HA       LEU  41  -4.149  -7.932   0.617
  277   1HB   LEU  41          2HB       LEU  41  -6.449  -6.653   2.125
  278   2HB   LEU  41          1HB       LEU  41  -5.621  -8.113   2.666
  279    HG   LEU  41           HG       LEU  41  -4.083  -5.614   2.010
  280   1HD1  LEU  41          1HD1      LEU  41  -5.751  -6.238   4.402
  281   2HD1  LEU  41          2HD1      LEU  41  -5.367  -4.675   3.679
  282   3HD1  LEU  41          3HD1      LEU  41  -4.173  -5.501   4.684
  283   1HD2  LEU  41          1HD2      LEU  41  -3.132  -7.240   4.199
  284   2HD2  LEU  41          2HD2      LEU  41  -2.336  -6.891   2.663
  285   3HD2  LEU  41          3HD2      LEU  41  -3.445  -8.260   2.793
  286    H    ASN  42           H        ASN  42  -7.035  -7.017  -0.952
  287    HA   ASN  42           HA       ASN  42  -8.377  -9.605  -0.667
  288   1HB   ASN  42          2HB       ASN  42  -9.163  -7.037  -1.144
  289   2HB   ASN  42          1HB       ASN  42  -9.154  -7.677  -2.788
  290   1HD2  ASN  42          1HD2      ASN  42 -11.643  -7.191  -2.266
  291   2HD2  ASN  42          2HD2      ASN  42 -12.519  -8.515  -1.665
  292    H    SER  43           H        SER  43  -5.836  -8.392  -2.530
  293    HA   SER  43           HA       SER  43  -6.389  -9.886  -5.000
  294   1HB   SER  43          2HB       SER  43  -4.697  -8.566  -5.796
  295   2HB   SER  43          1HB       SER  43  -4.975  -7.655  -4.316
  296    HG   SER  43           HG       SER  43  -2.872  -8.125  -4.194
  297    H    LYS  44           H        LYS  44  -5.825 -11.101  -2.113
  298    HA   LYS  44           HA       LYS  44  -4.789 -13.073  -1.320
  299   1HB   LYS  44          2HB       LYS  44  -5.789 -13.531  -3.788
  300   2HB   LYS  44          1HB       LYS  44  -4.080 -13.835  -4.109
  301   1HG   LYS  44          2HG       LYS  44  -3.974 -15.614  -2.598
  302   2HG   LYS  44          1HG       LYS  44  -5.383 -15.057  -1.693
  303   1HD   LYS  44          2HD       LYS  44  -5.781 -17.089  -3.171
  304   2HD   LYS  44          1HD       LYS  44  -6.882 -15.737  -3.439
  305   1HE   LYS  44          2HE       LYS  44  -4.478 -15.476  -5.071
  306   2HE   LYS  44          1HE       LYS  44  -5.337 -16.993  -5.403
  307   1HZ   LYS  44          1HZ       LYS  44  -6.977 -14.621  -4.998
  308   2HZ   LYS  44          2HZ       LYS  44  -7.192 -15.916  -6.078
  309   3HZ   LYS  44          3HZ       LYS  44  -6.092 -14.672  -6.443
  310    H    LEU  45           H        LEU  45  -3.175 -10.559  -2.166
  311    HA   LEU  45           HA       LEU  45  -0.515 -11.810  -2.670
  312   1HB   LEU  45          2HB       LEU  45  -1.775  -9.097  -2.904
  313   2HB   LEU  45          1HB       LEU  45  -0.022  -9.205  -2.744
  314    HG   LEU  45           HG       LEU  45  -1.681 -10.629  -4.845
  315   1HD1  LEU  45          1HD1      LEU  45  -1.186  -8.921  -6.290
  316   2HD1  LEU  45          2HD1      LEU  45   0.376  -8.605  -5.542
  317   3HD1  LEU  45          3HD1      LEU  45  -1.096  -7.983  -4.801
  318   1HD2  LEU  45          1HD2      LEU  45   0.794 -11.347  -3.808
  319   2HD2  LEU  45          2HD2      LEU  45   1.223 -10.375  -5.214
  320   3HD2  LEU  45          3HD2      LEU  45   0.189 -11.792  -5.404
  321    HA   PRO  46           HA       PRO  46   0.629 -11.245   1.527
  322   1HB   PRO  46          2HB       PRO  46   3.345 -11.083   1.241
  323   2HB   PRO  46          1HB       PRO  46   2.443 -12.599   1.066
  324   1HG   PRO  46          2HG       PRO  46   3.585 -10.829  -1.009
  325   2HG   PRO  46          1HG       PRO  46   3.407 -12.589  -0.992
  326   1HD   PRO  46          2HD       PRO  46   1.759 -10.847  -2.360
  327   2HD   PRO  46          1HD       PRO  46   1.331 -12.505  -1.905
  328    H    VAL  47           H        VAL  47   2.209  -9.676   2.825
  329    HA   VAL  47           HA       VAL  47   1.417  -6.953   2.223
  330    HB   VAL  47           HB       VAL  47   2.954  -8.479   4.308
  331   1HG1  VAL  47          1HG1      VAL  47   3.602  -6.490   5.484
  332   2HG1  VAL  47          2HG1      VAL  47   2.754  -5.460   4.336
  333   3HG1  VAL  47          3HG1      VAL  47   4.210  -6.319   3.840
  334   1HG2  VAL  47          1HG2      VAL  47   0.337  -7.846   4.025
  335   2HG2  VAL  47          2HG2      VAL  47   0.887  -6.452   4.954
  336   3HG2  VAL  47          3HG2      VAL  47   1.107  -8.081   5.593
  337    H    ASP  48           H        ASP  48   3.842  -8.923   1.004
  338    HA   ASP  48           HA       ASP  48   5.984  -6.924   0.884
  339   1HB   ASP  48          2HB       ASP  48   6.179  -9.479   1.041
  340   2HB   ASP  48          1HB       ASP  48   5.706  -9.511  -0.658
  341    H    ILE  49           H        ILE  49   3.439  -8.221  -1.200
  342    HA   ILE  49           HA       ILE  49   4.345  -6.736  -3.563
  343    HB   ILE  49           HB       ILE  49   1.607  -7.917  -3.086
  344   1HG1  ILE  49          2HG1      ILE  49   3.157  -9.624  -2.324
  345   2HG1  ILE  49          1HG1      ILE  49   2.568 -10.078  -3.923
  346   1HG2  ILE  49          1HG2      ILE  49   1.559  -7.066  -5.210
  347   2HG2  ILE  49          2HG2      ILE  49   2.351  -8.594  -5.594
  348   3HG2  ILE  49          3HG2      ILE  49   3.311  -7.129  -5.385
  349   1HD1  ILE  49          1HD1      ILE  49   4.647  -8.827  -4.820
  350   2HD1  ILE  49          2HD1      ILE  49   4.889 -10.410  -4.077
  351   3HD1  ILE  49          3HD1      ILE  49   5.249  -8.943  -3.165
  352    H    LEU  50           H        LEU  50   1.846  -6.512  -1.087
  353    HA   LEU  50           HA       LEU  50   0.597  -4.115  -2.124
  354   1HB   LEU  50          2HB       LEU  50   0.665  -5.197   0.705
  355   2HB   LEU  50          1HB       LEU  50  -0.597  -4.210  -0.031
  356    HG   LEU  50           HG       LEU  50   0.142  -7.040  -0.809
  357   1HD1  LEU  50          1HD1      LEU  50  -2.290  -5.832   0.523
  358   2HD1  LEU  50          2HD1      LEU  50  -1.146  -6.968   1.238
  359   3HD1  LEU  50          3HD1      LEU  50  -2.207  -7.491  -0.071
  360   1HD2  LEU  50          1HD2      LEU  50  -1.049  -4.965  -2.358
  361   2HD2  LEU  50          2HD2      LEU  50  -2.312  -6.125  -1.955
  362   3HD2  LEU  50          3HD2      LEU  50  -0.855  -6.663  -2.787
  363    H    GLY  51           H        GLY  51   3.324  -4.837  -0.047
  364   1HA   GLY  51          2HA       GLY  51   3.595  -2.178   1.086
  365   2HA   GLY  51          1HA       GLY  51   4.858  -3.414   1.051
  366    H    ARG  52           H        ARG  52   4.423  -3.726  -1.876
  367    HA   ARG  52           HA       ARG  52   6.109  -1.430  -2.747
  368   1HB   ARG  52          2HB       ARG  52   5.809  -4.299  -3.347
  369   2HB   ARG  52          1HB       ARG  52   6.054  -3.287  -4.769
  370   1HG   ARG  52          2HG       ARG  52   8.012  -2.231  -3.542
  371   2HG   ARG  52          1HG       ARG  52   7.838  -3.508  -2.338
  372   1HD   ARG  52          2HD       ARG  52   7.917  -4.412  -5.172
  373   2HD   ARG  52          1HD       ARG  52   9.436  -3.783  -4.504
  374    HE   ARG  52           HE       ARG  52   7.874  -6.043  -3.323
  375   1HH1  ARG  52          1HH2      ARG  52  10.469  -6.689  -4.546
  376   2HH1  ARG  52          2HH2      ARG  52  11.566  -6.613  -3.209
  377   1HH2  ARG  52          2HH1      ARG  52   9.387  -4.828  -1.185
  378   2HH2  ARG  52          1HH1      ARG  52  10.952  -5.560  -1.302
  379    H    VAL  53           H        VAL  53   3.059  -3.104  -3.382
  380    HA   VAL  53           HA       VAL  53   2.454  -1.749  -5.857
  381    HB   VAL  53           HB       VAL  53   0.948  -3.242  -3.723
  382   1HG1  VAL  53          1HG1      VAL  53  -0.490  -1.359  -4.678
  383   2HG1  VAL  53          2HG1      VAL  53  -1.121  -2.988  -4.897
  384   3HG1  VAL  53          3HG1      VAL  53  -0.337  -2.161  -6.242
  385   1HG2  VAL  53          1HG2      VAL  53   0.975  -3.887  -6.648
  386   2HG2  VAL  53          2HG2      VAL  53   0.982  -4.976  -5.258
  387   3HG2  VAL  53          3HG2      VAL  53   2.459  -4.133  -5.726
  388    H    TRP  54           H        TRP  54   1.854  -1.009  -2.432
  389    HA   TRP  54           HA       TRP  54   0.229   1.336  -3.024
  390   1HB   TRP  54          2HB       TRP  54  -0.140   0.358  -0.901
  391   2HB   TRP  54          1HB       TRP  54   1.588   0.180  -0.584
  392    HD1  TRP  54           HD1      TRP  54   2.987   2.474  -0.187
  393    HE1  TRP  54           HE1      TRP  54   2.263   4.710   0.841
  394    HE3  TRP  54           HE3      TRP  54  -2.085   1.965  -0.471
  395    HZ2  TRP  54           HZ2      TRP  54  -0.155   6.098   1.493
  396    HZ3  TRP  54           HZ3      TRP  54  -3.574   3.766   0.364
  397    HH2  TRP  54           HH2      TRP  54  -2.614   5.821   1.348
  398    H    GLU  55           H        GLU  55   3.604   0.894  -1.820
  399    HA   GLU  55           HA       GLU  55   4.295   3.648  -1.803
  400   1HB   GLU  55          2HB       GLU  55   5.953   1.177  -2.393
  401   2HB   GLU  55          1HB       GLU  55   6.616   2.753  -1.962
  402   1HG   GLU  55          2HG       GLU  55   5.202   2.637   0.147
  403   2HG   GLU  55          1HG       GLU  55   4.897   0.949  -0.258
  404    H    LEU  56           H        LEU  56   4.967   1.235  -4.333
  405    HA   LEU  56           HA       LEU  56   5.904   3.066  -6.304
  406   1HB   LEU  56          2HB       LEU  56   4.450   0.406  -6.547
  407   2HB   LEU  56          1HB       LEU  56   5.451   1.136  -7.803
  408    HG   LEU  56           HG       LEU  56   6.589   0.702  -5.052
  409   1HD1  LEU  56          1HD1      LEU  56   7.418  -1.443  -6.682
  410   2HD1  LEU  56          2HD1      LEU  56   5.661  -1.373  -6.829
  411   3HD1  LEU  56          3HD1      LEU  56   6.407  -1.524  -5.237
  412   1HD2  LEU  56          1HD2      LEU  56   8.547   0.180  -6.879
  413   2HD2  LEU  56          2HD2      LEU  56   8.222   1.787  -6.233
  414   3HD2  LEU  56          3HD2      LEU  56   7.546   1.312  -7.788
  415    H    SER  57           H        SER  57   2.770   2.485  -5.018
  416    HA   SER  57           HA       SER  57   1.336   3.688  -7.335
  417   1HB   SER  57          2HB       SER  57   0.195   1.848  -6.374
  418   2HB   SER  57          1HB       SER  57   0.608   2.339  -4.734
  419    HG   SER  57           HG       SER  57  -1.226   3.538  -6.533
  420    H    ASP  58           H        ASP  58   2.545   4.387  -4.145
  421    HA   ASP  58           HA       ASP  58   0.998   6.784  -3.626
  422   1HB   ASP  58          2HB       ASP  58   2.487   5.079  -2.169
  423   2HB   ASP  58          1HB       ASP  58   3.700   6.326  -2.450
  424    H    ILE  59           H        ILE  59   1.237   8.275  -5.351
  425    HA   ILE  59           HA       ILE  59   3.916   8.921  -6.392
  426    HB   ILE  59           HB       ILE  59   1.262  10.281  -6.919
  427   1HG1  ILE  59          2HG1      ILE  59   1.041   7.806  -7.154
  428   2HG1  ILE  59          1HG1      ILE  59   0.904   8.638  -8.704
  429   1HG2  ILE  59          1HG2      ILE  59   3.825   9.910  -8.489
  430   2HG2  ILE  59          2HG2      ILE  59   3.171  11.423  -7.862
  431   3HG2  ILE  59          3HG2      ILE  59   2.347  10.582  -9.176
  432   1HD1  ILE  59          1HD1      ILE  59   2.524   7.252  -9.448
  433   2HD1  ILE  59          2HD1      ILE  59   2.903   6.703  -7.816
  434   3HD1  ILE  59          3HD1      ILE  59   3.640   8.179  -8.443
  435    H    ASP  60           H        ASP  60   1.433  10.413  -4.330
  436    HA   ASP  60           HA       ASP  60   3.167  12.796  -3.940
  437   1HB   ASP  60          2HB       ASP  60   1.157  13.823  -3.836
  438   2HB   ASP  60          1HB       ASP  60   0.392  12.270  -4.146
  439    H    HIS  61           H        HIS  61   2.489   9.789  -2.485
  440    HA   HIS  61           HA       HIS  61   3.163   8.845  -0.432
  441   1HB   HIS  61          2HB       HIS  61   4.913  11.301  -0.676
  442   2HB   HIS  61          1HB       HIS  61   5.113  10.117   0.614
  443    HD1  HIS  61           HD1      HIS  61   7.526  10.016  -0.871
  444    HD2  HIS  61           HD2      HIS  61   4.146   8.142  -2.435
  445    HE1  HIS  61           HE1      HIS  61   8.362   8.332  -2.569
  446    H    ASP  62           H        ASP  62   0.764  10.352  -0.272
  447    HA   ASP  62           HA       ASP  62   1.061  11.870   2.294
  448   1HB   ASP  62          2HB       ASP  62  -1.023  12.922   1.654
  449   2HB   ASP  62          1HB       ASP  62   0.018  12.919   0.231
  450    H    GLY  63           H        GLY  63   0.989   8.867   1.966
  451   1HA   GLY  63          2HA       GLY  63  -0.020   7.054   3.064
  452   2HA   GLY  63          1HA       GLY  63  -0.752   8.244   4.142
  453    H    MET  64           H        MET  64  -1.228   8.317   0.660
  454    HA   MET  64           HA       MET  64  -3.909   7.076   0.909
  455   1HB   MET  64          2HB       MET  64  -3.393   9.964   0.139
  456   2HB   MET  64          1HB       MET  64  -4.936   9.144  -0.066
  457   1HG   MET  64          2HG       MET  64  -5.126   8.800   2.321
  458   2HG   MET  64          1HG       MET  64  -3.521   9.478   2.587
  459   1HE   MET  64          1HE       MET  64  -7.363  11.561   1.270
  460   2HE   MET  64          2HE       MET  64  -7.303  10.241   2.435
  461   3HE   MET  64          3HE       MET  64  -6.770   9.968   0.779
  462    H    LEU  65           H        LEU  65  -4.903   6.756  -1.230
  463    HA   LEU  65           HA       LEU  65  -2.915   6.858  -3.472
  464   1HB   LEU  65          2HB       LEU  65  -5.027   4.875  -2.624
  465   2HB   LEU  65          1HB       LEU  65  -4.486   4.927  -4.301
  466    HG   LEU  65           HG       LEU  65  -2.803   4.392  -1.841
  467   1HD1  LEU  65          1HD1      LEU  65  -2.894   2.228  -2.483
  468   2HD1  LEU  65          2HD1      LEU  65  -2.582   2.638  -4.168
  469   3HD1  LEU  65          3HD1      LEU  65  -4.226   2.707  -3.534
  470   1HD2  LEU  65          1HD2      LEU  65  -1.384   5.757  -3.147
  471   2HD2  LEU  65          2HD2      LEU  65  -2.027   5.127  -4.664
  472   3HD2  LEU  65          3HD2      LEU  65  -0.972   4.124  -3.668
  473    H    ASP  66           H        ASP  66  -3.536   8.734  -4.529
  474    HA   ASP  66           HA       ASP  66  -6.251   9.692  -4.671
  475   1HB   ASP  66          2HB       ASP  66  -4.094  10.370  -6.665
  476   2HB   ASP  66          1HB       ASP  66  -5.306  11.426  -5.949
  477    H    ARG  67           H        ARG  67  -7.612   9.760  -6.586
  478    HA   ARG  67           HA       ARG  67  -8.311   7.463  -7.864
  479   1HB   ARG  67          2HB       ARG  67  -9.331   8.850  -9.512
  480   2HB   ARG  67          1HB       ARG  67  -9.217   9.854  -8.068
  481   1HG   ARG  67          2HG       ARG  67  -7.165  10.893  -8.925
  482   2HG   ARG  67          1HG       ARG  67  -7.226   9.861 -10.353
  483   1HD   ARG  67          2HD       ARG  67  -9.775  11.071 -10.179
  484   2HD   ARG  67          1HD       ARG  67  -8.588  12.362  -9.904
  485    HE   ARG  67           HE       ARG  67  -7.608  10.742 -12.017
  486   1HH1  ARG  67          1HH2      ARG  67  -7.999  13.735 -12.154
  487   2HH1  ARG  67          2HH2      ARG  67  -9.180  13.874 -13.413
  488   1HH2  ARG  67          2HH1      ARG  67 -10.104  10.536 -13.282
  489   2HH2  ARG  67          1HH1      ARG  67 -10.372  12.067 -14.049
  490    H    ASP  68           H        ASP  68  -5.637   9.554  -8.928
  491    HA   ASP  68           HA       ASP  68  -4.996   7.832 -11.214
  492   1HB   ASP  68          2HB       ASP  68  -4.679  10.425 -10.758
  493   2HB   ASP  68          1HB       ASP  68  -3.157   9.895 -10.040
  494    H    GLU  69           H        GLU  69  -3.800   8.339  -7.922
  495    HA   GLU  69           HA       GLU  69  -1.447   6.647  -8.240
  496   1HB   GLU  69          2HB       GLU  69  -2.994   7.497  -5.770
  497   2HB   GLU  69          1HB       GLU  69  -1.329   6.922  -5.803
  498   1HG   GLU  69          2HG       GLU  69  -0.968   8.878  -7.507
  499   2HG   GLU  69          1HG       GLU  69  -2.443   9.530  -6.796
  500    H    PHE  70           H        PHE  70  -4.724   6.222  -6.911
  501    HA   PHE  70           HA       PHE  70  -4.466   3.531  -6.010
  502   1HB   PHE  70          2HB       PHE  70  -6.334   5.326  -5.748
  503   2HB   PHE  70          1HB       PHE  70  -6.921   4.738  -7.302
  504    HD1  PHE  70           HD1      PHE  70  -6.726   4.111  -3.744
  505    HD2  PHE  70           HD2      PHE  70  -7.506   2.285  -7.554
  506    HE1  PHE  70           HE1      PHE  70  -7.854   2.221  -2.607
  507    HE2  PHE  70           HE2      PHE  70  -8.632   0.395  -6.415
  508    HZ   PHE  70           HZ       PHE  70  -8.810   0.368  -3.938
  509    H    ALA  71           H        ALA  71  -4.681   4.932  -9.188
  510    HA   ALA  71           HA       ALA  71  -5.587   2.553 -10.584
  511   1HB   ALA  71          1HB       ALA  71  -5.037   3.889 -12.544
  512   2HB   ALA  71          2HB       ALA  71  -3.997   4.940 -11.580
  513   3HB   ALA  71          3HB       ALA  71  -5.745   4.962 -11.336
  514    H    VAL  72           H        VAL  72  -2.404   4.113 -10.173
  515    HA   VAL  72           HA       VAL  72  -0.842   2.212 -11.592
  516    HB   VAL  72           HB       VAL  72  -0.184   3.864  -9.123
  517   1HG1  VAL  72          1HG1      VAL  72   2.128   3.817 -10.337
  518   2HG1  VAL  72          2HG1      VAL  72   1.486   2.391 -11.152
  519   3HG1  VAL  72          3HG1      VAL  72   1.639   2.409  -9.395
  520   1HG2  VAL  72          1HG2      VAL  72   0.466   5.624 -10.651
  521   2HG2  VAL  72          2HG2      VAL  72  -1.162   5.113 -11.109
  522   3HG2  VAL  72          3HG2      VAL  72   0.229   4.568 -12.046
  523    H    ALA  73           H        ALA  73  -2.256   2.132  -8.380
  524    HA   ALA  73           HA       ALA  73  -0.720  -0.269  -7.578
  525   1HB   ALA  73          1HB       ALA  73  -2.805   0.394  -5.768
  526   2HB   ALA  73          2HB       ALA  73  -2.147   1.915  -6.377
  527   3HB   ALA  73          3HB       ALA  73  -1.082   0.744  -5.601
  528    H    MET  74           H        MET  74  -3.579   0.325  -9.335
  529    HA   MET  74           HA       MET  74  -5.098  -1.976  -8.292
  530   1HB   MET  74          2HB       MET  74  -5.364   0.067 -10.495
  531   2HB   MET  74          1HB       MET  74  -6.426  -1.341 -10.475
  532   1HG   MET  74          2HG       MET  74  -6.085   0.263  -7.965
  533   2HG   MET  74          1HG       MET  74  -7.157   0.863  -9.231
  534   1HE   MET  74          1HE       MET  74  -6.863  -2.791  -6.901
  535   2HE   MET  74          2HE       MET  74  -7.783  -1.645  -5.930
  536   3HE   MET  74          3HE       MET  74  -6.237  -1.159  -6.623
  537    H    PHE  75           H        PHE  75  -3.409  -1.185 -11.333
  538    HA   PHE  75           HA       PHE  75  -3.661  -3.894 -12.345
  539   1HB   PHE  75          2HB       PHE  75  -2.579  -2.999 -14.212
  540   2HB   PHE  75          1HB       PHE  75  -3.225  -1.526 -13.492
  541    HD1  PHE  75           HD1      PHE  75  -0.207  -3.651 -13.788
  542    HD2  PHE  75           HD2      PHE  75  -1.788   0.149 -12.586
  543    HE1  PHE  75           HE1      PHE  75   2.095  -2.787 -13.525
  544    HE2  PHE  75           HE2      PHE  75   0.508   1.021 -12.326
  545    HZ   PHE  75           HZ       PHE  75   2.459  -0.457 -12.790
  546    H    LEU  76           H        LEU  76  -1.351  -2.019 -10.480
  547    HA   LEU  76           HA       LEU  76   0.879  -3.784 -10.455
  548   1HB   LEU  76          2HB       LEU  76  -0.266  -1.579  -8.834
  549   2HB   LEU  76          1HB       LEU  76   0.871  -2.625  -7.986
  550    HG   LEU  76           HG       LEU  76   1.441  -1.331 -10.658
  551   1HD1  LEU  76          1HD1      LEU  76   1.329  -0.124  -8.106
  552   2HD1  LEU  76          2HD1      LEU  76   2.024   0.554  -9.578
  553   3HD1  LEU  76          3HD1      LEU  76   3.041  -0.358  -8.462
  554   1HD2  LEU  76          1HD2      LEU  76   3.308  -2.611  -8.641
  555   2HD2  LEU  76          2HD2      LEU  76   3.716  -2.062 -10.266
  556   3HD2  LEU  76          3HD2      LEU  76   2.662  -3.458 -10.045
  557    H    VAL  77           H        VAL  77  -2.257  -3.963  -8.996
  558    HA   VAL  77           HA       VAL  77  -1.457  -6.066  -7.079
  559    HB   VAL  77           HB       VAL  77  -4.003  -4.546  -7.768
  560   1HG1  VAL  77          1HG1      VAL  77  -3.572  -6.986  -6.072
  561   2HG1  VAL  77          2HG1      VAL  77  -4.964  -6.542  -7.058
  562   3HG1  VAL  77          3HG1      VAL  77  -4.702  -5.759  -5.499
  563   1HG2  VAL  77          1HG2      VAL  77  -2.021  -3.559  -6.412
  564   2HG2  VAL  77          2HG2      VAL  77  -2.531  -4.660  -5.132
  565   3HG2  VAL  77          3HG2      VAL  77  -3.640  -3.421  -5.724
  566    H    TYR  78           H        TYR  78  -4.048  -5.759  -9.517
  567    HA   TYR  78           HA       TYR  78  -4.556  -8.502  -9.803
  568   1HB   TYR  78          2HB       TYR  78  -4.909  -6.036 -11.450
  569   2HB   TYR  78          1HB       TYR  78  -5.250  -7.596 -12.203
  570    HD1  TYR  78           HD1      TYR  78  -6.798  -4.999 -10.563
  571    HD2  TYR  78           HD2      TYR  78  -6.469  -9.280 -10.374
  572    HE1  TYR  78           HE1      TYR  78  -8.961  -5.108  -9.358
  573    HE2  TYR  78           HE2      TYR  78  -8.640  -9.393  -9.173
  574    HH   TYR  78           HH       TYR  78 -10.653  -8.052  -8.886
  575    H    CYS  79           H        CYS  79  -1.824  -6.690 -10.928
  576    HA   CYS  79           HA       CYS  79  -1.118  -8.636 -13.026
  577   1HB   CYS  79          2HB       CYS  79   0.157  -6.179 -11.809
  578   2HB   CYS  79          1HB       CYS  79   0.986  -7.159 -13.016
  579    HG   CYS  79           HG       CYS  79  -1.843  -6.182 -13.799
  580    H    ALA  80           H        ALA  80  -0.803  -8.408  -9.638
  581    HA   ALA  80           HA       ALA  80   1.725  -9.938  -9.511
  582   1HB   ALA  80          1HB       ALA  80  -0.062  -8.396  -7.733
  583   2HB   ALA  80          2HB       ALA  80   1.694  -8.563  -7.684
  584   3HB   ALA  80          3HB       ALA  80   0.669  -9.813  -6.978
  585    H    LEU  81           H        LEU  81  -1.693 -10.463  -9.579
  586    HA   LEU  81           HA       LEU  81  -1.500 -13.154  -8.381
  587   1HB   LEU  81          2HB       LEU  81  -3.775 -11.569  -9.608
  588   2HB   LEU  81          1HB       LEU  81  -3.965 -13.134  -8.814
  589    HG   LEU  81           HG       LEU  81  -2.865 -12.076  -6.773
  590   1HD1  LEU  81          1HD1      LEU  81  -3.338  -9.488  -6.865
  591   2HD1  LEU  81          2HD1      LEU  81  -3.158  -9.737  -8.605
  592   3HD1  LEU  81          3HD1      LEU  81  -1.836 -10.148  -7.515
  593   1HD2  LEU  81          1HD2      LEU  81  -5.052 -10.628  -6.378
  594   2HD2  LEU  81          2HD2      LEU  81  -5.157 -12.384  -6.498
  595   3HD2  LEU  81          3HD2      LEU  81  -5.558 -11.377  -7.890
  596    H    GLU  82           H        GLU  82  -2.081 -11.629 -11.509
  597    HA   GLU  82           HA       GLU  82  -2.641 -14.046 -12.961
  598   1HB   GLU  82          2HB       GLU  82  -2.196 -11.191 -13.413
  599   2HB   GLU  82          1HB       GLU  82  -1.555 -12.182 -14.724
  600   1HG   GLU  82          2HG       GLU  82  -4.245 -12.947 -13.733
  601   2HG   GLU  82          1HG       GLU  82  -4.149 -11.403 -14.582
  602    H    LYS  83           H        LYS  83   0.257 -11.973 -13.055
  603    HA   LYS  83           HA       LYS  83   2.168 -14.074 -12.705
  604   1HB   LYS  83          2HB       LYS  83   0.989 -14.758 -14.862
  605   2HB   LYS  83          1HB       LYS  83   1.704 -13.331 -15.603
  606   1HG   LYS  83          2HG       LYS  83   3.200 -15.123 -16.088
  607   2HG   LYS  83          1HG       LYS  83   3.961 -14.209 -14.786
  608   1HD   LYS  83          2HD       LYS  83   2.183 -16.188 -13.671
  609   2HD   LYS  83          1HD       LYS  83   3.310 -16.959 -14.788
  610   1HE   LYS  83          2HE       LYS  83   4.209 -15.010 -12.642
  611   2HE   LYS  83          1HE       LYS  83   4.174 -16.770 -12.406
  612   1HZ   LYS  83          1HZ       LYS  83   5.497 -15.464 -14.719
  613   2HZ   LYS  83          2HZ       LYS  83   5.609 -17.091 -14.245
  614   3HZ   LYS  83          3HZ       LYS  83   6.324 -15.875 -13.297
  615    H    GLU  84           H        GLU  84   1.854 -11.176 -12.114
  616    HA   GLU  84           HA       GLU  84   4.456 -10.265 -13.279
  617   1HB   GLU  84          2HB       GLU  84   1.801  -9.314 -13.853
  618   2HB   GLU  84          1HB       GLU  84   2.712  -8.033 -13.054
  619   1HG   GLU  84          2HG       GLU  84   3.706  -7.620 -15.034
  620   2HG   GLU  84          1HG       GLU  84   4.521  -9.176 -14.868
  621    HA   PRO  85           HA       PRO  85   4.714  -9.535  -8.837
  622   1HB   PRO  85          2HB       PRO  85   7.438  -9.240  -8.822
  623   2HB   PRO  85          1HB       PRO  85   6.636 -10.824  -8.816
  624   1HG   PRO  85          2HG       PRO  85   7.864  -9.333 -11.084
  625   2HG   PRO  85          1HG       PRO  85   7.910 -11.065 -10.715
  626   1HD   PRO  85          2HD       PRO  85   6.268  -9.992 -12.598
  627   2HD   PRO  85          1HD       PRO  85   5.863 -11.458 -11.678
  628    H    VAL  86           H        VAL  86   6.529  -7.711  -7.843
  629    HA   VAL  86           HA       VAL  86   5.954  -5.210  -9.401
  630    HB   VAL  86           HB       VAL  86   5.953  -5.698  -6.401
  631   1HG1  VAL  86          1HG1      VAL  86   5.183  -3.264  -8.046
  632   2HG1  VAL  86          2HG1      VAL  86   6.604  -3.399  -7.011
  633   3HG1  VAL  86          3HG1      VAL  86   4.991  -3.418  -6.299
  634   1HG2  VAL  86          1HG2      VAL  86   4.056  -6.770  -7.547
  635   2HG2  VAL  86          2HG2      VAL  86   3.687  -5.256  -8.372
  636   3HG2  VAL  86          3HG2      VAL  86   3.505  -5.373  -6.623
  637    HA   PRO  87           HA       PRO  87  10.290  -4.565  -8.916
  638   1HB   PRO  87          2HB       PRO  87  10.399  -1.955  -9.706
  639   2HB   PRO  87          1HB       PRO  87  10.130  -3.293 -10.839
  640   1HG   PRO  87          2HG       PRO  87   8.234  -1.294  -9.813
  641   2HG   PRO  87          1HG       PRO  87   8.195  -2.227 -11.315
  642   1HD   PRO  87          2HD       PRO  87   6.716  -2.716  -8.959
  643   2HD   PRO  87          1HD       PRO  87   6.816  -3.756 -10.395
  644    H    MET  88           H        MET  88  11.498  -2.176  -8.131
  645    HA   MET  88           HA       MET  88  10.406  -1.805  -5.358
  646   1HB   MET  88          2HB       MET  88  13.261  -1.892  -6.362
  647   2HB   MET  88          1HB       MET  88  12.774  -1.691  -4.679
  648   1HG   MET  88          2HG       MET  88  11.876  -3.885  -4.561
  649   2HG   MET  88          1HG       MET  88  11.866  -4.062  -6.315
  650   1HE   MET  88          1HE       MET  88  14.457  -4.133  -3.057
  651   2HE   MET  88          2HE       MET  88  14.573  -5.815  -3.568
  652   3HE   MET  88          3HE       MET  88  12.990  -5.064  -3.385
  653    H    SER  89           H        SER  89  10.553  -0.111  -8.140
  654    HA   SER  89           HA       SER  89  10.721   2.432  -6.703
  655   1HB   SER  89          2HB       SER  89  13.067   1.526  -7.206
  656   2HB   SER  89          1HB       SER  89  12.709   1.911  -8.885
  657    HG   SER  89           HG       SER  89  13.776   3.584  -7.517
  658    H    LEU  90           H        LEU  90   9.090   0.828  -8.690
  659    HA   LEU  90           HA       LEU  90   7.555   1.380 -10.420
  660   1HB   LEU  90          2HB       LEU  90   8.243   3.749  -8.888
  661   2HB   LEU  90          1HB       LEU  90   7.871   4.175 -10.558
  662    HG   LEU  90           HG       LEU  90   6.120   2.574  -8.679
  663   1HD1  LEU  90          1HD1      LEU  90   5.545   4.688  -8.071
  664   2HD1  LEU  90          2HD1      LEU  90   4.664   4.700  -9.600
  665   3HD1  LEU  90          3HD1      LEU  90   6.280   5.402  -9.506
  666   1HD2  LEU  90          1HD2      LEU  90   4.722   3.336 -11.011
  667   2HD2  LEU  90          2HD2      LEU  90   5.186   1.703 -10.538
  668   3HD2  LEU  90          3HD2      LEU  90   6.253   2.659 -11.567
  669    HA   PRO  91           HA       PRO  91  10.514   1.641 -13.781
  670   1HB   PRO  91          2HB       PRO  91   8.710   0.922 -15.729
  671   2HB   PRO  91          1HB       PRO  91   9.521  -0.253 -14.671
  672   1HG   PRO  91          2HG       PRO  91   6.784   0.908 -14.453
  673   2HG   PRO  91          1HG       PRO  91   7.321  -0.756 -14.191
  674   1HD   PRO  91          2HD       PRO  91   6.820   0.942 -12.157
  675   2HD   PRO  91          1HD       PRO  91   8.077  -0.312 -12.061
  676    HA   PRO  92           HA       PRO  92   9.602   5.579 -15.452
  677   1HB   PRO  92          2HB       PRO  92  10.330   5.401 -18.085
  678   2HB   PRO  92          1HB       PRO  92  11.500   5.440 -16.750
  679   1HG   PRO  92          2HG       PRO  92  10.497   3.123 -18.321
  680   2HG   PRO  92          1HG       PRO  92  12.122   3.447 -17.700
  681   1HD   PRO  92          2HD       PRO  92  10.372   1.712 -16.523
  682   2HD   PRO  92          1HD       PRO  92  11.650   2.573 -15.638
  683    H    ALA  93           H        ALA  93   7.988   2.875 -16.947
  684    HA   ALA  93           HA       ALA  93   6.152   4.657 -18.460
  685   1HB   ALA  93          1HB       ALA  93   7.172   1.998 -18.672
  686   2HB   ALA  93          2HB       ALA  93   6.119   2.846 -19.806
  687   3HB   ALA  93          3HB       ALA  93   5.418   1.883 -18.500
  688    H    LEU  94           H        LEU  94   6.342   3.883 -15.304
  689    HA   LEU  94           HA       LEU  94   3.390   3.439 -15.056
  690   1HB   LEU  94          2HB       LEU  94   5.806   2.455 -13.582
  691   2HB   LEU  94          1HB       LEU  94   4.276   2.585 -12.711
  692    HG   LEU  94           HG       LEU  94   4.586   0.345 -13.733
  693   1HD1  LEU  94          1HD1      LEU  94   2.368   2.026 -14.951
  694   2HD1  LEU  94          2HD1      LEU  94   2.326   1.264 -13.375
  695   3HD1  LEU  94          3HD1      LEU  94   2.366   0.272 -14.832
  696   1HD2  LEU  94          1HD2      LEU  94   4.184   1.576 -16.434
  697   2HD2  LEU  94          2HD2      LEU  94   4.932   0.043 -16.017
  698   3HD2  LEU  94          3HD2      LEU  94   5.806   1.554 -15.768
  699    H    VAL  95           H        VAL  95   4.822   6.070 -15.226
  700    HA   VAL  95           HA       VAL  95   3.825   7.154 -12.627
  701    HB   VAL  95           HB       VAL  95   5.958   8.790 -13.284
  702   1HG1  VAL  95          1HG1      VAL  95   5.485   6.550 -11.371
  703   2HG1  VAL  95          2HG1      VAL  95   5.801   8.256 -11.051
  704   3HG1  VAL  95          3HG1      VAL  95   7.127   7.182 -11.497
  705   1HG2  VAL  95          1HG2      VAL  95   7.868   7.353 -13.762
  706   2HG2  VAL  95          2HG2      VAL  95   6.664   7.132 -15.030
  707   3HG2  VAL  95          3HG2      VAL  95   6.837   5.922 -13.758
  708    HA   PRO  96           HA       PRO  96   1.686   9.925 -15.264
  709   1HB   PRO  96          2HB       PRO  96   1.451  12.071 -13.555
  710   2HB   PRO  96          1HB       PRO  96   0.460  10.603 -13.423
  711   1HG   PRO  96          2HG       PRO  96   2.925  11.361 -11.915
  712   2HG   PRO  96          1HG       PRO  96   1.421  10.635 -11.319
  713   1HD   PRO  96          2HD       PRO  96   3.623   9.156 -11.741
  714   2HD   PRO  96          1HD       PRO  96   1.992   8.508 -12.062
  715    HA   PRO  97           HA       PRO  97   4.558  12.670 -17.082
  716   1HB   PRO  97          2HB       PRO  97   3.118  14.948 -17.593
  717   2HB   PRO  97          1HB       PRO  97   2.906  13.438 -18.504
  718   1HG   PRO  97          2HG       PRO  97   1.275  14.539 -16.263
  719   2HG   PRO  97          1HG       PRO  97   0.749  13.730 -17.749
  720   1HD   PRO  97          2HD       PRO  97   0.853  12.467 -15.354
  721   2HD   PRO  97          1HD       PRO  97   1.129  11.627 -16.897
  722    H    SER  98           H        SER  98   3.275  13.411 -14.046
  723    HA   SER  98           HA       SER  98   4.814  15.923 -13.734
  724   1HB   SER  98          2HB       SER  98   2.797  14.339 -12.178
  725   2HB   SER  98          1HB       SER  98   3.814  15.484 -11.309
  726    HG   SER  98           HG       SER  98   3.111  16.887 -13.257
  727    H    LYS  99           H        LYS  99   4.928  12.537 -12.863
  728    HA   LYS  99           HA       LYS  99   7.399  12.971 -11.254
  729   1HB   LYS  99          2HB       LYS  99   5.145  11.162 -11.283
  730   2HB   LYS  99          1HB       LYS  99   6.643  10.241 -11.422
  731   1HG   LYS  99          2HG       LYS  99   6.980  12.339  -9.474
  732   2HG   LYS  99          1HG       LYS  99   5.551  11.384  -9.075
  733   1HD   LYS  99          2HD       LYS  99   7.895   9.802  -9.932
  734   2HD   LYS  99          1HD       LYS  99   8.104  10.666  -8.408
  735   1HE   LYS  99          2HE       LYS  99   6.178   9.601  -7.437
  736   2HE   LYS  99          1HE       LYS  99   5.685   8.932  -9.006
  737   1HZ   LYS  99          1HZ       LYS  99   7.823   8.083  -7.221
  738   2HZ   LYS  99          2HZ       LYS  99   8.198   8.084  -8.879
  739   3HZ   LYS  99          3HZ       LYS  99   6.889   7.169  -8.304
  740    H    ARG 100           H        ARG 100   6.842  12.934 -14.376
  741    HA   ARG 100           HA       ARG 100   8.102  10.736 -15.604
  742   1HB   ARG 100          2HB       ARG 100   7.750  13.651 -16.162
  743   2HB   ARG 100          1HB       ARG 100   8.856  12.751 -17.202
  744   1HG   ARG 100          2HG       ARG 100   6.099  11.689 -16.598
  745   2HG   ARG 100          1HG       ARG 100   6.354  12.859 -17.894
  746   1HD   ARG 100          2HD       ARG 100   7.113  11.219 -19.257
  747   2HD   ARG 100          1HD       ARG 100   8.355  10.778 -18.067
  748    HE   ARG 100           HE       ARG 100   6.604   9.395 -16.924
  749   1HH1  ARG 100          1HH2      ARG 100   7.107   8.872 -20.050
  750   2HH1  ARG 100          2HH2      ARG 100   5.509   8.359 -20.478
  751   1HH2  ARG 100          2HH1      ARG 100   4.081   9.432 -17.504
  752   2HH2  ARG 100          1HH1      ARG 100   3.795   8.678 -19.038
  753    H    SER 107           1H       SER 107   3.739   5.448  10.021
  754    HA   SER 107           HA       SER 107   6.253   4.942   8.514
  755   1HB   SER 107          2HB       SER 107   5.709   2.788   9.078
  756   2HB   SER 107          1HB       SER 107   4.062   3.223   9.528
  757    HG   SER 107           HG       SER 107   4.373   1.910   7.555
  758    H    THR 108           H        THR 108   5.520   4.553   6.142
  759    HA   THR 108           HA       THR 108   3.360   6.526   5.471
  760    HB   THR 108           HB       THR 108   5.632   7.208   4.859
  761    HG1  THR 108           HG1      THR 108   4.920   6.530   2.352
  762   1HG2  THR 108          1HG2      THR 108   5.868   4.405   4.238
  763   2HG2  THR 108          2HG2      THR 108   7.141   5.620   4.354
  764   3HG2  THR 108          3HG2      THR 108   6.306   5.362   2.823
  765    H    ASN 109           H        ASN 109   4.074   3.248   5.478
  766    HA   ASN 109           HA       ASN 109   2.171   2.748   3.209
  767   1HB   ASN 109          2HB       ASN 109   4.358   2.106   2.492
  768   2HB   ASN 109          1HB       ASN 109   4.733   1.375   4.053
  769   1HD2  ASN 109          1HD2      ASN 109   2.772   0.946   1.105
  770   2HD2  ASN 109          2HD2      ASN 109   2.492  -0.711   1.332
  771    HA   PRO 110           HA       PRO 110  -0.097   0.660   6.377
  772   1HB   PRO 110          2HB       PRO 110  -1.890  -0.623   4.751
  773   2HB   PRO 110          1HB       PRO 110  -1.986   1.109   5.126
  774   1HG   PRO 110          2HG       PRO 110  -0.973  -0.245   2.687
  775   2HG   PRO 110          1HG       PRO 110  -1.867   1.275   2.852
  776   1HD   PRO 110          2HD       PRO 110   0.842   1.118   2.427
  777   2HD   PRO 110          1HD       PRO 110   0.029   2.497   3.198
  778    H    PHE 111           H        PHE 111   1.556  -0.953   3.759
  779    HA   PHE 111           HA       PHE 111   1.214  -3.621   5.049
  780   1HB   PHE 111          2HB       PHE 111   2.516  -2.736   2.447
  781   2HB   PHE 111          1HB       PHE 111   2.252  -4.412   2.934
  782    HD1  PHE 111           HD1      PHE 111   0.823  -1.567   1.293
  783    HD2  PHE 111           HD2      PHE 111  -0.165  -5.105   3.517
  784    HE1  PHE 111           HE1      PHE 111  -1.491  -1.482   0.403
  785    HE2  PHE 111           HE2      PHE 111  -2.472  -5.021   2.629
  786    HZ   PHE 111           HZ       PHE 111  -3.138  -3.213   1.071
  787    H    LEU 112           HN       LEU 112   2.928  -1.272   6.050
  788    HA   LEU 112           HA       LEU 112   5.555  -2.724   6.131
  789   1HB   LEU 112          2HB       LEU 112   4.769  -0.015   5.458
  790   2HB   LEU 112          1HB       LEU 112   5.892  -0.008   6.818
  791    HG   LEU 112           HG       LEU 112   6.986   0.056   4.532
  792   1HD1  LEU 112          1HD1      LEU 112   7.895  -2.493   5.733
  793   2HD1  LEU 112          2HD1      LEU 112   7.785  -1.135   6.853
  794   3HD1  LEU 112          3HD1      LEU 112   8.800  -1.013   5.415
  795   1HD2  LEU 112          1HD2      LEU 112   5.184  -2.032   4.041
  796   2HD2  LEU 112          2HD2      LEU 112   6.756  -2.823   4.153
  797   3HD2  LEU 112          3HD2      LEU 112   6.505  -1.524   2.988
  Start of MODEL    9
    1    HA   PRO   6           HA       PRO   6   1.351   6.890 -23.360
    2   1HB   PRO   6          2HB       PRO   6   0.084   4.469 -23.226
    3   2HB   PRO   6          1HB       PRO   6   0.326   5.345 -24.752
    4   1HG   PRO   6          2HG       PRO   6   1.841   3.044 -23.632
    5   2HG   PRO   6          1HG       PRO   6   1.381   3.385 -25.307
    6   1HD   PRO   6          2HD       PRO   6   3.886   3.817 -24.304
    7   2HD   PRO   6          1HD       PRO   6   3.198   4.725 -25.668
    8    H    TRP   7           H        TRP   7  -0.199   5.650 -21.496
    9    HA   TRP   7           HA       TRP   7   1.581   5.584 -19.125
   10   1HB   TRP   7          2HB       TRP   7  -0.438   7.011 -19.211
   11   2HB   TRP   7          1HB       TRP   7  -1.438   5.578 -19.441
   12    HD1  TRP   7           HD1      TRP   7   1.429   5.026 -17.161
   13    HE1  TRP   7           HE1      TRP   7   0.628   4.919 -14.715
   14    HE3  TRP   7           HE3      TRP   7  -3.343   6.721 -17.742
   15    HZ2  TRP   7           HZ2      TRP   7  -1.739   5.486 -13.202
   16    HZ3  TRP   7           HZ3      TRP   7  -4.851   6.933 -15.786
   17    HH2  TRP   7           HH2      TRP   7  -4.056   6.319 -13.519
   18    H    ALA   8           H        ALA   8   2.169   3.673 -18.209
   19    HA   ALA   8           HA       ALA   8   1.784   1.114 -19.133
   20   1HB   ALA   8          1HB       ALA   8   3.209   1.914 -17.219
   21   2HB   ALA   8          2HB       ALA   8   2.342   0.416 -16.865
   22   3HB   ALA   8          3HB       ALA   8   1.752   1.948 -16.218
   23    H    VAL   9           H        VAL   9  -0.520   3.009 -17.245
   24    HA   VAL   9           HA       VAL   9  -2.344   0.722 -16.892
   25    HB   VAL   9           HB       VAL   9  -2.365   3.665 -16.197
   26   1HG1  VAL   9          1HG1      VAL   9  -4.662   3.230 -16.578
   27   2HG1  VAL   9          2HG1      VAL   9  -4.456   2.969 -14.846
   28   3HG1  VAL   9          3HG1      VAL   9  -4.543   1.590 -15.941
   29   1HG2  VAL   9          1HG2      VAL   9  -2.248   1.100 -14.579
   30   2HG2  VAL   9          2HG2      VAL   9  -2.355   2.715 -13.880
   31   3HG2  VAL   9          3HG2      VAL   9  -0.933   2.252 -14.815
   32    H    LYS  10           H        LYS  10  -4.538   0.745 -17.799
   33    HA   LYS  10           HA       LYS  10  -4.674   2.185 -20.424
   34   1HB   LYS  10          2HB       LYS  10  -5.810  -0.407 -19.344
   35   2HB   LYS  10          1HB       LYS  10  -6.330   0.281 -20.881
   36   1HG   LYS  10          2HG       LYS  10  -3.394   0.048 -20.434
   37   2HG   LYS  10          1HG       LYS  10  -4.283  -1.450 -20.717
   38   1HD   LYS  10          2HD       LYS  10  -5.245  -0.490 -22.778
   39   2HD   LYS  10          1HD       LYS  10  -4.340   0.999 -22.503
   40   1HE   LYS  10          2HE       LYS  10  -3.147  -1.760 -22.965
   41   2HE   LYS  10          1HE       LYS  10  -3.089  -0.383 -24.085
   42   1HZ   LYS  10          1HZ       LYS  10  -2.071   0.898 -22.197
   43   2HZ   LYS  10          2HZ       LYS  10  -1.084  -0.315 -22.862
   44   3HZ   LYS  10          3HZ       LYS  10  -1.879  -0.577 -21.383
   45    HA   PRO  11           HA       PRO  11  -8.269   4.363 -19.153
   46   1HB   PRO  11          2HB       PRO  11  -9.943   4.088 -21.309
   47   2HB   PRO  11          1HB       PRO  11  -8.517   5.148 -21.319
   48   1HG   PRO  11          2HG       PRO  11  -8.845   2.400 -22.433
   49   2HG   PRO  11          1HG       PRO  11  -8.010   3.804 -23.121
   50   1HD   PRO  11          2HD       PRO  11  -6.685   1.781 -21.915
   51   2HD   PRO  11          1HD       PRO  11  -6.111   3.462 -21.861
   52    H    GLU  12           H        GLU  12  -8.779   1.134 -20.488
   53    HA   GLU  12           HA       GLU  12 -11.406   0.757 -19.289
   54   1HB   GLU  12          2HB       GLU  12 -11.156  -0.664 -21.076
   55   2HB   GLU  12          1HB       GLU  12  -9.403  -0.698 -20.920
   56   1HG   GLU  12          2HG       GLU  12 -10.269  -2.920 -20.455
   57   2HG   GLU  12          1HG       GLU  12  -9.658  -2.225 -18.955
   58    H    ASP  13           H        ASP  13  -8.067   0.289 -18.326
   59    HA   ASP  13           HA       ASP  13  -8.715  -1.383 -16.009
   60   1HB   ASP  13          2HB       ASP  13  -6.282  -0.018 -17.164
   61   2HB   ASP  13          1HB       ASP  13  -6.217  -0.761 -15.566
   62    H    LYS  14           H        LYS  14  -7.835   1.990 -16.670
   63    HA   LYS  14           HA       LYS  14  -7.831   2.873 -13.940
   64   1HB   LYS  14          2HB       LYS  14  -6.802   4.212 -15.635
   65   2HB   LYS  14          1HB       LYS  14  -8.260   4.191 -16.626
   66   1HG   LYS  14          2HG       LYS  14  -7.926   6.355 -15.397
   67   2HG   LYS  14          1HG       LYS  14  -9.449   5.553 -15.008
   68   1HD   LYS  14          2HD       LYS  14  -8.834   5.147 -12.858
   69   2HD   LYS  14          1HD       LYS  14  -7.175   4.748 -13.309
   70   1HE   LYS  14          2HE       LYS  14  -6.994   6.779 -12.063
   71   2HE   LYS  14          1HE       LYS  14  -6.896   7.291 -13.759
   72   1HZ   LYS  14          1HZ       LYS  14  -9.406   7.443 -13.653
   73   2HZ   LYS  14          2HZ       LYS  14  -8.546   8.644 -12.814
   74   3HZ   LYS  14          3HZ       LYS  14  -9.252   7.351 -11.967
   75    H    ALA  15           H        ALA  15 -10.338   2.220 -16.275
   76    HA   ALA  15           HA       ALA  15 -12.469   3.746 -15.069
   77   1HB   ALA  15          1HB       ALA  15 -12.629   1.155 -16.643
   78   2HB   ALA  15          2HB       ALA  15 -12.343   2.724 -17.396
   79   3HB   ALA  15          3HB       ALA  15 -13.856   2.417 -16.544
   80    H    LYS  16           H        LYS  16 -11.418   0.342 -14.755
   81    HA   LYS  16           HA       LYS  16 -13.413  -0.272 -12.731
   82   1HB   LYS  16          2HB       LYS  16 -12.553  -2.403 -12.951
   83   2HB   LYS  16          1HB       LYS  16 -11.929  -1.712 -14.445
   84   1HG   LYS  16          2HG       LYS  16  -9.801  -1.204 -13.338
   85   2HG   LYS  16          1HG       LYS  16 -10.426  -1.854 -11.824
   86   1HD   LYS  16          2HD       LYS  16  -9.318  -3.724 -12.629
   87   2HD   LYS  16          1HD       LYS  16 -10.910  -3.984 -13.341
   88   1HE   LYS  16          2HE       LYS  16 -10.026  -2.657 -15.378
   89   2HE   LYS  16          1HE       LYS  16  -8.414  -2.924 -14.681
   90   1HZ   LYS  16          1HZ       LYS  16 -10.412  -5.077 -15.128
   91   2HZ   LYS  16          2HZ       LYS  16  -8.800  -5.265 -14.625
   92   3HZ   LYS  16          3HZ       LYS  16  -9.144  -4.730 -16.201
   93    H    TYR  17           H        TYR  17 -10.155   1.001 -12.806
   94    HA   TYR  17           HA       TYR  17  -9.494   0.649 -10.015
   95   1HB   TYR  17          2HB       TYR  17  -8.648   2.702 -12.095
   96   2HB   TYR  17          1HB       TYR  17  -7.829   2.439 -10.560
   97    HD1  TYR  17           HD1      TYR  17  -9.001  -0.696 -11.539
   98    HD2  TYR  17           HD2      TYR  17  -5.992   2.196 -12.544
   99    HE1  TYR  17           HE1      TYR  17  -7.634  -2.481 -12.580
  100    HE2  TYR  17           HE2      TYR  17  -4.612   0.412 -13.577
  101    HH   TYR  17           HH       TYR  17  -4.879  -2.665 -13.018
  102    H    ASP  18           H        ASP  18 -11.117   3.161 -11.915
  103    HA   ASP  18           HA       ASP  18 -11.384   5.049  -9.715
  104   1HB   ASP  18          2HB       ASP  18 -11.351   5.790 -12.018
  105   2HB   ASP  18          1HB       ASP  18 -12.688   4.717 -12.438
  106    H    ALA  19           H        ALA  19 -13.027   2.157 -10.544
  107    HA   ALA  19           HA       ALA  19 -15.553   2.981  -9.198
  108   1HB   ALA  19          1HB       ALA  19 -14.560   0.754 -10.921
  109   2HB   ALA  19          2HB       ALA  19 -16.103   1.605 -10.977
  110   3HB   ALA  19          3HB       ALA  19 -15.830   0.350  -9.768
  111    H    ILE  20           H        ILE  20 -12.652   1.103  -8.828
  112    HA   ILE  20           HA       ILE  20 -13.420  -0.141  -6.290
  113    HB   ILE  20           HB       ILE  20 -10.980   0.085  -8.067
  114   1HG1  ILE  20          2HG1      ILE  20 -12.349  -2.426  -7.130
  115   2HG1  ILE  20          1HG1      ILE  20 -13.033  -1.481  -8.454
  116   1HG2  ILE  20          1HG2      ILE  20 -10.587  -0.022  -5.440
  117   2HG2  ILE  20          2HG2      ILE  20  -9.611  -0.971  -6.555
  118   3HG2  ILE  20          3HG2      ILE  20 -10.955  -1.724  -5.699
  119   1HD1  ILE  20          1HD1      ILE  20 -10.219  -2.610  -8.347
  120   2HD1  ILE  20          2HD1      ILE  20 -10.868  -1.625  -9.657
  121   3HD1  ILE  20          3HD1      ILE  20 -11.543  -3.223  -9.338
  122    H    PHE  21           H        PHE  21 -11.639   2.646  -7.502
  123    HA   PHE  21           HA       PHE  21 -10.488   3.445  -4.966
  124   1HB   PHE  21          2HB       PHE  21  -9.353   4.384  -6.742
  125   2HB   PHE  21          1HB       PHE  21 -10.797   4.454  -7.748
  126    HD1  PHE  21           HD1      PHE  21  -8.668   6.259  -5.413
  127    HD2  PHE  21           HD2      PHE  21 -12.484   6.273  -7.384
  128    HE1  PHE  21           HE1      PHE  21  -8.934   8.669  -4.885
  129    HE2  PHE  21           HE2      PHE  21 -12.750   8.679  -6.855
  130    HZ   PHE  21           HZ       PHE  21 -10.980   9.876  -5.606
  131    H    ASP  22           H        ASP  22 -13.425   4.179  -6.770
  132    HA   ASP  22           HA       ASP  22 -14.364   6.106  -4.746
  133   1HB   ASP  22          2HB       ASP  22 -14.822   6.665  -7.010
  134   2HB   ASP  22          1HB       ASP  22 -15.356   5.024  -7.388
  135    H    SER  23           H        SER  23 -14.229   2.805  -4.896
  136    HA   SER  23           HA       SER  23 -16.952   2.239  -3.880
  137   1HB   SER  23          2HB       SER  23 -16.291   0.402  -5.077
  138   2HB   SER  23          1HB       SER  23 -14.584   0.804  -4.914
  139    HG   SER  23           HG       SER  23 -15.745  -1.103  -3.701
  140    H    LEU  24           H        LEU  24 -13.998   3.315  -2.686
  141    HA   LEU  24           HA       LEU  24 -14.432   2.180   0.048
  142   1HB   LEU  24          2HB       LEU  24 -12.027   3.772  -0.742
  143   2HB   LEU  24          1HB       LEU  24 -12.128   2.350   0.293
  144    HG   LEU  24           HG       LEU  24 -12.506   2.293  -2.710
  145   1HD1  LEU  24          1HD1      LEU  24 -10.127   2.736  -1.333
  146   2HD1  LEU  24          2HD1      LEU  24 -10.266   2.112  -2.978
  147   3HD1  LEU  24          3HD1      LEU  24 -10.122   0.996  -1.619
  148   1HD2  LEU  24          1HD2      LEU  24 -13.429   0.493  -0.990
  149   2HD2  LEU  24          2HD2      LEU  24 -11.747  -0.037  -0.993
  150   3HD2  LEU  24          3HD2      LEU  24 -12.667  -0.012  -2.498
  151    H    SER  25           H        SER  25 -14.948   4.899  -1.852
  152    HA   SER  25           HA       SER  25 -15.883   7.000  -1.250
  153   1HB   SER  25          2HB       SER  25 -16.791   7.050   0.826
  154   2HB   SER  25          1HB       SER  25 -16.072   5.464   1.078
  155    HG   SER  25           HG       SER  25 -14.138   6.683   1.718
  156    HA   PRO  26           HA       PRO  26 -11.599   8.425  -1.390
  157   1HB   PRO  26          2HB       PRO  26 -12.035  10.236  -3.382
  158   2HB   PRO  26          1HB       PRO  26 -11.755   8.511  -3.691
  159   1HG   PRO  26          2HG       PRO  26 -14.291  10.047  -3.697
  160   2HG   PRO  26          1HG       PRO  26 -13.790   8.690  -4.714
  161   1HD   PRO  26          2HD       PRO  26 -15.504   8.488  -2.565
  162   2HD   PRO  26          1HD       PRO  26 -14.555   7.142  -3.230
  163    H    VAL  27           H        VAL  27 -10.696  10.394  -0.668
  164    HA   VAL  27           HA       VAL  27 -12.661  12.367   0.442
  165    HB   VAL  27           HB       VAL  27  -9.907  11.571   1.448
  166   1HG1  VAL  27          1HG1      VAL  27 -11.054  13.871   2.003
  167   2HG1  VAL  27          2HG1      VAL  27 -10.331  12.925   3.305
  168   3HG1  VAL  27          3HG1      VAL  27 -12.077  12.892   3.056
  169   1HG2  VAL  27          1HG2      VAL  27 -12.171   9.994   1.470
  170   2HG2  VAL  27          2HG2      VAL  27 -12.277  10.820   3.025
  171   3HG2  VAL  27          3HG2      VAL  27 -10.847   9.869   2.628
  172    H    ASN  28           H        ASN  28 -12.527  14.216  -0.795
  173    HA   ASN  28           HA       ASN  28 -11.569  15.988  -2.034
  174   1HB   ASN  28          2HB       ASN  28 -10.377  16.285   0.093
  175   2HB   ASN  28          1HB       ASN  28  -9.200  15.059  -0.371
  176   1HD2  ASN  28          1HD2      ASN  28  -7.378  15.788  -1.495
  177   2HD2  ASN  28          2HD2      ASN  28  -7.228  17.327  -2.194
  178    H    GLY  29           H        GLY  29 -11.277  12.969  -2.794
  179   1HA   GLY  29          2HA       GLY  29 -10.658  12.118  -4.951
  180   2HA   GLY  29          1HA       GLY  29  -9.541  13.473  -5.138
  181    H    PHE  30           H        PHE  30  -9.771  11.319  -2.330
  182    HA   PHE  30           HA       PHE  30  -7.226   9.997  -3.095
  183   1HB   PHE  30          2HB       PHE  30  -7.666  11.815  -0.721
  184   2HB   PHE  30          1HB       PHE  30  -6.290  10.712  -0.843
  185    HD1  PHE  30           HD1      PHE  30  -7.777  13.814  -2.012
  186    HD2  PHE  30           HD2      PHE  30  -4.676  10.934  -2.715
  187    HE1  PHE  30           HE1      PHE  30  -6.608  15.439  -3.461
  188    HE2  PHE  30           HE2      PHE  30  -3.488  12.569  -4.164
  189    HZ   PHE  30           HZ       PHE  30  -4.456  14.825  -4.537
  190    H    LEU  31           H        LEU  31  -6.853   8.074  -2.019
  191    HA   LEU  31           HA       LEU  31  -9.054   7.116  -0.210
  192   1HB   LEU  31          2HB       LEU  31  -7.297   5.788  -2.274
  193   2HB   LEU  31          1HB       LEU  31  -8.034   4.836  -0.984
  194    HG   LEU  31           HG       LEU  31  -9.448   6.470  -3.097
  195   1HD1  LEU  31          1HD1      LEU  31  -9.116   4.392  -4.035
  196   2HD1  LEU  31          2HD1      LEU  31 -10.558   4.018  -3.090
  197   3HD1  LEU  31          3HD1      LEU  31  -8.960   3.602  -2.463
  198   1HD2  LEU  31          1HD2      LEU  31 -10.677   6.870  -1.073
  199   2HD2  LEU  31          2HD2      LEU  31 -10.475   5.201  -0.545
  200   3HD2  LEU  31          3HD2      LEU  31 -11.528   5.573  -1.913
  201    H    SER  32           H        SER  32  -8.367   6.496   1.828
  202    HA   SER  32           HA       SER  32  -5.547   6.963   2.504
  203   1HB   SER  32          2HB       SER  32  -6.346   6.825   4.747
  204   2HB   SER  32          1HB       SER  32  -7.662   7.573   3.845
  205    HG   SER  32           HG       SER  32  -8.844   5.899   4.282
  206    H    GLY  33           H        GLY  33  -4.101   5.373   3.224
  207   1HA   GLY  33          2HA       GLY  33  -4.053   2.874   2.004
  208   2HA   GLY  33          1HA       GLY  33  -3.270   3.177   3.559
  209    H    ASP  34           H        ASP  34  -5.908   3.916   4.748
  210    HA   ASP  34           HA       ASP  34  -6.638   1.377   5.848
  211   1HB   ASP  34          2HB       ASP  34  -6.913   3.758   6.759
  212   2HB   ASP  34          1HB       ASP  34  -8.338   3.875   5.725
  213    H    LYS  35           H        LYS  35  -7.686   3.106   2.979
  214    HA   LYS  35           HA       LYS  35 -10.009   1.281   2.628
  215   1HB   LYS  35          2HB       LYS  35  -8.993   3.787   1.245
  216   2HB   LYS  35          1HB       LYS  35 -10.417   2.895   0.709
  217   1HG   LYS  35          2HG       LYS  35 -11.431   3.203   2.957
  218   2HG   LYS  35          1HG       LYS  35 -10.026   4.155   3.439
  219   1HD   LYS  35          2HD       LYS  35 -10.512   5.715   1.524
  220   2HD   LYS  35          1HD       LYS  35 -12.006   4.820   1.245
  221   1HE   LYS  35          2HE       LYS  35 -13.050   5.843   2.986
  222   2HE   LYS  35          1HE       LYS  35 -11.657   5.602   4.058
  223   1HZ   LYS  35          1HZ       LYS  35 -12.332   7.981   3.067
  224   2HZ   LYS  35          2HZ       LYS  35 -11.266   7.454   1.854
  225   3HZ   LYS  35          3HZ       LYS  35 -10.738   7.558   3.465
  226    H    VAL  36           H        VAL  36  -6.853   2.159   1.349
  227    HA   VAL  36           HA       VAL  36  -7.064   0.373  -0.974
  228    HB   VAL  36           HB       VAL  36  -4.801   1.920   0.308
  229   1HG1  VAL  36          1HG1      VAL  36  -4.529  -0.209  -1.388
  230   2HG1  VAL  36          2HG1      VAL  36  -3.382   1.122  -1.276
  231   3HG1  VAL  36          3HG1      VAL  36  -4.622   1.134  -2.527
  232   1HG2  VAL  36          1HG2      VAL  36  -6.385   3.469  -0.536
  233   2HG2  VAL  36          2HG2      VAL  36  -6.740   2.462  -1.941
  234   3HG2  VAL  36          3HG2      VAL  36  -5.199   3.313  -1.834
  235    H    LYS  37           H        LYS  37  -5.245   0.426   2.111
  236    HA   LYS  37           HA       LYS  37  -3.685  -1.826   1.958
  237   1HB   LYS  37          2HB       LYS  37  -3.908  -0.331   3.912
  238   2HB   LYS  37          1HB       LYS  37  -5.489  -1.021   4.263
  239   1HG   LYS  37          2HG       LYS  37  -4.199  -3.305   4.254
  240   2HG   LYS  37          1HG       LYS  37  -2.779  -2.291   4.513
  241   1HD   LYS  37          2HD       LYS  37  -3.755  -1.335   6.517
  242   2HD   LYS  37          1HD       LYS  37  -5.281  -2.169   6.222
  243   1HE   LYS  37          2HE       LYS  37  -4.410  -4.256   6.825
  244   2HE   LYS  37          1HE       LYS  37  -2.740  -3.771   6.469
  245   1HZ   LYS  37          1HZ       LYS  37  -2.678  -2.376   8.339
  246   2HZ   LYS  37          2HZ       LYS  37  -3.392  -3.811   8.900
  247   3HZ   LYS  37          3HZ       LYS  37  -4.356  -2.451   8.570
  248    HA   PRO  38           HA       PRO  38  -7.373  -4.741   2.935
  249   1HB   PRO  38          2HB       PRO  38  -9.894  -3.757   2.497
  250   2HB   PRO  38          1HB       PRO  38  -9.087  -3.671   4.076
  251   1HG   PRO  38          2HG       PRO  38  -9.367  -1.571   1.978
  252   2HG   PRO  38          1HG       PRO  38  -9.508  -1.432   3.739
  253   1HD   PRO  38          2HD       PRO  38  -7.292  -0.673   2.398
  254   2HD   PRO  38          1HD       PRO  38  -7.238  -1.329   4.050
  255    H    VAL  39           H        VAL  39  -7.845  -2.270   0.458
  256    HA   VAL  39           HA       VAL  39  -9.066  -3.871  -1.574
  257    HB   VAL  39           HB       VAL  39  -7.489  -1.339  -1.338
  258   1HG1  VAL  39          1HG1      VAL  39  -7.566  -0.958  -3.757
  259   2HG1  VAL  39          2HG1      VAL  39  -8.250  -2.564  -4.004
  260   3HG1  VAL  39          3HG1      VAL  39  -6.601  -2.389  -3.399
  261   1HG2  VAL  39          1HG2      VAL  39  -9.814  -1.128  -0.923
  262   2HG2  VAL  39          2HG2      VAL  39 -10.232  -2.155  -2.294
  263   3HG2  VAL  39          3HG2      VAL  39  -9.594  -0.534  -2.567
  264    H    LEU  40           H        LEU  40  -5.682  -3.314  -0.667
  265    HA   LEU  40           HA       LEU  40  -4.631  -4.874  -2.921
  266   1HB   LEU  40          2HB       LEU  40  -3.288  -3.866  -0.395
  267   2HB   LEU  40          1HB       LEU  40  -2.506  -4.272  -1.921
  268    HG   LEU  40           HG       LEU  40  -4.572  -2.087  -1.595
  269   1HD1  LEU  40          1HD1      LEU  40  -2.250  -0.832  -2.249
  270   2HD1  LEU  40          2HD1      LEU  40  -1.628  -2.151  -1.259
  271   3HD1  LEU  40          3HD1      LEU  40  -2.811  -1.030  -0.589
  272   1HD2  LEU  40          1HD2      LEU  40  -2.685  -2.741  -3.877
  273   2HD2  LEU  40          2HD2      LEU  40  -3.916  -1.478  -3.863
  274   3HD2  LEU  40          3HD2      LEU  40  -4.394  -3.176  -3.840
  275    H    LEU  41           H        LEU  41  -5.666  -5.429   0.343
  276    HA   LEU  41           HA       LEU  41  -4.187  -7.918   0.734
  277   1HB   LEU  41          2HB       LEU  41  -6.446  -6.450   2.098
  278   2HB   LEU  41          1HB       LEU  41  -5.904  -8.030   2.659
  279    HG   LEU  41           HG       LEU  41  -3.954  -5.772   2.232
  280   1HD1  LEU  41          1HD1      LEU  41  -5.841  -6.275   4.508
  281   2HD1  LEU  41          2HD1      LEU  41  -5.318  -4.741   3.813
  282   3HD1  LEU  41          3HD1      LEU  41  -4.228  -5.655   4.857
  283   1HD2  LEU  41          1HD2      LEU  41  -3.757  -8.501   2.913
  284   2HD2  LEU  41          2HD2      LEU  41  -3.480  -7.618   4.415
  285   3HD2  LEU  41          3HD2      LEU  41  -2.475  -7.292   3.002
  286    H    ASN  42           H        ASN  42  -6.989  -6.953  -0.967
  287    HA   ASN  42           HA       ASN  42  -8.326  -9.571  -0.753
  288   1HB   ASN  42          2HB       ASN  42  -9.783  -7.712  -0.785
  289   2HB   ASN  42          1HB       ASN  42  -8.859  -6.901  -2.049
  290   1HD2  ASN  42          1HD2      ASN  42 -10.471  -6.754  -3.685
  291   2HD2  ASN  42          2HD2      ASN  42 -11.235  -8.107  -4.366
  292    H    SER  43           H        SER  43  -5.786  -8.311  -2.538
  293    HA   SER  43           HA       SER  43  -6.441  -9.592  -5.110
  294   1HB   SER  43          2HB       SER  43  -4.246  -8.668  -5.731
  295   2HB   SER  43          1HB       SER  43  -5.203  -7.448  -4.896
  296    HG   SER  43           HG       SER  43  -3.967  -7.669  -3.131
  297    H    LYS  44           H        LYS  44  -5.898 -11.043  -2.356
  298    HA   LYS  44           HA       LYS  44  -4.949 -13.125  -1.750
  299   1HB   LYS  44          2HB       LYS  44  -5.932 -13.439  -4.159
  300   2HB   LYS  44          1HB       LYS  44  -4.242 -13.431  -4.664
  301   1HG   LYS  44          2HG       LYS  44  -4.171 -15.144  -2.519
  302   2HG   LYS  44          1HG       LYS  44  -5.755 -15.498  -3.210
  303   1HD   LYS  44          2HD       LYS  44  -4.799 -16.645  -4.890
  304   2HD   LYS  44          1HD       LYS  44  -3.849 -15.231  -5.343
  305   1HE   LYS  44          2HE       LYS  44  -2.243 -15.851  -3.454
  306   2HE   LYS  44          1HE       LYS  44  -3.106 -17.400  -3.361
  307   1HZ   LYS  44          1HZ       LYS  44  -2.713 -17.752  -5.701
  308   2HZ   LYS  44          2HZ       LYS  44  -1.228 -17.489  -4.919
  309   3HZ   LYS  44          3HZ       LYS  44  -1.938 -16.250  -5.840
  310    H    LEU  45           H        LEU  45  -3.283 -10.527  -2.430
  311    HA   LEU  45           HA       LEU  45  -0.603 -11.778  -2.806
  312   1HB   LEU  45          2HB       LEU  45  -1.852  -9.068  -3.080
  313   2HB   LEU  45          1HB       LEU  45  -0.108  -9.175  -2.832
  314    HG   LEU  45           HG       LEU  45  -1.620 -10.663  -4.995
  315   1HD1  LEU  45          1HD1      LEU  45  -0.777  -9.004  -6.531
  316   2HD1  LEU  45          2HD1      LEU  45   0.177  -8.239  -5.267
  317   3HD1  LEU  45          3HD1      LEU  45  -1.582  -8.141  -5.225
  318   1HD2  LEU  45          1HD2      LEU  45   0.773 -11.321  -3.901
  319   2HD2  LEU  45          2HD2      LEU  45   1.310 -10.147  -5.103
  320   3HD2  LEU  45          3HD2      LEU  45   0.399 -11.571  -5.608
  321    HA   PRO  46           HA       PRO  46   0.351 -11.223   1.438
  322   1HB   PRO  46          2HB       PRO  46   3.081 -11.152   1.262
  323   2HB   PRO  46          1HB       PRO  46   2.136 -12.639   1.070
  324   1HG   PRO  46          2HG       PRO  46   3.434 -10.953  -0.974
  325   2HG   PRO  46          1HG       PRO  46   3.166 -12.698  -0.949
  326   1HD   PRO  46          2HD       PRO  46   1.661 -10.870  -2.389
  327   2HD   PRO  46          1HD       PRO  46   1.151 -12.517  -1.973
  328    H    VAL  47           H        VAL  47   1.605  -9.647   2.872
  329    HA   VAL  47           HA       VAL  47   1.055  -6.923   2.167
  330    HB   VAL  47           HB       VAL  47   2.416  -8.464   4.373
  331   1HG1  VAL  47          1HG1      VAL  47   2.950  -6.525   5.599
  332   2HG1  VAL  47          2HG1      VAL  47   1.994  -5.489   4.547
  333   3HG1  VAL  47          3HG1      VAL  47   3.524  -6.155   3.975
  334   1HG2  VAL  47          1HG2      VAL  47   0.346  -6.718   5.243
  335   2HG2  VAL  47          2HG2      VAL  47   0.316  -8.479   5.158
  336   3HG2  VAL  47          3HG2      VAL  47  -0.220  -7.521   3.778
  337    H    ASP  48           H        ASP  48   3.572  -8.984   1.267
  338    HA   ASP  48           HA       ASP  48   5.733  -7.038   1.312
  339   1HB   ASP  48          2HB       ASP  48   5.234  -9.838   0.418
  340   2HB   ASP  48          1HB       ASP  48   6.614  -8.991  -0.280
  341    H    ILE  49           H        ILE  49   3.330  -8.212  -0.986
  342    HA   ILE  49           HA       ILE  49   4.517  -6.747  -3.241
  343    HB   ILE  49           HB       ILE  49   1.702  -7.824  -3.090
  344   1HG1  ILE  49          2HG1      ILE  49   3.068  -9.594  -2.121
  345   2HG1  ILE  49          1HG1      ILE  49   2.623 -10.047  -3.763
  346   1HG2  ILE  49          1HG2      ILE  49   3.493  -6.854  -5.115
  347   2HG2  ILE  49          2HG2      ILE  49   1.811  -7.353  -5.282
  348   3HG2  ILE  49          3HG2      ILE  49   3.103  -8.540  -5.452
  349   1HD1  ILE  49          1HD1      ILE  49   5.031 -10.461  -3.248
  350   2HD1  ILE  49          2HD1      ILE  49   5.239  -8.724  -3.015
  351   3HD1  ILE  49          3HD1      ILE  49   4.785  -9.355  -4.600
  352    H    LEU  50           H        LEU  50   1.768  -6.477  -1.041
  353    HA   LEU  50           HA       LEU  50   0.668  -4.058  -2.158
  354   1HB   LEU  50          2HB       LEU  50   0.530  -5.045   0.700
  355   2HB   LEU  50          1HB       LEU  50  -0.678  -4.105  -0.175
  356    HG   LEU  50           HG       LEU  50   0.098  -6.992  -0.641
  357   1HD1  LEU  50          1HD1      LEU  50  -1.504  -6.694   1.142
  358   2HD1  LEU  50          2HD1      LEU  50  -2.358  -7.317  -0.269
  359   3HD1  LEU  50          3HD1      LEU  50  -2.474  -5.606   0.147
  360   1HD2  LEU  50          1HD2      LEU  50  -2.063  -6.318  -2.298
  361   2HD2  LEU  50          2HD2      LEU  50  -0.416  -6.678  -2.814
  362   3HD2  LEU  50          3HD2      LEU  50  -0.899  -5.010  -2.512
  363    H    GLY  51           H        GLY  51   3.239  -4.788   0.128
  364   1HA   GLY  51          2HA       GLY  51   3.440  -2.104   1.203
  365   2HA   GLY  51          1HA       GLY  51   4.691  -3.347   1.313
  366    H    ARG  52           H        ARG  52   4.476  -3.728  -1.644
  367    HA   ARG  52           HA       ARG  52   6.279  -1.490  -2.414
  368   1HB   ARG  52          2HB       ARG  52   6.451  -4.224  -2.589
  369   2HB   ARG  52          1HB       ARG  52   5.883  -3.791  -4.202
  370   1HG   ARG  52          2HG       ARG  52   7.723  -2.191  -4.443
  371   2HG   ARG  52          1HG       ARG  52   8.285  -2.572  -2.815
  372   1HD   ARG  52          2HD       ARG  52   7.931  -4.869  -4.689
  373   2HD   ARG  52          1HD       ARG  52   9.317  -3.793  -4.961
  374    HE   ARG  52           HE       ARG  52   9.550  -4.133  -2.316
  375   1HH1  ARG  52          1HH2      ARG  52  11.220  -5.858  -4.081
  376   2HH1  ARG  52          2HH2      ARG  52  10.795  -7.453  -3.555
  377   1HH2  ARG  52          2HH1      ARG  52   7.917  -6.427  -1.913
  378   2HH2  ARG  52          1HH1      ARG  52   8.923  -7.775  -2.323
  379    H    VAL  53           H        VAL  53   3.238  -3.105  -3.302
  380    HA   VAL  53           HA       VAL  53   2.955  -1.737  -5.839
  381    HB   VAL  53           HB       VAL  53   1.110  -3.169  -3.919
  382   1HG1  VAL  53          1HG1      VAL  53  -0.722  -2.339  -4.941
  383   2HG1  VAL  53          2HG1      VAL  53  -0.067  -2.778  -6.517
  384   3HG1  VAL  53          3HG1      VAL  53   0.312  -1.209  -5.816
  385   1HG2  VAL  53          1HG2      VAL  53   2.856  -4.295  -5.479
  386   2HG2  VAL  53          2HG2      VAL  53   1.762  -3.845  -6.792
  387   3HG2  VAL  53          3HG2      VAL  53   1.207  -4.919  -5.505
  388    H    TRP  54           H        TRP  54   1.966  -1.026  -2.503
  389    HA   TRP  54           HA       TRP  54   0.389   1.298  -3.145
  390   1HB   TRP  54          2HB       TRP  54   0.080   0.353  -0.992
  391   2HB   TRP  54          1HB       TRP  54   1.821   0.246  -0.699
  392    HD1  TRP  54           HD1      TRP  54   3.136   2.612  -0.408
  393    HE1  TRP  54           HE1      TRP  54   2.347   4.843   0.566
  394    HE3  TRP  54           HE3      TRP  54  -1.906   1.872  -0.525
  395    HZ2  TRP  54           HZ2      TRP  54  -0.122   6.151   1.250
  396    HZ3  TRP  54           HZ3      TRP  54  -3.459   3.633   0.309
  397    HH2  TRP  54           HH2      TRP  54  -2.571   5.749   1.183
  398    H    GLU  55           H        GLU  55   3.763   0.957  -1.940
  399    HA   GLU  55           HA       GLU  55   4.473   3.663  -1.888
  400   1HB   GLU  55          2HB       GLU  55   5.967   1.141  -2.565
  401   2HB   GLU  55          1HB       GLU  55   6.783   2.698  -2.439
  402   1HG   GLU  55          2HG       GLU  55   5.328   2.737  -0.154
  403   2HG   GLU  55          1HG       GLU  55   5.619   1.005  -0.313
  404    H    LEU  56           H        LEU  56   5.126   1.476  -4.646
  405    HA   LEU  56           HA       LEU  56   5.816   3.583  -6.466
  406   1HB   LEU  56          2HB       LEU  56   4.624   0.835  -6.992
  407   2HB   LEU  56          1HB       LEU  56   5.531   1.807  -8.152
  408    HG   LEU  56           HG       LEU  56   6.897   1.351  -5.567
  409   1HD1  LEU  56          1HD1      LEU  56   7.021  -0.937  -7.468
  410   2HD1  LEU  56          2HD1      LEU  56   5.600  -0.834  -6.430
  411   3HD1  LEU  56          3HD1      LEU  56   7.209  -0.922  -5.714
  412   1HD2  LEU  56          1HD2      LEU  56   8.523   0.552  -7.686
  413   2HD2  LEU  56          2HD2      LEU  56   8.481   2.168  -6.984
  414   3HD2  LEU  56          3HD2      LEU  56   7.505   1.798  -8.404
  415    H    SER  57           H        SER  57   2.833   2.634  -5.094
  416    HA   SER  57           HA       SER  57   1.152   3.717  -7.283
  417   1HB   SER  57          2HB       SER  57   0.769   2.220  -4.715
  418   2HB   SER  57          1HB       SER  57  -0.602   3.034  -5.462
  419    HG   SER  57           HG       SER  57   0.127   1.896  -7.442
  420    H    ASP  58           H        ASP  58   2.379   4.586  -4.103
  421    HA   ASP  58           HA       ASP  58   0.529   6.815  -3.710
  422   1HB   ASP  58          2HB       ASP  58   2.078   5.273  -2.107
  423   2HB   ASP  58          1HB       ASP  58   3.137   6.671  -2.289
  424    H    ILE  59           H        ILE  59   1.130   7.635  -6.018
  425    HA   ILE  59           HA       ILE  59   3.572   8.700  -6.817
  426    HB   ILE  59           HB       ILE  59   0.785   9.878  -7.057
  427   1HG1  ILE  59          2HG1      ILE  59   1.004   7.537  -7.866
  428   2HG1  ILE  59          1HG1      ILE  59   0.726   8.660  -9.196
  429   1HG2  ILE  59          1HG2      ILE  59   3.254  10.323  -8.759
  430   2HG2  ILE  59          2HG2      ILE  59   2.572  11.493  -7.630
  431   3HG2  ILE  59          3HG2      ILE  59   1.656  11.007  -9.057
  432   1HD1  ILE  59          1HD1      ILE  59   2.492   7.346  -9.997
  433   2HD1  ILE  59          2HD1      ILE  59   3.267   7.253  -8.413
  434   3HD1  ILE  59          3HD1      ILE  59   3.328   8.754  -9.338
  435    H    ASP  60           H        ASP  60   1.313  10.031  -4.431
  436    HA   ASP  60           HA       ASP  60   2.985  12.457  -4.078
  437   1HB   ASP  60          2HB       ASP  60   0.500  11.606  -2.575
  438   2HB   ASP  60          1HB       ASP  60   1.110  13.243  -2.815
  439    H    HIS  61           H        HIS  61   2.314   9.383  -2.544
  440    HA   HIS  61           HA       HIS  61   3.367   8.340  -0.695
  441   1HB   HIS  61          2HB       HIS  61   5.210  10.737  -0.682
  442   2HB   HIS  61          1HB       HIS  61   5.586   9.072  -0.243
  443    HD1  HIS  61           HD1      HIS  61   5.788   7.334  -2.232
  444    HD2  HIS  61           HD2      HIS  61   5.412  11.311  -3.426
  445    HE1  HIS  61           HE1      HIS  61   6.425   7.409  -4.683
  446    H    ASP  62           H        ASP  62   1.102   9.958  -0.159
  447    HA   ASP  62           HA       ASP  62   1.868  11.419   2.344
  448   1HB   ASP  62          2HB       ASP  62  -0.206  12.650   1.975
  449   2HB   ASP  62          1HB       ASP  62   0.720  12.639   0.474
  450    H    GLY  63           H        GLY  63   0.718   8.450   1.386
  451   1HA   GLY  63          2HA       GLY  63   0.011   6.766   2.978
  452   2HA   GLY  63          1HA       GLY  63  -0.599   8.052   4.017
  453    H    MET  64           H        MET  64  -1.349   8.322   0.662
  454    HA   MET  64           HA       MET  64  -3.984   6.989   0.945
  455   1HB   MET  64          2HB       MET  64  -3.722   9.907   0.141
  456   2HB   MET  64          1HB       MET  64  -5.211   9.001   0.357
  457   1HG   MET  64          2HG       MET  64  -3.581   8.947   2.766
  458   2HG   MET  64          1HG       MET  64  -3.942  10.589   2.264
  459   1HE   MET  64          1HE       MET  64  -7.640  10.773   1.921
  460   2HE   MET  64          2HE       MET  64  -7.161   9.503   0.797
  461   3HE   MET  64          3HE       MET  64  -6.126  10.911   1.014
  462    H    LEU  65           H        LEU  65  -5.103   6.879  -1.201
  463    HA   LEU  65           HA       LEU  65  -3.179   7.120  -3.499
  464   1HB   LEU  65          2HB       LEU  65  -5.241   5.075  -2.686
  465   2HB   LEU  65          1HB       LEU  65  -4.742   5.213  -4.372
  466    HG   LEU  65           HG       LEU  65  -2.951   4.662  -1.991
  467   1HD1  LEU  65          1HD1      LEU  65  -3.061   2.485  -2.597
  468   2HD1  LEU  65          2HD1      LEU  65  -2.892   2.871  -4.310
  469   3HD1  LEU  65          3HD1      LEU  65  -4.478   2.942  -3.541
  470   1HD2  LEU  65          1HD2      LEU  65  -1.634   6.022  -3.410
  471   2HD2  LEU  65          2HD2      LEU  65  -2.356   5.349  -4.872
  472   3HD2  LEU  65          3HD2      LEU  65  -1.231   4.382  -3.917
  473    H    ASP  66           H        ASP  66  -3.838   8.796  -4.806
  474    HA   ASP  66           HA       ASP  66  -6.511   9.908  -4.756
  475   1HB   ASP  66          2HB       ASP  66  -4.183  10.915  -5.366
  476   2HB   ASP  66          1HB       ASP  66  -4.516  10.263  -6.971
  477    H    ARG  67           H        ARG  67  -7.824  10.075  -6.850
  478    HA   ARG  67           HA       ARG  67  -8.676   7.543  -7.754
  479   1HB   ARG  67          2HB       ARG  67  -9.549   8.989  -9.742
  480   2HB   ARG  67          1HB       ARG  67 -10.112   9.374  -8.117
  481   1HG   ARG  67          2HG       ARG  67  -8.965  11.350  -8.041
  482   2HG   ARG  67          1HG       ARG  67  -7.611  10.720  -8.975
  483   1HD   ARG  67          2HD       ARG  67  -8.859  10.926 -11.051
  484   2HD   ARG  67          1HD       ARG  67 -10.329  11.377 -10.164
  485    HE   ARG  67           HE       ARG  67  -8.014  13.077  -9.578
  486   1HH1  ARG  67          1HH2      ARG  67 -10.976  13.837  -9.530
  487   2HH1  ARG  67          2HH2      ARG  67 -11.066  14.901 -10.895
  488   1HH2  ARG  67          2HH1      ARG  67  -8.032  13.882 -12.227
  489   2HH2  ARG  67          1HH1      ARG  67  -9.402  14.925 -12.421
  490    H    ASP  68           H        ASP  68  -6.182   9.676  -9.097
  491    HA   ASP  68           HA       ASP  68  -5.657   7.867 -11.362
  492   1HB   ASP  68          2HB       ASP  68  -4.495  10.443 -10.278
  493   2HB   ASP  68          1HB       ASP  68  -3.759   9.599 -11.641
  494    H    GLU  69           H        GLU  69  -4.392   8.600  -8.171
  495    HA   GLU  69           HA       GLU  69  -1.900   7.136  -8.472
  496   1HB   GLU  69          2HB       GLU  69  -3.213   8.849  -6.624
  497   2HB   GLU  69          1HB       GLU  69  -2.861   7.347  -5.764
  498   1HG   GLU  69          2HG       GLU  69  -0.532   7.516  -6.850
  499   2HG   GLU  69          1HG       GLU  69  -0.950   9.198  -7.161
  500    H    PHE  70           H        PHE  70  -5.057   6.479  -6.949
  501    HA   PHE  70           HA       PHE  70  -4.505   3.837  -6.039
  502   1HB   PHE  70          2HB       PHE  70  -6.477   5.263  -5.459
  503   2HB   PHE  70          1HB       PHE  70  -7.084   5.050  -7.102
  504    HD1  PHE  70           HD1      PHE  70  -6.624   3.497  -3.826
  505    HD2  PHE  70           HD2      PHE  70  -7.804   2.807  -7.900
  506    HE1  PHE  70           HE1      PHE  70  -7.667   1.350  -3.159
  507    HE2  PHE  70           HE2      PHE  70  -8.848   0.658  -7.232
  508    HZ   PHE  70           HZ       PHE  70  -8.780  -0.068  -4.862
  509    H    ALA  71           H        ALA  71  -5.065   5.166  -9.200
  510    HA   ALA  71           HA       ALA  71  -5.936   2.764 -10.552
  511   1HB   ALA  71          1HB       ALA  71  -5.515   4.065 -12.512
  512   2HB   ALA  71          2HB       ALA  71  -4.264   5.012 -11.701
  513   3HB   ALA  71          3HB       ALA  71  -5.964   5.244 -11.278
  514    H    VAL  72           H        VAL  72  -2.764   4.324 -10.245
  515    HA   VAL  72           HA       VAL  72  -1.190   2.432 -11.633
  516    HB   VAL  72           HB       VAL  72  -0.701   4.247  -9.258
  517   1HG1  VAL  72          1HG1      VAL  72   1.028   2.237 -10.500
  518   2HG1  VAL  72          2HG1      VAL  72   1.231   3.110  -8.987
  519   3HG1  VAL  72          3HG1      VAL  72   1.741   3.849 -10.501
  520   1HG2  VAL  72          1HG2      VAL  72   0.348   5.685 -10.988
  521   2HG2  VAL  72          2HG2      VAL  72  -1.348   5.353 -11.362
  522   3HG2  VAL  72          3HG2      VAL  72  -0.069   4.490 -12.219
  523    H    ALA  73           H        ALA  73  -2.596   2.335  -8.425
  524    HA   ALA  73           HA       ALA  73  -0.927   0.104  -7.493
  525   1HB   ALA  73          1HB       ALA  73  -2.806   2.073  -6.489
  526   2HB   ALA  73          2HB       ALA  73  -1.563   1.180  -5.614
  527   3HB   ALA  73          3HB       ALA  73  -3.168   0.470  -5.839
  528    H    MET  74           H        MET  74  -3.683   0.303  -9.496
  529    HA   MET  74           HA       MET  74  -4.838  -2.236  -8.495
  530   1HB   MET  74          2HB       MET  74  -5.578  -0.578 -10.920
  531   2HB   MET  74          1HB       MET  74  -6.577  -1.788 -10.128
  532   1HG   MET  74          2HG       MET  74  -6.084   1.031  -9.386
  533   2HG   MET  74          1HG       MET  74  -7.491   0.027  -9.090
  534   1HE   MET  74          1HE       MET  74  -7.866  -1.482  -7.126
  535   2HE   MET  74          2HE       MET  74  -6.651  -1.956  -5.941
  536   3HE   MET  74          3HE       MET  74  -6.472  -2.453  -7.621
  537    H    PHE  75           H        PHE  75  -3.098  -1.055 -11.375
  538    HA   PHE  75           HA       PHE  75  -3.139  -3.701 -12.622
  539   1HB   PHE  75          2HB       PHE  75  -2.049  -2.609 -14.391
  540   2HB   PHE  75          1HB       PHE  75  -2.945  -1.286 -13.651
  541    HD1  PHE  75           HD1      PHE  75   0.389  -2.973 -13.656
  542    HD2  PHE  75           HD2      PHE  75  -1.827   0.605 -12.814
  543    HE1  PHE  75           HE1      PHE  75   2.512  -1.752 -13.261
  544    HE2  PHE  75           HE2      PHE  75   0.286   1.821 -12.421
  545    HZ   PHE  75           HZ       PHE  75   2.461   0.652 -12.643
  546    H    LEU  76           H        LEU  76  -1.273  -2.047 -10.253
  547    HA   LEU  76           HA       LEU  76   1.170  -3.633 -10.519
  548   1HB   LEU  76          2HB       LEU  76   0.040  -1.459  -8.888
  549   2HB   LEU  76          1HB       LEU  76   1.079  -2.551  -7.973
  550    HG   LEU  76           HG       LEU  76   1.818  -1.111 -10.536
  551   1HD1  LEU  76          1HD1      LEU  76   2.987  -0.852  -7.752
  552   2HD1  LEU  76          2HD1      LEU  76   1.751   0.233  -8.390
  553   3HD1  LEU  76          3HD1      LEU  76   3.337   0.157  -9.157
  554   1HD2  LEU  76          1HD2      LEU  76   4.140  -2.110  -9.643
  555   2HD2  LEU  76          2HD2      LEU  76   3.093  -3.027 -10.725
  556   3HD2  LEU  76          3HD2      LEU  76   3.062  -3.344  -8.991
  557    H    VAL  77           H        VAL  77  -1.914  -3.879  -8.937
  558    HA   VAL  77           HA       VAL  77  -1.067  -6.090  -7.161
  559    HB   VAL  77           HB       VAL  77  -3.676  -4.625  -7.700
  560   1HG1  VAL  77          1HG1      VAL  77  -3.716  -5.958  -5.195
  561   2HG1  VAL  77          2HG1      VAL  77  -3.193  -7.146  -6.390
  562   3HG1  VAL  77          3HG1      VAL  77  -4.721  -6.293  -6.605
  563   1HG2  VAL  77          1HG2      VAL  77  -1.859  -4.570  -5.273
  564   2HG2  VAL  77          2HG2      VAL  77  -3.249  -3.533  -5.589
  565   3HG2  VAL  77          3HG2      VAL  77  -1.794  -3.379  -6.571
  566    H    TYR  78           H        TYR  78  -2.979  -5.541 -10.095
  567    HA   TYR  78           HA       TYR  78  -4.019  -8.249 -10.241
  568   1HB   TYR  78          2HB       TYR  78  -4.023  -5.734 -11.777
  569   2HB   TYR  78          1HB       TYR  78  -4.136  -7.185 -12.774
  570    HD1  TYR  78           HD1      TYR  78  -6.010  -4.843 -10.959
  571    HD2  TYR  78           HD2      TYR  78  -5.776  -9.059 -11.754
  572    HE1  TYR  78           HE1      TYR  78  -8.392  -5.095 -10.318
  573    HE2  TYR  78           HE2      TYR  78  -8.160  -9.309 -11.114
  574    HH   TYR  78           HH       TYR  78 -10.257  -7.546 -11.117
  575    H    CYS  79           H        CYS  79  -1.079  -6.660 -11.306
  576    HA   CYS  79           HA       CYS  79  -0.332  -8.768 -13.195
  577   1HB   CYS  79          2HB       CYS  79   0.710  -6.193 -12.141
  578   2HB   CYS  79          1HB       CYS  79   1.936  -7.343 -12.676
  579    HG   CYS  79           HG       CYS  79   0.846  -7.352 -15.046
  580    H    ALA  80           H        ALA  80  -0.183  -8.290  -9.789
  581    HA   ALA  80           HA       ALA  80   2.116 -10.104  -9.401
  582   1HB   ALA  80          1HB       ALA  80   1.001  -9.674  -6.941
  583   2HB   ALA  80          2HB       ALA  80   0.423  -8.256  -7.816
  584   3HB   ALA  80          3HB       ALA  80   2.155  -8.571  -7.693
  585    H    LEU  81           H        LEU  81  -1.201 -10.337  -9.972
  586    HA   LEU  81           HA       LEU  81  -1.645 -12.786  -8.376
  587   1HB   LEU  81          2HB       LEU  81  -3.471 -11.657 -10.486
  588   2HB   LEU  81          1HB       LEU  81  -3.901 -12.450  -8.973
  589    HG   LEU  81           HG       LEU  81  -2.896  -9.647  -9.409
  590   1HD1  LEU  81          1HD1      LEU  81  -5.415 -10.641  -9.187
  591   2HD1  LEU  81          2HD1      LEU  81  -4.963  -9.013  -8.681
  592   3HD1  LEU  81          3HD1      LEU  81  -5.052 -10.312  -7.493
  593   1HD2  LEU  81          1HD2      LEU  81  -2.969  -9.665  -6.779
  594   2HD2  LEU  81          2HD2      LEU  81  -1.527 -10.244  -7.610
  595   3HD2  LEU  81          3HD2      LEU  81  -2.697 -11.396  -6.974
  596    H    GLU  82           H        GLU  82  -1.496 -11.769 -11.770
  597    HA   GLU  82           HA       GLU  82  -1.838 -14.405 -12.877
  598   1HB   GLU  82          2HB       GLU  82  -1.199 -11.655 -13.726
  599   2HB   GLU  82          1HB       GLU  82  -0.525 -12.909 -14.769
  600   1HG   GLU  82          2HG       GLU  82  -3.433 -12.600 -13.969
  601   2HG   GLU  82          1HG       GLU  82  -2.750 -12.319 -15.571
  602    H    LYS  83           H        LYS  83   1.044 -12.325 -12.510
  603    HA   LYS  83           HA       LYS  83   2.780 -14.438 -11.696
  604   1HB   LYS  83          2HB       LYS  83   1.955 -14.554 -14.371
  605   2HB   LYS  83          1HB       LYS  83   3.616 -13.968 -14.421
  606   1HG   LYS  83          2HG       LYS  83   3.920 -15.926 -12.603
  607   2HG   LYS  83          1HG       LYS  83   2.560 -16.595 -13.505
  608   1HD   LYS  83          2HD       LYS  83   4.629 -15.484 -15.252
  609   2HD   LYS  83          1HD       LYS  83   5.230 -16.795 -14.235
  610   1HE   LYS  83          2HE       LYS  83   4.361 -17.828 -16.236
  611   2HE   LYS  83          1HE       LYS  83   3.155 -18.122 -14.969
  612   1HZ   LYS  83          1HZ       LYS  83   2.170 -15.910 -15.702
  613   2HZ   LYS  83          2HZ       LYS  83   1.931 -17.236 -16.737
  614   3HZ   LYS  83          3HZ       LYS  83   3.112 -16.071 -17.102
  615    H    GLU  84           H        GLU  84   2.405 -11.351 -13.330
  616    HA   GLU  84           HA       GLU  84   5.149 -10.512 -13.261
  617   1HB   GLU  84          2HB       GLU  84   2.476  -9.429 -13.792
  618   2HB   GLU  84          1HB       GLU  84   3.587  -8.231 -13.127
  619   1HG   GLU  84          2HG       GLU  84   5.194  -9.505 -14.945
  620   2HG   GLU  84          1HG       GLU  84   3.628  -9.572 -15.755
  621    HA   PRO  85           HA       PRO  85   5.198  -9.967  -8.801
  622   1HB   PRO  85          2HB       PRO  85   7.894  -9.476  -8.665
  623   2HB   PRO  85          1HB       PRO  85   7.213 -11.112  -8.769
  624   1HG   PRO  85          2HG       PRO  85   8.403  -9.420 -10.913
  625   2HG   PRO  85          1HG       PRO  85   8.564 -11.160 -10.629
  626   1HD   PRO  85          2HD       PRO  85   6.913 -10.117 -12.516
  627   2HD   PRO  85          1HD       PRO  85   6.583 -11.650 -11.681
  628    H    VAL  86           H        VAL  86   6.514  -8.037  -7.528
  629    HA   VAL  86           HA       VAL  86   6.117  -5.541  -9.146
  630    HB   VAL  86           HB       VAL  86   5.357  -6.122  -6.267
  631   1HG1  VAL  86          1HG1      VAL  86   5.410  -3.645  -7.949
  632   2HG1  VAL  86          2HG1      VAL  86   5.772  -3.841  -6.233
  633   3HG1  VAL  86          3HG1      VAL  86   4.098  -3.842  -6.787
  634   1HG2  VAL  86          1HG2      VAL  86   4.011  -6.566  -8.776
  635   2HG2  VAL  86          2HG2      VAL  86   3.150  -5.328  -7.863
  636   3HG2  VAL  86          3HG2      VAL  86   3.438  -6.911  -7.145
  637    HA   PRO  87           HA       PRO  87  10.192  -4.883  -7.416
  638   1HB   PRO  87          2HB       PRO  87  10.888  -2.882  -9.144
  639   2HB   PRO  87          1HB       PRO  87  10.934  -4.596  -9.596
  640   1HG   PRO  87          2HG       PRO  87   9.027  -2.502 -10.379
  641   2HG   PRO  87          1HG       PRO  87   9.465  -4.001 -11.205
  642   1HD   PRO  87          2HD       PRO  87   7.141  -3.511  -9.661
  643   2HD   PRO  87          1HD       PRO  87   7.667  -5.059 -10.350
  644    H    MET  88           H        MET  88  11.310  -2.585  -6.807
  645    HA   MET  88           HA       MET  88   9.171  -1.008  -5.426
  646   1HB   MET  88          2HB       MET  88  12.155  -0.965  -4.975
  647   2HB   MET  88          1HB       MET  88  10.890  -0.426  -3.875
  648   1HG   MET  88          2HG       MET  88  10.176  -2.656  -3.437
  649   2HG   MET  88          1HG       MET  88  11.099  -3.299  -4.797
  650   1HE   MET  88          1HE       MET  88  11.942  -2.045  -0.721
  651   2HE   MET  88          2HE       MET  88  11.140  -1.089  -1.965
  652   3HE   MET  88          3HE       MET  88  12.848  -0.822  -1.624
  653    H    SER  89           H        SER  89  10.649  -0.780  -8.298
  654    HA   SER  89           HA       SER  89  11.379   2.096  -7.948
  655   1HB   SER  89          2HB       SER  89  12.782   1.770  -9.847
  656   2HB   SER  89          1HB       SER  89  13.041   0.414  -8.758
  657    HG   SER  89           HG       SER  89  12.712  -0.132 -11.029
  658    H    LEU  90           H        LEU  90   9.584   3.226  -8.318
  659    HA   LEU  90           HA       LEU  90   7.413   2.673 -10.051
  660   1HB   LEU  90          2HB       LEU  90   8.451   4.790  -8.434
  661   2HB   LEU  90          1HB       LEU  90   7.991   5.484  -9.989
  662    HG   LEU  90           HG       LEU  90   6.192   3.675  -8.355
  663   1HD1  LEU  90          1HD1      LEU  90   6.164   5.540  -7.003
  664   2HD1  LEU  90          2HD1      LEU  90   4.995   6.073  -8.211
  665   3HD1  LEU  90          3HD1      LEU  90   6.669   6.619  -8.304
  666   1HD2  LEU  90          1HD2      LEU  90   4.856   5.462 -10.153
  667   2HD2  LEU  90          2HD2      LEU  90   4.896   3.700 -10.199
  668   3HD2  LEU  90          3HD2      LEU  90   6.131   4.632 -11.045
  669    HA   PRO  91           HA       PRO  91   9.916   3.061 -13.823
  670   1HB   PRO  91          2HB       PRO  91   8.019   1.953 -15.465
  671   2HB   PRO  91          1HB       PRO  91   9.144   0.985 -14.490
  672   1HG   PRO  91          2HG       PRO  91   6.306   1.719 -13.931
  673   2HG   PRO  91          1HG       PRO  91   7.131   0.168 -13.706
  674   1HD   PRO  91          2HD       PRO  91   6.663   1.843 -11.647
  675   2HD   PRO  91          1HD       PRO  91   8.112   0.823 -11.726
  676    HA   PRO  92           HA       PRO  92   8.058   6.838 -15.149
  677   1HB   PRO  92          2HB       PRO  92   9.477   7.169 -17.463
  678   2HB   PRO  92          1HB       PRO  92  10.172   7.450 -15.855
  679   1HG   PRO  92          2HG       PRO  92  10.448   5.096 -17.657
  680   2HG   PRO  92          1HG       PRO  92  11.659   5.874 -16.624
  681   1HD   PRO  92          2HD       PRO  92  10.385   3.564 -15.954
  682   2HD   PRO  92          1HD       PRO  92  10.988   4.730 -14.754
  683    H    ALA  93           H        ALA  93   7.684   3.870 -16.709
  684    HA   ALA  93           HA       ALA  93   6.185   4.881 -19.048
  685   1HB   ALA  93          1HB       ALA  93   7.500   2.477 -18.178
  686   2HB   ALA  93          2HB       ALA  93   6.864   2.851 -19.781
  687   3HB   ALA  93          3HB       ALA  93   5.824   2.088 -18.573
  688    H    LEU  94           H        LEU  94   5.574   4.432 -15.795
  689    HA   LEU  94           HA       LEU  94   2.659   3.960 -16.274
  690   1HB   LEU  94          2HB       LEU  94   2.918   2.212 -14.856
  691   2HB   LEU  94          1HB       LEU  94   4.643   2.537 -14.824
  692    HG   LEU  94           HG       LEU  94   3.901   4.369 -13.029
  693   1HD1  LEU  94          1HD1      LEU  94   1.488   3.018 -13.596
  694   2HD1  LEU  94          2HD1      LEU  94   1.782   4.174 -12.296
  695   3HD1  LEU  94          3HD1      LEU  94   2.007   2.448 -12.012
  696   1HD2  LEU  94          1HD2      LEU  94   5.277   2.954 -11.964
  697   2HD2  LEU  94          2HD2      LEU  94   4.751   1.591 -12.951
  698   3HD2  LEU  94          3HD2      LEU  94   3.844   2.035 -11.505
  699    H    VAL  95           H        VAL  95   4.924   6.242 -15.411
  700    HA   VAL  95           HA       VAL  95   3.324   7.534 -13.281
  701    HB   VAL  95           HB       VAL  95   5.985   8.074 -14.629
  702   1HG1  VAL  95          1HG1      VAL  95   4.378   9.987 -13.423
  703   2HG1  VAL  95          2HG1      VAL  95   6.128  10.092 -13.617
  704   3HG1  VAL  95          3HG1      VAL  95   5.442   9.473 -12.113
  705   1HG2  VAL  95          1HG2      VAL  95   6.480   7.672 -11.990
  706   2HG2  VAL  95          2HG2      VAL  95   6.475   6.371 -13.180
  707   3HG2  VAL  95          3HG2      VAL  95   5.046   6.666 -12.190
  708    HA   PRO  96           HA       PRO  96   1.309  10.133 -16.249
  709   1HB   PRO  96          2HB       PRO  96   0.248  11.918 -14.466
  710   2HB   PRO  96          1HB       PRO  96  -0.418  10.292 -14.716
  711   1HG   PRO  96          2HG       PRO  96   1.353  11.297 -12.546
  712   2HG   PRO  96          1HG       PRO  96  -0.004  10.162 -12.461
  713   1HD   PRO  96          2HD       PRO  96   2.609   9.385 -12.440
  714   2HD   PRO  96          1HD       PRO  96   1.288   8.369 -13.058
  715    HA   PRO  97           HA       PRO  97   4.080  13.486 -16.845
  716   1HB   PRO  97          2HB       PRO  97   2.454  15.368 -17.994
  717   2HB   PRO  97          1HB       PRO  97   3.007  13.913 -18.848
  718   1HG   PRO  97          2HG       PRO  97   0.390  14.457 -17.536
  719   2HG   PRO  97          1HG       PRO  97   0.739  13.610 -19.052
  720   1HD   PRO  97          2HD       PRO  97   0.157  12.323 -16.727
  721   2HD   PRO  97          1HD       PRO  97   1.191  11.627 -17.994
  722    H    SER  98           H        SER  98   1.574  13.656 -14.605
  723    HA   SER  98           HA       SER  98   1.882  16.465 -13.846
  724   1HB   SER  98          2HB       SER  98  -0.090  14.701 -13.559
  725   2HB   SER  98          1HB       SER  98   0.756  14.335 -12.058
  726    HG   SER  98           HG       SER  98   0.608  16.556 -11.535
  727    H    LYS  99           H        LYS  99   3.256  13.374 -12.912
  728    HA   LYS  99           HA       LYS  99   4.710  14.596 -10.629
  729   1HB   LYS  99          2HB       LYS  99   3.577  12.347 -10.542
  730   2HB   LYS  99          1HB       LYS  99   4.725  11.777 -11.755
  731   1HG   LYS  99          2HG       LYS  99   5.473  11.181  -9.476
  732   2HG   LYS  99          1HG       LYS  99   6.597  12.304 -10.242
  733   1HD   LYS  99          2HD       LYS  99   5.740  14.159  -8.996
  734   2HD   LYS  99          1HD       LYS  99   4.355  13.223  -8.432
  735   1HE   LYS  99          2HE       LYS  99   5.571  12.169  -6.791
  736   2HE   LYS  99          1HE       LYS  99   7.040  12.105  -7.786
  737   1HZ   LYS  99          1HZ       LYS  99   6.099  14.766  -7.129
  738   2HZ   LYS  99          2HZ       LYS  99   7.681  14.146  -7.142
  739   3HZ   LYS  99          3HZ       LYS  99   6.669  13.871  -5.807
  740    H    ARG 100           H        ARG 100   5.122  14.874 -13.773
  741    HA   ARG 100           HA       ARG 100   8.004  14.075 -13.856
  742   1HB   ARG 100          2HB       ARG 100   5.759  14.278 -15.717
  743   2HB   ARG 100          1HB       ARG 100   7.216  15.048 -16.346
  744   1HG   ARG 100          2HG       ARG 100   8.505  13.032 -16.033
  745   2HG   ARG 100          1HG       ARG 100   7.174  12.256 -15.175
  746   1HD   ARG 100          2HD       ARG 100   6.555  13.280 -17.905
  747   2HD   ARG 100          1HD       ARG 100   7.594  11.845 -17.806
  748    HE   ARG 100           HE       ARG 100   5.277  11.712 -16.031
  749   1HH1  ARG 100          1HH2      ARG 100   4.022  12.078 -18.682
  750   2HH1  ARG 100          2HH2      ARG 100   3.958  10.463 -19.305
  751   1HH2  ARG 100          2HH1      ARG 100   6.280   9.217 -17.051
  752   2HH2  ARG 100          1HH1      ARG 100   5.236   8.844 -18.382
  753    H    SER 107           1H       SER 107   8.183   5.115   4.440
  754    HA   SER 107           HA       SER 107   7.240   6.832   2.323
  755   1HB   SER 107          2HB       SER 107   7.943   3.932   1.919
  756   2HB   SER 107          1HB       SER 107   6.582   4.637   1.051
  757    HG   SER 107           HG       SER 107   8.072   6.277   0.338
  758    H    THR 108           H        THR 108   5.034   7.025   2.676
  759    HA   THR 108           HA       THR 108   3.821   5.927   5.027
  760    HB   THR 108           HB       THR 108   1.799   6.969   4.087
  761    HG1  THR 108           HG1      THR 108   2.478   7.960   1.851
  762   1HG2  THR 108          1HG2      THR 108   4.377   8.258   4.308
  763   2HG2  THR 108          2HG2      THR 108   2.785   8.877   4.749
  764   3HG2  THR 108          3HG2      THR 108   3.384   9.077   3.102
  765    H    ASN 109           H        ASN 109   4.336   3.577   4.665
  766    HA   ASN 109           HA       ASN 109   2.472   2.289   2.702
  767   1HB   ASN 109          2HB       ASN 109   5.025   2.073   2.545
  768   2HB   ASN 109          1HB       ASN 109   4.920   1.093   4.009
  769   1HD2  ASN 109          1HD2      ASN 109   3.912   1.235   0.595
  770   2HD2  ASN 109          2HD2      ASN 109   3.535  -0.414   0.465
  771    HA   PRO 110           HA       PRO 110   0.492   0.876   6.448
  772   1HB   PRO 110          2HB       PRO 110  -1.605  -0.366   5.214
  773   2HB   PRO 110          1HB       PRO 110  -1.513   1.395   5.417
  774   1HG   PRO 110          2HG       PRO 110  -1.001  -0.259   3.010
  775   2HG   PRO 110          1HG       PRO 110  -1.694   1.362   3.144
  776   1HD   PRO 110          2HD       PRO 110   0.908   0.806   2.391
  777   2HD   PRO 110          1HD       PRO 110   0.338   2.366   3.023
  778    H    PHE 111           H        PHE 111   1.907  -0.975   3.934
  779    HA   PHE 111           HA       PHE 111   1.324  -3.579   5.272
  780   1HB   PHE 111          2HB       PHE 111   2.597  -2.771   2.641
  781   2HB   PHE 111          1HB       PHE 111   2.451  -4.447   3.164
  782    HD1  PHE 111           HD1      PHE 111   0.767  -1.631   1.656
  783    HD2  PHE 111           HD2      PHE 111   0.136  -5.366   3.683
  784    HE1  PHE 111           HE1      PHE 111  -1.566  -1.691   0.820
  785    HE2  PHE 111           HE2      PHE 111  -2.197  -5.424   2.846
  786    HZ   PHE 111           HZ       PHE 111  -3.047  -3.587   1.419
  787    H    LEU 112           HN       LEU 112   3.980  -1.355   4.533
  788    HA   LEU 112           HA       LEU 112   6.009  -3.197   5.640
  789   1HB   LEU 112          2HB       LEU 112   5.873  -0.603   4.180
  790   2HB   LEU 112          1HB       LEU 112   7.287  -0.855   5.205
  791    HG   LEU 112           HG       LEU 112   6.694  -3.249   3.685
  792   1HD1  LEU 112          1HD1      LEU 112   7.595  -1.045   1.888
  793   2HD1  LEU 112          2HD1      LEU 112   5.870  -1.153   2.233
  794   3HD1  LEU 112          3HD1      LEU 112   6.708  -2.520   1.501
  795   1HD2  LEU 112          1HD2      LEU 112   9.117  -2.070   2.854
  796   2HD2  LEU 112          2HD2      LEU 112   8.913  -3.310   4.091
  797   3HD2  LEU 112          3HD2      LEU 112   8.921  -1.605   4.543
  Start of MODEL   10
    1    HA   PRO   6           HA       PRO   6   2.296   7.214 -22.103
    2   1HB   PRO   6          2HB       PRO   6  -0.351   6.517 -22.056
    3   2HB   PRO   6          1HB       PRO   6   0.421   7.299 -23.450
    4   1HG   PRO   6          2HG       PRO   6  -0.242   4.429 -23.019
    5   2HG   PRO   6          1HG       PRO   6  -0.366   5.409 -24.489
    6   1HD   PRO   6          2HD       PRO   6   1.662   3.658 -24.035
    7   2HD   PRO   6          1HD       PRO   6   1.844   5.121 -25.027
    8    H    TRP   7           H        TRP   7   0.295   7.014 -20.218
    9    HA   TRP   7           HA       TRP   7   1.511   5.925 -17.946
   10   1HB   TRP   7          2HB       TRP   7  -0.399   7.532 -18.076
   11   2HB   TRP   7          1HB       TRP   7  -1.451   6.198 -18.550
   12    HD1  TRP   7           HD1      TRP   7   1.117   5.157 -16.105
   13    HE1  TRP   7           HE1      TRP   7   0.075   4.898 -13.757
   14    HE3  TRP   7           HE3      TRP   7  -3.403   7.383 -16.904
   15    HZ2  TRP   7           HZ2      TRP   7  -2.361   5.553 -12.402
   16    HZ3  TRP   7           HZ3      TRP   7  -5.065   7.556 -15.074
   17    HH2  TRP   7           HH2      TRP   7  -4.551   6.644 -12.826
   18    H    ALA   8           H        ALA   8   1.906   3.818 -17.395
   19    HA   ALA   8           HA       ALA   8   1.291   1.520 -18.818
   20   1HB   ALA   8          1HB       ALA   8   2.801   1.515 -16.940
   21   2HB   ALA   8          2HB       ALA   8   1.490   0.407 -16.531
   22   3HB   ALA   8          3HB       ALA   8   1.520   2.030 -15.841
   23    H    VAL   9           H        VAL   9  -0.828   3.404 -16.773
   24    HA   VAL   9           HA       VAL   9  -2.933   1.301 -16.827
   25    HB   VAL   9           HB       VAL   9  -2.566   3.963 -15.434
   26   1HG1  VAL   9          1HG1      VAL   9  -4.948   3.657 -16.025
   27   2HG1  VAL   9          2HG1      VAL   9  -4.699   3.496 -14.287
   28   3HG1  VAL   9          3HG1      VAL   9  -4.923   2.058 -15.283
   29   1HG2  VAL   9          1HG2      VAL   9  -2.744   1.091 -14.466
   30   2HG2  VAL   9          2HG2      VAL   9  -2.601   2.502 -13.415
   31   3HG2  VAL   9          3HG2      VAL   9  -1.286   2.084 -14.515
   32    H    LYS  10           H        LYS  10  -4.513   1.386 -18.356
   33    HA   LYS  10           HA       LYS  10  -4.723   3.791 -20.089
   34   1HB   LYS  10          2HB       LYS  10  -5.027   0.910 -20.272
   35   2HB   LYS  10          1HB       LYS  10  -6.457   1.720 -20.909
   36   1HG   LYS  10          2HG       LYS  10  -5.319   2.614 -22.677
   37   2HG   LYS  10          1HG       LYS  10  -3.870   2.911 -21.718
   38   1HD   LYS  10          2HD       LYS  10  -2.986   0.844 -22.160
   39   2HD   LYS  10          1HD       LYS  10  -4.567   0.065 -22.224
   40   1HE   LYS  10          2HE       LYS  10  -3.738   2.024 -24.368
   41   2HE   LYS  10          1HE       LYS  10  -3.282   0.312 -24.466
   42   1HZ   LYS  10          1HZ       LYS  10  -5.643  -0.242 -24.044
   43   2HZ   LYS  10          2HZ       LYS  10  -5.409   0.588 -25.509
   44   3HZ   LYS  10          3HZ       LYS  10  -6.027   1.407 -24.155
   45    HA   PRO  11           HA       PRO  11  -8.684   5.074 -18.671
   46   1HB   PRO  11          2HB       PRO  11 -10.408   4.833 -20.797
   47   2HB   PRO  11          1HB       PRO  11  -9.174   6.106 -20.687
   48   1HG   PRO  11          2HG       PRO  11  -9.093   3.517 -22.171
   49   2HG   PRO  11          1HG       PRO  11  -8.560   5.127 -22.688
   50   1HD   PRO  11          2HD       PRO  11  -6.823   3.265 -21.838
   51   2HD   PRO  11          1HD       PRO  11  -6.573   4.993 -21.512
   52    H    GLU  12           H        GLU  12  -8.840   2.026 -20.496
   53    HA   GLU  12           HA       GLU  12 -11.287   1.066 -19.316
   54   1HB   GLU  12          2HB       GLU  12 -10.484  -1.101 -20.225
   55   2HB   GLU  12          1HB       GLU  12 -10.250   0.195 -21.399
   56   1HG   GLU  12          2HG       GLU  12  -7.893   0.427 -20.638
   57   2HG   GLU  12          1HG       GLU  12  -8.140  -0.924 -19.531
   58    H    ASP  13           H        ASP  13  -7.889   0.937 -18.380
   59    HA   ASP  13           HA       ASP  13  -8.403  -0.826 -16.082
   60   1HB   ASP  13          2HB       ASP  13  -6.005   0.847 -16.924
   61   2HB   ASP  13          1HB       ASP  13  -5.988  -0.419 -15.696
   62    H    LYS  14           H        LYS  14  -7.720   2.580 -16.747
   63    HA   LYS  14           HA       LYS  14  -7.749   3.486 -14.011
   64   1HB   LYS  14          2HB       LYS  14  -6.702   4.803 -15.710
   65   2HB   LYS  14          1HB       LYS  14  -8.134   4.742 -16.734
   66   1HG   LYS  14          2HG       LYS  14  -8.242   6.896 -15.802
   67   2HG   LYS  14          1HG       LYS  14  -9.315   5.965 -14.760
   68   1HD   LYS  14          2HD       LYS  14  -6.706   5.660 -13.702
   69   2HD   LYS  14          1HD       LYS  14  -6.907   7.376 -14.056
   70   1HE   LYS  14          2HE       LYS  14  -9.231   6.046 -12.765
   71   2HE   LYS  14          1HE       LYS  14  -7.790   6.266 -11.753
   72   1HZ   LYS  14          1HZ       LYS  14  -7.950   8.495 -11.845
   73   2HZ   LYS  14          2HZ       LYS  14  -9.578   8.206 -12.234
   74   3HZ   LYS  14          3HZ       LYS  14  -8.448   8.508 -13.466
   75    H    ALA  15           H        ALA  15 -10.196   2.486 -16.205
   76    HA   ALA  15           HA       ALA  15 -12.364   4.075 -14.998
   77   1HB   ALA  15          1HB       ALA  15 -12.106   1.879 -17.063
   78   2HB   ALA  15          2HB       ALA  15 -12.578   3.560 -17.312
   79   3HB   ALA  15          3HB       ALA  15 -13.687   2.440 -16.520
   80    H    LYS  16           H        LYS  16 -11.143   0.739 -14.910
   81    HA   LYS  16           HA       LYS  16 -13.217  -0.129 -13.027
   82   1HB   LYS  16          2HB       LYS  16 -12.368  -2.224 -13.511
   83   2HB   LYS  16          1HB       LYS  16 -11.777  -1.351 -14.920
   84   1HG   LYS  16          2HG       LYS  16  -9.638  -0.940 -13.732
   85   2HG   LYS  16          1HG       LYS  16 -10.231  -1.910 -12.384
   86   1HD   LYS  16          2HD       LYS  16 -10.487  -3.239 -14.996
   87   2HD   LYS  16          1HD       LYS  16  -8.818  -2.910 -14.528
   88   1HE   LYS  16          2HE       LYS  16  -8.937  -4.282 -12.643
   89   2HE   LYS  16          1HE       LYS  16 -10.698  -4.106 -12.505
   90   1HZ   LYS  16          1HZ       LYS  16 -11.022  -5.403 -14.447
   91   2HZ   LYS  16          2HZ       LYS  16  -9.944  -6.275 -13.465
   92   3HZ   LYS  16          3HZ       LYS  16  -9.365  -5.413 -14.811
   93    H    TYR  17           H        TYR  17 -10.095   1.328 -12.936
   94    HA   TYR  17           HA       TYR  17  -9.453   0.560 -10.173
   95   1HB   TYR  17          2HB       TYR  17  -8.368   2.632 -12.114
   96   2HB   TYR  17          1HB       TYR  17  -7.633   2.245 -10.563
   97    HD1  TYR  17           HD1      TYR  17  -9.028  -0.734 -11.669
   98    HD2  TYR  17           HD2      TYR  17  -5.754   1.906 -12.521
   99    HE1  TYR  17           HE1      TYR  17  -7.800  -2.604 -12.738
  100    HE2  TYR  17           HE2      TYR  17  -4.514   0.037 -13.581
  101    HH   TYR  17           HH       TYR  17  -5.613  -2.444 -14.764
  102    H    ASP  18           H        ASP  18 -10.816   3.300 -11.936
  103    HA   ASP  18           HA       ASP  18 -10.971   5.072  -9.616
  104   1HB   ASP  18          2HB       ASP  18 -10.825   6.001 -11.821
  105   2HB   ASP  18          1HB       ASP  18 -12.160   5.002 -12.401
  106    H    ALA  19           H        ALA  19 -12.747   2.354 -10.580
  107    HA   ALA  19           HA       ALA  19 -15.297   3.299  -9.366
  108   1HB   ALA  19          1HB       ALA  19 -15.887   1.967 -11.148
  109   2HB   ALA  19          2HB       ALA  19 -15.603   0.646 -10.015
  110   3HB   ALA  19          3HB       ALA  19 -14.338   1.125 -11.148
  111    H    ILE  20           H        ILE  20 -12.543   1.223  -8.851
  112    HA   ILE  20           HA       ILE  20 -13.549  -0.012  -6.398
  113    HB   ILE  20           HB       ILE  20 -10.944   0.167  -7.932
  114   1HG1  ILE  20          2HG1      ILE  20 -12.515  -2.307  -7.226
  115   2HG1  ILE  20          1HG1      ILE  20 -12.976  -1.311  -8.608
  116   1HG2  ILE  20          1HG2      ILE  20 -11.273  -0.359  -5.150
  117   2HG2  ILE  20          2HG2      ILE  20  -9.803  -0.438  -6.116
  118   3HG2  ILE  20          3HG2      ILE  20 -10.824  -1.864  -5.950
  119   1HD1  ILE  20          1HD1      ILE  20 -11.465  -3.081  -9.356
  120   2HD1  ILE  20          2HD1      ILE  20 -10.269  -2.602  -8.151
  121   3HD1  ILE  20          3HD1      ILE  20 -10.654  -1.519  -9.492
  122    H    PHE  21           H        PHE  21 -11.494   2.665  -7.415
  123    HA   PHE  21           HA       PHE  21 -10.466   3.388  -4.833
  124   1HB   PHE  21          2HB       PHE  21  -9.247   4.357  -6.517
  125   2HB   PHE  21          1HB       PHE  21 -10.633   4.434  -7.598
  126    HD1  PHE  21           HD1      PHE  21  -8.490   6.290  -5.400
  127    HD2  PHE  21           HD2      PHE  21 -12.433   6.218  -7.102
  128    HE1  PHE  21           HE1      PHE  21  -8.746   8.709  -4.911
  129    HE2  PHE  21           HE2      PHE  21 -12.689   8.635  -6.614
  130    HZ   PHE  21           HZ       PHE  21 -10.846   9.880  -5.519
  131    H    ASP  22           H        ASP  22 -13.388   4.187  -6.632
  132    HA   ASP  22           HA       ASP  22 -14.287   6.109  -4.567
  133   1HB   ASP  22          2HB       ASP  22 -14.680   6.695  -6.850
  134   2HB   ASP  22          1HB       ASP  22 -15.340   5.099  -7.217
  135    H    SER  23           H        SER  23 -14.391   2.765  -5.080
  136    HA   SER  23           HA       SER  23 -17.078   2.246  -4.044
  137   1HB   SER  23          2HB       SER  23 -15.083   0.856  -5.404
  138   2HB   SER  23          1HB       SER  23 -15.054   0.132  -3.800
  139    HG   SER  23           HG       SER  23 -17.522   0.609  -5.039
  140    H    LEU  24           H        LEU  24 -14.045   3.097  -2.752
  141    HA   LEU  24           HA       LEU  24 -14.533   1.916  -0.084
  142   1HB   LEU  24          2HB       LEU  24 -12.336   3.794  -0.981
  143   2HB   LEU  24          1HB       LEU  24 -12.273   2.588   0.304
  144    HG   LEU  24           HG       LEU  24 -12.668   1.859  -2.603
  145   1HD1  LEU  24          1HD1      LEU  24 -10.305   2.860  -1.319
  146   2HD1  LEU  24          2HD1      LEU  24 -10.491   2.279  -2.976
  147   3HD1  LEU  24          3HD1      LEU  24 -10.072   1.151  -1.688
  148   1HD2  LEU  24          1HD2      LEU  24 -11.470   0.171  -0.425
  149   2HD2  LEU  24          2HD2      LEU  24 -12.289  -0.345  -1.900
  150   3HD2  LEU  24          3HD2      LEU  24 -13.222   0.318  -0.558
  151    H    SER  25           H        SER  25 -13.829   5.080  -1.499
  152    HA   SER  25           HA       SER  25 -15.680   6.864  -0.836
  153   1HB   SER  25          2HB       SER  25 -14.537   5.782   1.728
  154   2HB   SER  25          1HB       SER  25 -15.061   7.461   1.662
  155    HG   SER  25           HG       SER  25 -16.569   5.108   1.197
  156    HA   PRO  26           HA       PRO  26 -11.626   8.685  -1.727
  157   1HB   PRO  26          2HB       PRO  26 -12.557  10.494  -3.542
  158   2HB   PRO  26          1HB       PRO  26 -12.212   8.803  -3.953
  159   1HG   PRO  26          2HG       PRO  26 -14.816  10.120  -3.414
  160   2HG   PRO  26          1HG       PRO  26 -14.411   8.858  -4.587
  161   1HD   PRO  26          2HD       PRO  26 -15.670   8.389  -2.190
  162   2HD   PRO  26          1HD       PRO  26 -14.710   7.177  -3.066
  163    H    VAL  27           H        VAL  27 -10.752  10.670  -1.038
  164    HA   VAL  27           HA       VAL  27 -12.648  12.586   0.279
  165    HB   VAL  27           HB       VAL  27  -9.884  11.693   1.179
  166   1HG1  VAL  27          1HG1      VAL  27 -11.918  13.141   2.859
  167   2HG1  VAL  27          2HG1      VAL  27 -10.877  14.052   1.764
  168   3HG1  VAL  27          3HG1      VAL  27 -10.166  13.075   3.050
  169   1HG2  VAL  27          1HG2      VAL  27 -11.005   9.853   1.903
  170   2HG2  VAL  27          2HG2      VAL  27 -12.577  10.594   1.600
  171   3HG2  VAL  27          3HG2      VAL  27 -11.720  10.928   3.104
  172    H    ASN  28           H        ASN  28 -12.566  14.299  -1.175
  173    HA   ASN  28           HA       ASN  28 -11.629  16.075  -2.420
  174   1HB   ASN  28          2HB       ASN  28 -10.613  16.542  -0.238
  175   2HB   ASN  28          1HB       ASN  28  -9.330  15.378  -0.562
  176   1HD2  ASN  28          1HD2      ASN  28  -7.514  16.116  -1.722
  177   2HD2  ASN  28          2HD2      ASN  28  -7.402  17.654  -2.431
  178    H    GLY  29           H        GLY  29 -11.088  13.049  -3.025
  179   1HA   GLY  29          2HA       GLY  29 -10.286  12.233  -5.156
  180   2HA   GLY  29          1HA       GLY  29  -9.172  13.598  -5.228
  181    H    PHE  30           H        PHE  30  -9.623  11.479  -2.428
  182    HA   PHE  30           HA       PHE  30  -7.042  10.122  -2.988
  183   1HB   PHE  30          2HB       PHE  30  -7.600  11.967  -0.656
  184   2HB   PHE  30          1HB       PHE  30  -6.204  10.880  -0.729
  185    HD1  PHE  30           HD1      PHE  30  -7.542  14.052  -1.723
  186    HD2  PHE  30           HD2      PHE  30  -4.694  11.028  -2.795
  187    HE1  PHE  30           HE1      PHE  30  -6.361  15.685  -3.151
  188    HE2  PHE  30           HE2      PHE  30  -3.496  12.670  -4.232
  189    HZ   PHE  30           HZ       PHE  30  -4.332  15.002  -4.409
  190    H    LEU  31           H        LEU  31  -6.835   8.173  -1.975
  191    HA   LEU  31           HA       LEU  31  -9.109   7.303  -0.215
  192   1HB   LEU  31          2HB       LEU  31  -7.345   5.944  -2.246
  193   2HB   LEU  31          1HB       LEU  31  -8.075   4.993  -0.954
  194    HG   LEU  31           HG       LEU  31  -9.472   6.578  -3.108
  195   1HD1  LEU  31          1HD1      LEU  31 -10.636   4.140  -2.952
  196   2HD1  LEU  31          2HD1      LEU  31  -9.027   3.739  -2.353
  197   3HD1  LEU  31          3HD1      LEU  31  -9.220   4.461  -3.955
  198   1HD2  LEU  31          1HD2      LEU  31 -10.721   7.126  -1.148
  199   2HD2  LEU  31          2HD2      LEU  31 -10.517   5.508  -0.477
  200   3HD2  LEU  31          3HD2      LEU  31 -11.576   5.759  -1.865
  201    H    SER  32           H        SER  32  -8.510   6.587   1.841
  202    HA   SER  32           HA       SER  32  -5.736   7.070   2.640
  203   1HB   SER  32          2HB       SER  32  -7.608   5.745   4.498
  204   2HB   SER  32          1HB       SER  32  -6.663   7.214   4.723
  205    HG   SER  32           HG       SER  32  -8.487   8.192   4.371
  206    H    GLY  33           H        GLY  33  -4.216   5.525   3.157
  207   1HA   GLY  33          2HA       GLY  33  -4.100   3.049   1.934
  208   2HA   GLY  33          1HA       GLY  33  -3.317   3.350   3.487
  209    H    ASP  34           H        ASP  34  -5.956   3.931   4.758
  210    HA   ASP  34           HA       ASP  34  -6.562   1.320   5.764
  211   1HB   ASP  34          2HB       ASP  34  -6.942   3.365   7.028
  212   2HB   ASP  34          1HB       ASP  34  -8.052   3.962   5.793
  213    H    LYS  35           H        LYS  35  -7.857   3.190   3.056
  214    HA   LYS  35           HA       LYS  35 -10.119   1.306   2.708
  215   1HB   LYS  35          2HB       LYS  35  -9.118   3.812   1.318
  216   2HB   LYS  35          1HB       LYS  35 -10.510   2.896   0.742
  217   1HG   LYS  35          2HG       LYS  35 -11.728   3.295   2.762
  218   2HG   LYS  35          1HG       LYS  35 -10.294   3.916   3.579
  219   1HD   LYS  35          2HD       LYS  35 -10.246   5.721   1.739
  220   2HD   LYS  35          1HD       LYS  35 -11.895   5.214   1.375
  221   1HE   LYS  35          2HE       LYS  35 -12.502   5.621   3.779
  222   2HE   LYS  35          1HE       LYS  35 -10.872   6.284   4.028
  223   1HZ   LYS  35          1HZ       LYS  35 -11.252   8.016   2.582
  224   2HZ   LYS  35          2HZ       LYS  35 -12.781   7.862   3.306
  225   3HZ   LYS  35          3HZ       LYS  35 -12.500   7.214   1.760
  226    H    VAL  36           H        VAL  36  -7.013   2.229   1.341
  227    HA   VAL  36           HA       VAL  36  -7.179   0.466  -0.977
  228    HB   VAL  36           HB       VAL  36  -4.933   1.863   0.497
  229   1HG1  VAL  36          1HG1      VAL  36  -4.186   1.359  -2.163
  230   2HG1  VAL  36          2HG1      VAL  36  -4.868  -0.156  -1.575
  231   3HG1  VAL  36          3HG1      VAL  36  -3.526   0.597  -0.716
  232   1HG2  VAL  36          1HG2      VAL  36  -6.649   3.316  -0.559
  233   2HG2  VAL  36          2HG2      VAL  36  -6.360   2.508  -2.103
  234   3HG2  VAL  36          3HG2      VAL  36  -5.080   3.467  -1.356
  235    H    LYS  37           H        LYS  37  -5.682   0.317   2.244
  236    HA   LYS  37           HA       LYS  37  -4.126  -1.905   2.265
  237   1HB   LYS  37          2HB       LYS  37  -6.064  -0.651   4.094
  238   2HB   LYS  37          1HB       LYS  37  -5.709  -2.333   4.485
  239   1HG   LYS  37          2HG       LYS  37  -3.264  -1.781   4.356
  240   2HG   LYS  37          1HG       LYS  37  -3.705  -0.086   4.156
  241   1HD   LYS  37          2HD       LYS  37  -3.197  -0.616   6.522
  242   2HD   LYS  37          1HD       LYS  37  -4.876  -0.119   6.317
  243   1HE   LYS  37          2HE       LYS  37  -5.613  -2.110   7.110
  244   2HE   LYS  37          1HE       LYS  37  -4.607  -2.992   5.943
  245   1HZ   LYS  37          1HZ       LYS  37  -3.693  -3.533   8.012
  246   2HZ   LYS  37          2HZ       LYS  37  -3.844  -1.947   8.605
  247   3HZ   LYS  37          3HZ       LYS  37  -2.675  -2.309   7.426
  248    HA   PRO  38           HA       PRO  38  -7.839  -4.956   2.465
  249   1HB   PRO  38          2HB       PRO  38 -10.314  -3.929   1.867
  250   2HB   PRO  38          1HB       PRO  38  -9.672  -4.021   3.519
  251   1HG   PRO  38          2HG       PRO  38  -9.757  -1.700   1.647
  252   2HG   PRO  38          1HG       PRO  38 -10.071  -1.754   3.389
  253   1HD   PRO  38          2HD       PRO  38  -7.740  -0.860   2.370
  254   2HD   PRO  38          1HD       PRO  38  -7.834  -1.702   3.933
  255    H    VAL  39           H        VAL  39  -8.094  -2.292   0.151
  256    HA   VAL  39           HA       VAL  39  -9.104  -3.743  -2.090
  257    HB   VAL  39           HB       VAL  39  -7.517  -1.256  -1.555
  258   1HG1  VAL  39          1HG1      VAL  39  -8.171  -2.169  -4.366
  259   2HG1  VAL  39          2HG1      VAL  39  -6.565  -2.317  -3.654
  260   3HG1  VAL  39          3HG1      VAL  39  -7.281  -0.727  -3.883
  261   1HG2  VAL  39          1HG2      VAL  39  -9.916  -1.153  -1.295
  262   2HG2  VAL  39          2HG2      VAL  39 -10.165  -1.897  -2.874
  263   3HG2  VAL  39          3HG2      VAL  39  -9.493  -0.270  -2.762
  264    H    LEU  40           H        LEU  40  -5.906  -3.541  -0.651
  265    HA   LEU  40           HA       LEU  40  -4.655  -4.951  -2.954
  266   1HB   LEU  40          2HB       LEU  40  -3.420  -3.946  -0.377
  267   2HB   LEU  40          1HB       LEU  40  -2.604  -4.264  -1.909
  268    HG   LEU  40           HG       LEU  40  -4.778  -2.186  -1.574
  269   1HD1  LEU  40          1HD1      LEU  40  -1.791  -2.035  -1.263
  270   2HD1  LEU  40          2HD1      LEU  40  -3.050  -1.289  -0.275
  271   3HD1  LEU  40          3HD1      LEU  40  -2.682  -0.643  -1.877
  272   1HD2  LEU  40          1HD2      LEU  40  -3.892  -1.394  -3.751
  273   2HD2  LEU  40          2HD2      LEU  40  -4.476  -3.057  -3.851
  274   3HD2  LEU  40          3HD2      LEU  40  -2.744  -2.733  -3.756
  275    H    LEU  41           H        LEU  41  -5.484  -5.417   0.457
  276    HA   LEU  41           HA       LEU  41  -4.090  -7.945   0.757
  277   1HB   LEU  41          2HB       LEU  41  -6.409  -6.661   2.240
  278   2HB   LEU  41          1HB       LEU  41  -5.455  -8.023   2.834
  279    HG   LEU  41           HG       LEU  41  -4.053  -5.510   1.993
  280   1HD1  LEU  41          1HD1      LEU  41  -6.108  -5.395   3.816
  281   2HD1  LEU  41          2HD1      LEU  41  -4.718  -4.307   3.805
  282   3HD1  LEU  41          3HD1      LEU  41  -4.720  -5.725   4.855
  283   1HD2  LEU  41          1HD2      LEU  41  -2.287  -6.494   3.044
  284   2HD2  LEU  41          2HD2      LEU  41  -3.248  -7.970   2.941
  285   3HD2  LEU  41          3HD2      LEU  41  -3.278  -6.999   4.414
  286    H    ASN  42           H        ASN  42  -6.877  -6.987  -0.920
  287    HA   ASN  42           HA       ASN  42  -8.303  -9.526  -0.537
  288   1HB   ASN  42          2HB       ASN  42  -8.760  -6.857  -1.759
  289   2HB   ASN  42          1HB       ASN  42  -9.639  -8.200  -2.491
  290   1HD2  ASN  42          1HD2      ASN  42 -10.475  -5.881  -0.573
  291   2HD2  ASN  42          2HD2      ASN  42 -11.338  -6.681   0.651
  292    H    SER  43           H        SER  43  -5.800  -8.352  -2.488
  293    HA   SER  43           HA       SER  43  -6.444  -9.829  -4.938
  294   1HB   SER  43          2HB       SER  43  -4.461  -8.812  -5.719
  295   2HB   SER  43          1HB       SER  43  -5.072  -7.649  -4.546
  296    HG   SER  43           HG       SER  43  -3.086  -9.643  -4.138
  297    H    LYS  44           H        LYS  44  -5.639 -10.903  -1.951
  298    HA   LYS  44           HA       LYS  44  -4.788 -12.982  -1.202
  299   1HB   LYS  44          2HB       LYS  44  -5.847 -13.423  -3.653
  300   2HB   LYS  44          1HB       LYS  44  -4.160 -13.815  -3.991
  301   1HG   LYS  44          2HG       LYS  44  -4.171 -15.659  -2.634
  302   2HG   LYS  44          1HG       LYS  44  -5.291 -14.933  -1.480
  303   1HD   LYS  44          2HD       LYS  44  -6.565 -16.632  -2.515
  304   2HD   LYS  44          1HD       LYS  44  -7.060 -15.161  -3.352
  305   1HE   LYS  44          2HE       LYS  44  -5.719 -15.669  -5.261
  306   2HE   LYS  44          1HE       LYS  44  -4.826 -16.929  -4.386
  307   1HZ   LYS  44          1HZ       LYS  44  -6.844 -17.571  -5.889
  308   2HZ   LYS  44          2HZ       LYS  44  -7.755 -17.097  -4.536
  309   3HZ   LYS  44          3HZ       LYS  44  -6.609 -18.346  -4.399
  310    H    LEU  45           H        LEU  45  -3.080 -10.544  -2.166
  311    HA   LEU  45           HA       LEU  45  -0.481 -11.936  -2.630
  312   1HB   LEU  45          2HB       LEU  45  -1.627  -9.193  -3.025
  313   2HB   LEU  45          1HB       LEU  45   0.121  -9.363  -2.863
  314    HG   LEU  45           HG       LEU  45  -1.565 -10.939  -4.826
  315   1HD1  LEU  45          1HD1      LEU  45  -0.449  -9.439  -6.518
  316   2HD1  LEU  45          2HD1      LEU  45   0.130  -8.452  -5.177
  317   3HD1  LEU  45          3HD1      LEU  45  -1.601  -8.606  -5.476
  318   1HD2  LEU  45          1HD2      LEU  45   1.364 -10.538  -5.145
  319   2HD2  LEU  45          2HD2      LEU  45   0.384 -11.964  -5.480
  320   3HD2  LEU  45          3HD2      LEU  45   0.869 -11.597  -3.825
  321    HA   PRO  46           HA       PRO  46   0.788 -11.187   1.491
  322   1HB   PRO  46          2HB       PRO  46   3.493 -10.989   1.136
  323   2HB   PRO  46          1HB       PRO  46   2.613 -12.525   1.026
  324   1HG   PRO  46          2HG       PRO  46   3.668 -10.796  -1.133
  325   2HG   PRO  46          1HG       PRO  46   3.530 -12.556  -1.058
  326   1HD   PRO  46          2HD       PRO  46   1.814 -10.898  -2.440
  327   2HD   PRO  46          1HD       PRO  46   1.426 -12.547  -1.909
  328    H    VAL  47           H        VAL  47   2.028  -9.521   2.825
  329    HA   VAL  47           HA       VAL  47   1.326  -6.849   2.063
  330    HB   VAL  47           HB       VAL  47   2.525  -8.372   4.280
  331   1HG1  VAL  47          1HG1      VAL  47   4.418  -6.999   4.242
  332   2HG1  VAL  47          2HG1      VAL  47   3.338  -6.117   5.323
  333   3HG1  VAL  47          3HG1      VAL  47   3.516  -5.607   3.645
  334   1HG2  VAL  47          1HG2      VAL  47   0.720  -7.511   5.311
  335   2HG2  VAL  47          2HG2      VAL  47   0.268  -6.822   3.753
  336   3HG2  VAL  47          3HG2      VAL  47   1.193  -5.862   4.907
  337    H    ASP  48           H        ASP  48   3.894  -8.852   1.113
  338    HA   ASP  48           HA       ASP  48   5.986  -6.861   0.941
  339   1HB   ASP  48          2HB       ASP  48   5.467  -9.638  -0.085
  340   2HB   ASP  48          1HB       ASP  48   6.856  -8.729  -0.680
  341    H    ILE  49           H        ILE  49   3.397  -8.035  -1.115
  342    HA   ILE  49           HA       ILE  49   4.346  -6.563  -3.470
  343    HB   ILE  49           HB       ILE  49   1.589  -7.712  -3.019
  344   1HG1  ILE  49          2HG1      ILE  49   3.079  -9.453  -2.244
  345   2HG1  ILE  49          1HG1      ILE  49   2.540  -9.888  -3.863
  346   1HG2  ILE  49          1HG2      ILE  49   2.639  -8.372  -5.540
  347   2HG2  ILE  49          2HG2      ILE  49   3.149  -6.709  -5.241
  348   3HG2  ILE  49          3HG2      ILE  49   1.438  -7.130  -5.184
  349   1HD1  ILE  49          1HD1      ILE  49   4.661  -8.673  -4.685
  350   2HD1  ILE  49          2HD1      ILE  49   4.862 -10.255  -3.929
  351   3HD1  ILE  49          3HD1      ILE  49   5.208  -8.788  -3.012
  352    H    LEU  50           H        LEU  50   1.920  -6.266  -0.942
  353    HA   LEU  50           HA       LEU  50   0.664  -3.875  -2.003
  354   1HB   LEU  50          2HB       LEU  50   0.740  -4.869   0.846
  355   2HB   LEU  50          1HB       LEU  50  -0.553  -3.978   0.046
  356    HG   LEU  50           HG       LEU  50   0.268  -6.856  -0.372
  357   1HD1  LEU  50          1HD1      LEU  50  -2.255  -5.405   0.433
  358   2HD1  LEU  50          2HD1      LEU  50  -1.364  -6.632   1.336
  359   3HD1  LEU  50          3HD1      LEU  50  -2.274  -7.085  -0.106
  360   1HD2  LEU  50          1HD2      LEU  50  -0.904  -4.943  -2.289
  361   2HD2  LEU  50          2HD2      LEU  50  -1.818  -6.442  -2.108
  362   3HD2  LEU  50          3HD2      LEU  50  -0.121  -6.496  -2.586
  363    H    GLY  51           H        GLY  51   3.426  -4.592   0.031
  364   1HA   GLY  51          2HA       GLY  51   3.677  -1.942   1.187
  365   2HA   GLY  51          1HA       GLY  51   4.959  -3.159   1.120
  366    H    ARG  52           H        ARG  52   4.596  -3.497  -1.757
  367    HA   ARG  52           HA       ARG  52   6.142  -1.139  -2.684
  368   1HB   ARG  52          2HB       ARG  52   6.116  -4.030  -3.112
  369   2HB   ARG  52          1HB       ARG  52   6.193  -3.124  -4.625
  370   1HG   ARG  52          2HG       ARG  52   8.093  -1.826  -3.756
  371   2HG   ARG  52          1HG       ARG  52   8.017  -2.732  -2.245
  372   1HD   ARG  52          2HD       ARG  52   8.105  -4.550  -4.507
  373   2HD   ARG  52          1HD       ARG  52   9.495  -3.441  -4.521
  374    HE   ARG  52           HE       ARG  52   9.183  -4.207  -1.847
  375   1HH1  ARG  52          1HH2      ARG  52   9.922  -5.601  -4.911
  376   2HH1  ARG  52          2HH2      ARG  52  10.729  -6.977  -4.236
  377   1HH2  ARG  52          2HH1      ARG  52  10.135  -6.045  -0.948
  378   2HH2  ARG  52          1HH1      ARG  52  10.850  -7.229  -1.991
  379    H    VAL  53           H        VAL  53   3.211  -3.020  -3.340
  380    HA   VAL  53           HA       VAL  53   2.591  -1.807  -5.879
  381    HB   VAL  53           HB       VAL  53   1.093  -3.225  -3.683
  382   1HG1  VAL  53          1HG1      VAL  53  -0.223  -2.350  -6.258
  383   2HG1  VAL  53          2HG1      VAL  53  -0.360  -1.399  -4.779
  384   3HG1  VAL  53          3HG1      VAL  53  -0.979  -3.047  -4.826
  385   1HG2  VAL  53          1HG2      VAL  53   2.625  -4.259  -5.523
  386   2HG2  VAL  53          2HG2      VAL  53   1.263  -3.939  -6.606
  387   3HG2  VAL  53          3HG2      VAL  53   1.056  -5.005  -5.212
  388    H    TRP  54           H        TRP  54   1.350  -1.115  -2.590
  389    HA   TRP  54           HA       TRP  54  -0.026   1.290  -3.242
  390   1HB   TRP  54          2HB       TRP  54  -0.413   0.370  -1.096
  391   2HB   TRP  54          1HB       TRP  54   1.313   0.130  -0.800
  392    HD1  TRP  54           HD1      TRP  54   2.798   2.374  -0.414
  393    HE1  TRP  54           HE1      TRP  54   2.162   4.622   0.626
  394    HE3  TRP  54           HE3      TRP  54  -2.291   2.022  -0.625
  395    HZ2  TRP  54           HZ2      TRP  54  -0.207   6.087   1.331
  396    HZ3  TRP  54           HZ3      TRP  54  -3.716   3.860   0.253
  397    HH2  TRP  54           HH2      TRP  54  -2.681   5.882   1.221
  398    H    GLU  55           H        GLU  55   3.249   0.770  -1.955
  399    HA   GLU  55           HA       GLU  55   4.297   3.312  -1.831
  400   1HB   GLU  55          2HB       GLU  55   5.097   0.611  -2.049
  401   2HB   GLU  55          1HB       GLU  55   6.142   1.560  -3.094
  402   1HG   GLU  55          2HG       GLU  55   6.893   1.282  -0.686
  403   2HG   GLU  55          1HG       GLU  55   6.842   2.937  -1.309
  404    H    LEU  56           H        LEU  56   4.816   1.247  -4.674
  405    HA   LEU  56           HA       LEU  56   5.616   3.384  -6.396
  406   1HB   LEU  56          2HB       LEU  56   4.349   0.689  -7.017
  407   2HB   LEU  56          1HB       LEU  56   5.246   1.683  -8.167
  408    HG   LEU  56           HG       LEU  56   6.648   1.126  -5.617
  409   1HD1  LEU  56          1HD1      LEU  56   6.956  -1.106  -7.483
  410   2HD1  LEU  56          2HD1      LEU  56   5.329  -1.009  -6.806
  411   3HD1  LEU  56          3HD1      LEU  56   6.725  -1.129  -5.733
  412   1HD2  LEU  56          1HD2      LEU  56   8.051   0.398  -8.032
  413   2HD2  LEU  56          2HD2      LEU  56   8.384   1.741  -6.939
  414   3HD2  LEU  56          3HD2      LEU  56   7.249   1.948  -8.272
  415    H    SER  57           H        SER  57   2.567   2.407  -5.174
  416    HA   SER  57           HA       SER  57   0.983   3.717  -7.298
  417   1HB   SER  57          2HB       SER  57  -0.042   1.794  -6.434
  418   2HB   SER  57          1HB       SER  57   0.495   2.132  -4.794
  419    HG   SER  57           HG       SER  57  -1.406   3.644  -6.266
  420    H    ASP  58           H        ASP  58   2.582   4.499  -4.343
  421    HA   ASP  58           HA       ASP  58   0.809   6.808  -3.742
  422   1HB   ASP  58          2HB       ASP  58   2.300   5.027  -2.253
  423   2HB   ASP  58          1HB       ASP  58   3.330   6.459  -2.267
  424    H    ILE  59           H        ILE  59   1.338   7.962  -5.769
  425    HA   ILE  59           HA       ILE  59   3.890   8.658  -6.713
  426    HB   ILE  59           HB       ILE  59   1.344  10.306  -6.612
  427   1HG1  ILE  59          2HG1      ILE  59   1.137   7.982  -7.580
  428   2HG1  ILE  59          1HG1      ILE  59   0.800   9.269  -8.734
  429   1HG2  ILE  59          1HG2      ILE  59   3.151  11.724  -7.292
  430   2HG2  ILE  59          2HG2      ILE  59   2.317  11.241  -8.769
  431   3HG2  ILE  59          3HG2      ILE  59   3.837  10.466  -8.320
  432   1HD1  ILE  59          1HD1      ILE  59   2.898   9.011  -9.806
  433   2HD1  ILE  59          2HD1      ILE  59   2.338   7.360  -9.527
  434   3HD1  ILE  59          3HD1      ILE  59   3.559   8.071  -8.468
  435    H    ASP  60           H        ASP  60   1.989  10.217  -4.124
  436    HA   ASP  60           HA       ASP  60   4.267  12.087  -3.629
  437   1HB   ASP  60          2HB       ASP  60   2.529  13.268  -2.259
  438   2HB   ASP  60          1HB       ASP  60   2.051  13.065  -3.945
  439    H    HIS  61           H        HIS  61   2.631   9.316  -2.319
  440    HA   HIS  61           HA       HIS  61   3.171   7.993  -0.430
  441   1HB   HIS  61          2HB       HIS  61   5.449   9.920   0.046
  442   2HB   HIS  61          1HB       HIS  61   5.393   8.189   0.374
  443    HD1  HIS  61           HD1      HIS  61   5.602   6.572  -1.692
  444    HD2  HIS  61           HD2      HIS  61   6.160  10.602  -2.599
  445    HE1  HIS  61           HE1      HIS  61   6.627   6.651  -4.009
  446    H    ASP  62           H        ASP  62   1.275  10.131  -0.160
  447    HA   ASP  62           HA       ASP  62   1.927  11.436   2.431
  448   1HB   ASP  62          2HB       ASP  62   0.119  12.877   1.881
  449   2HB   ASP  62          1HB       ASP  62   0.880  12.529   0.328
  450    H    GLY  63           H        GLY  63   0.711   8.510   1.480
  451   1HA   GLY  63          2HA       GLY  63  -0.164   6.878   3.016
  452   2HA   GLY  63          1HA       GLY  63  -0.744   8.190   4.043
  453    H    MET  64           H        MET  64  -1.313   8.309   0.600
  454    HA   MET  64           HA       MET  64  -4.034   7.197   0.874
  455   1HB   MET  64          2HB       MET  64  -3.524  10.078   0.083
  456   2HB   MET  64          1HB       MET  64  -5.096   9.286   0.188
  457   1HG   MET  64          2HG       MET  64  -4.684   8.878   2.603
  458   2HG   MET  64          1HG       MET  64  -3.190   9.806   2.475
  459   1HE   MET  64          1HE       MET  64  -7.057  11.107   3.694
  460   2HE   MET  64          2HE       MET  64  -6.389   9.504   3.397
  461   3HE   MET  64          3HE       MET  64  -7.338  10.301   2.145
  462    H    LEU  65           H        LEU  65  -5.145   7.074  -1.255
  463    HA   LEU  65           HA       LEU  65  -3.264   7.257  -3.586
  464   1HB   LEU  65          2HB       LEU  65  -5.120   5.080  -2.637
  465   2HB   LEU  65          1HB       LEU  65  -4.690   5.193  -4.342
  466    HG   LEU  65           HG       LEU  65  -2.721   4.973  -2.046
  467   1HD1  LEU  65          1HD1      LEU  65  -2.944   2.747  -2.251
  468   2HD1  LEU  65          2HD1      LEU  65  -2.606   2.849  -3.978
  469   3HD1  LEU  65          3HD1      LEU  65  -4.264   3.002  -3.393
  470   1HD2  LEU  65          1HD2      LEU  65  -1.078   4.635  -3.910
  471   2HD2  LEU  65          2HD2      LEU  65  -1.777   6.251  -3.900
  472   3HD2  LEU  65          3HD2      LEU  65  -2.350   5.051  -5.059
  473    H    ASP  66           H        ASP  66  -4.096   8.892  -4.844
  474    HA   ASP  66           HA       ASP  66  -6.880   9.692  -4.772
  475   1HB   ASP  66          2HB       ASP  66  -5.327  11.373  -5.269
  476   2HB   ASP  66          1HB       ASP  66  -4.413  10.343  -6.365
  477    H    ARG  67           H        ARG  67  -8.092   9.842  -6.952
  478    HA   ARG  67           HA       ARG  67  -8.797   7.276  -7.872
  479   1HB   ARG  67          2HB       ARG  67  -9.621   8.675  -9.921
  480   2HB   ARG  67          1HB       ARG  67 -10.296   9.026  -8.332
  481   1HG   ARG  67          2HG       ARG  67  -7.871  10.539  -8.705
  482   2HG   ARG  67          1HG       ARG  67  -8.962  10.822 -10.061
  483   1HD   ARG  67          2HD       ARG  67 -10.700  10.902  -7.926
  484   2HD   ARG  67          1HD       ARG  67  -9.240  11.645  -7.247
  485    HE   ARG  67           HE       ARG  67  -9.982  12.567  -9.946
  486   1HH1  ARG  67          1HH2      ARG  67  -8.580  13.675  -7.242
  487   2HH1  ARG  67          2HH2      ARG  67  -9.569  15.080  -7.024
  488   1HH2  ARG  67          2HH1      ARG  67 -11.932  14.105  -9.368
  489   2HH2  ARG  67          1HH1      ARG  67 -11.467  15.323  -8.227
  490    H    ASP  68           H        ASP  68  -6.420   9.538  -9.251
  491    HA   ASP  68           HA       ASP  68  -5.725   7.707 -11.434
  492   1HB   ASP  68          2HB       ASP  68  -5.287  10.448 -10.611
  493   2HB   ASP  68          1HB       ASP  68  -3.755   9.704 -11.068
  494    H    GLU  69           H        GLU  69  -4.397   8.636  -8.281
  495    HA   GLU  69           HA       GLU  69  -1.916   7.153  -8.572
  496   1HB   GLU  69          2HB       GLU  69  -3.182   8.941  -6.765
  497   2HB   GLU  69          1HB       GLU  69  -2.813   7.479  -5.847
  498   1HG   GLU  69          2HG       GLU  69  -0.490   7.566  -6.550
  499   2HG   GLU  69          1HG       GLU  69  -0.825   8.944  -7.598
  500    H    PHE  70           H        PHE  70  -5.021   6.541  -6.953
  501    HA   PHE  70           HA       PHE  70  -4.463   3.952  -5.932
  502   1HB   PHE  70          2HB       PHE  70  -6.391   5.445  -5.385
  503   2HB   PHE  70          1HB       PHE  70  -7.042   5.157  -6.999
  504    HD1  PHE  70           HD1      PHE  70  -6.904   3.975  -3.625
  505    HD2  PHE  70           HD2      PHE  70  -7.449   2.705  -7.689
  506    HE1  PHE  70           HE1      PHE  70  -7.987   1.891  -2.828
  507    HE2  PHE  70           HE2      PHE  70  -8.529   0.628  -6.897
  508    HZ   PHE  70           HZ       PHE  70  -8.798   0.217  -4.465
  509    H    ALA  71           H        ALA  71  -4.913   5.130  -9.140
  510    HA   ALA  71           HA       ALA  71  -5.864   2.683 -10.387
  511   1HB   ALA  71          1HB       ALA  71  -5.985   5.092 -11.223
  512   2HB   ALA  71          2HB       ALA  71  -5.416   3.920 -12.411
  513   3HB   ALA  71          3HB       ALA  71  -4.261   4.963 -11.578
  514    H    VAL  72           H        VAL  72  -2.710   4.228  -9.967
  515    HA   VAL  72           HA       VAL  72  -1.112   2.358 -11.391
  516    HB   VAL  72           HB       VAL  72  -0.486   3.999  -8.910
  517   1HG1  VAL  72          1HG1      VAL  72   1.663   3.403  -9.207
  518   2HG1  VAL  72          2HG1      VAL  72   1.594   3.816 -10.921
  519   3HG1  VAL  72          3HG1      VAL  72   1.110   2.209 -10.379
  520   1HG2  VAL  72          1HG2      VAL  72  -1.473   5.471 -10.536
  521   2HG2  VAL  72          2HG2      VAL  72  -0.577   4.714 -11.854
  522   3HG2  VAL  72          3HG2      VAL  72   0.274   5.694 -10.657
  523    H    ALA  73           H        ALA  73  -2.596   2.238  -8.216
  524    HA   ALA  73           HA       ALA  73  -0.985  -0.097  -7.360
  525   1HB   ALA  73          1HB       ALA  73  -1.483   0.902  -5.406
  526   2HB   ALA  73          2HB       ALA  73  -3.168   0.425  -5.637
  527   3HB   ALA  73          3HB       ALA  73  -2.604   1.993  -6.221
  528    H    MET  74           H        MET  74  -3.770   0.362  -9.254
  529    HA   MET  74           HA       MET  74  -5.240  -2.013  -8.312
  530   1HB   MET  74          2HB       MET  74  -5.476   0.049 -10.502
  531   2HB   MET  74          1HB       MET  74  -6.487  -1.394 -10.543
  532   1HG   MET  74          2HG       MET  74  -6.319   0.198  -8.010
  533   2HG   MET  74          1HG       MET  74  -7.349   0.771  -9.322
  534   1HE   MET  74          1HE       MET  74  -7.926  -1.234  -6.039
  535   2HE   MET  74          2HE       MET  74  -6.369  -1.507  -6.821
  536   3HE   MET  74          3HE       MET  74  -7.527  -2.831  -6.687
  537    H    PHE  75           H        PHE  75  -3.430  -1.108 -11.249
  538    HA   PHE  75           HA       PHE  75  -3.578  -3.805 -12.331
  539   1HB   PHE  75          2HB       PHE  75  -2.473  -2.835 -14.153
  540   2HB   PHE  75          1HB       PHE  75  -3.244  -1.422 -13.435
  541    HD1  PHE  75           HD1      PHE  75  -0.085  -3.110 -14.130
  542    HD2  PHE  75           HD2      PHE  75  -1.934   0.136 -12.010
  543    HE1  PHE  75           HE1      PHE  75   2.135  -2.055 -13.812
  544    HE2  PHE  75           HE2      PHE  75   0.283   1.187 -11.693
  545    HZ   PHE  75           HZ       PHE  75   2.321   0.095 -12.592
  546    H    LEU  76           H        LEU  76  -1.439  -1.981 -10.247
  547    HA   LEU  76           HA       LEU  76   0.848  -3.728 -10.351
  548   1HB   LEU  76          2HB       LEU  76  -0.262  -1.564  -8.627
  549   2HB   LEU  76          1HB       LEU  76   0.948  -2.615  -7.890
  550    HG   LEU  76           HG       LEU  76   1.321  -1.200 -10.544
  551   1HD1  LEU  76          1HD1      LEU  76   1.735  -0.338  -7.749
  552   2HD1  LEU  76          2HD1      LEU  76   1.574   0.631  -9.214
  553   3HD1  LEU  76          3HD1      LEU  76   3.126  -0.100  -8.807
  554   1HD2  LEU  76          1HD2      LEU  76   3.710  -1.830 -10.141
  555   2HD2  LEU  76          2HD2      LEU  76   2.657  -3.233 -10.329
  556   3HD2  LEU  76          3HD2      LEU  76   3.196  -2.743  -8.722
  557    H    VAL  77           H        VAL  77  -2.275  -3.895  -8.857
  558    HA   VAL  77           HA       VAL  77  -1.483  -6.039  -6.978
  559    HB   VAL  77           HB       VAL  77  -4.030  -4.501  -7.615
  560   1HG1  VAL  77          1HG1      VAL  77  -3.603  -6.562  -5.420
  561   2HG1  VAL  77          2HG1      VAL  77  -4.505  -6.874  -6.903
  562   3HG1  VAL  77          3HG1      VAL  77  -5.085  -5.667  -5.755
  563   1HG2  VAL  77          1HG2      VAL  77  -3.573  -3.299  -5.666
  564   2HG2  VAL  77          2HG2      VAL  77  -1.949  -3.573  -6.300
  565   3HG2  VAL  77          3HG2      VAL  77  -2.566  -4.578  -4.988
  566    H    TYR  78           H        TYR  78  -3.625  -5.591  -9.799
  567    HA   TYR  78           HA       TYR  78  -4.352  -8.397  -9.894
  568   1HB   TYR  78          2HB       TYR  78  -4.773  -5.904 -11.466
  569   2HB   TYR  78          1HB       TYR  78  -5.045  -7.437 -12.301
  570    HD1  TYR  78           HD1      TYR  78  -6.792  -5.008 -10.695
  571    HD2  TYR  78           HD2      TYR  78  -6.113  -9.242 -10.418
  572    HE1  TYR  78           HE1      TYR  78  -8.948  -5.272  -9.500
  573    HE2  TYR  78           HE2      TYR  78  -8.270  -9.508  -9.219
  574    HH   TYR  78           HH       TYR  78  -9.873  -8.311  -8.029
  575    H    CYS  79           H        CYS  79  -1.733  -6.481 -11.180
  576    HA   CYS  79           HA       CYS  79  -1.016  -8.482 -13.208
  577   1HB   CYS  79          2HB       CYS  79   0.299  -5.967 -12.131
  578   2HB   CYS  79          1HB       CYS  79   0.952  -6.916 -13.465
  579    HG   CYS  79           HG       CYS  79  -1.936  -6.186 -14.012
  580    H    ALA  80           H        ALA  80  -0.371  -7.869  -9.848
  581    HA   ALA  80           HA       ALA  80   2.164  -9.324  -9.753
  582   1HB   ALA  80          1HB       ALA  80   0.197  -8.073  -7.876
  583   2HB   ALA  80          2HB       ALA  80   1.936  -7.809  -8.007
  584   3HB   ALA  80          3HB       ALA  80   1.322  -9.258  -7.212
  585    H    LEU  81           H        LEU  81  -1.146 -10.134  -9.950
  586    HA   LEU  81           HA       LEU  81  -0.854 -12.748  -8.620
  587   1HB   LEU  81          2HB       LEU  81  -3.080 -11.171  -9.895
  588   2HB   LEU  81          1HB       LEU  81  -3.313 -12.839  -9.370
  589    HG   LEU  81           HG       LEU  81  -1.966 -11.301  -7.319
  590   1HD1  LEU  81          1HD1      LEU  81  -3.611  -9.678  -8.753
  591   2HD1  LEU  81          2HD1      LEU  81  -3.326  -9.495  -7.022
  592   3HD1  LEU  81          3HD1      LEU  81  -4.759 -10.352  -7.593
  593   1HD2  LEU  81          1HD2      LEU  81  -4.713 -12.177  -6.817
  594   2HD2  LEU  81          2HD2      LEU  81  -3.212 -12.699  -6.049
  595   3HD2  LEU  81          3HD2      LEU  81  -3.730 -13.438  -7.564
  596    H    GLU  82           H        GLU  82  -1.797 -11.560 -11.864
  597    HA   GLU  82           HA       GLU  82  -1.055 -14.263 -12.916
  598   1HB   GLU  82          2HB       GLU  82  -3.284 -14.148 -13.373
  599   2HB   GLU  82          1HB       GLU  82  -3.311 -12.391 -13.270
  600   1HG   GLU  82          2HG       GLU  82  -2.402 -12.189 -15.513
  601   2HG   GLU  82          1HG       GLU  82  -2.174 -13.936 -15.620
  602    H    LYS  83           H        LYS  83  -0.239 -10.882 -13.200
  603    HA   LYS  83           HA       LYS  83   1.008 -11.443 -15.862
  604   1HB   LYS  83          2HB       LYS  83  -0.437  -9.270 -14.705
  605   2HB   LYS  83          1HB       LYS  83   1.152  -8.704 -15.207
  606   1HG   LYS  83          2HG       LYS  83  -0.005 -10.491 -17.182
  607   2HG   LYS  83          1HG       LYS  83  -1.059  -9.112 -16.866
  608   1HD   LYS  83          2HD       LYS  83   1.081  -7.676 -17.075
  609   2HD   LYS  83          1HD       LYS  83   1.799  -9.101 -17.827
  610   1HE   LYS  83          2HE       LYS  83   0.566  -8.864 -19.742
  611   2HE   LYS  83          1HE       LYS  83  -0.879  -8.332 -18.859
  612   1HZ   LYS  83          1HZ       LYS  83   0.000  -6.447 -20.002
  613   2HZ   LYS  83          2HZ       LYS  83   1.567  -6.743 -19.415
  614   3HZ   LYS  83          3HZ       LYS  83   0.339  -6.244 -18.353
  615    H    GLU  84           H        GLU  84   2.046  -8.906 -13.642
  616    HA   GLU  84           HA       GLU  84   4.679 -10.319 -13.374
  617   1HB   GLU  84          2HB       GLU  84   4.016  -7.474 -14.174
  618   2HB   GLU  84          1HB       GLU  84   5.638  -7.972 -13.691
  619   1HG   GLU  84          2HG       GLU  84   4.034  -9.172 -15.967
  620   2HG   GLU  84          1HG       GLU  84   5.390  -8.057 -16.143
  621    HA   PRO  85           HA       PRO  85   4.433  -9.306  -9.121
  622   1HB   PRO  85          2HB       PRO  85   7.093  -8.979  -8.538
  623   2HB   PRO  85          1HB       PRO  85   6.347 -10.568  -8.815
  624   1HG   PRO  85          2HG       PRO  85   7.937  -8.874 -10.687
  625   2HG   PRO  85          1HG       PRO  85   7.988 -10.627 -10.434
  626   1HD   PRO  85          2HD       PRO  85   6.698  -9.504 -12.526
  627   2HD   PRO  85          1HD       PRO  85   6.142 -11.008 -11.758
  628    H    VAL  86           H        VAL  86   6.176  -7.565  -7.718
  629    HA   VAL  86           HA       VAL  86   5.758  -4.936  -9.100
  630    HB   VAL  86           HB       VAL  86   5.097  -5.792  -6.267
  631   1HG1  VAL  86          1HG1      VAL  86   6.107  -3.416  -6.672
  632   2HG1  VAL  86          2HG1      VAL  86   4.628  -3.561  -5.721
  633   3HG1  VAL  86          3HG1      VAL  86   4.545  -3.063  -7.411
  634   1HG2  VAL  86          1HG2      VAL  86   3.009  -4.465  -7.774
  635   2HG2  VAL  86          2HG2      VAL  86   2.991  -6.061  -7.023
  636   3HG2  VAL  86          3HG2      VAL  86   3.612  -5.864  -8.662
  637    HA   PRO  87           HA       PRO  87   9.946  -4.579  -7.581
  638   1HB   PRO  87          2HB       PRO  87  10.584  -2.375  -9.057
  639   2HB   PRO  87          1HB       PRO  87  10.539  -4.006  -9.752
  640   1HG   PRO  87          2HG       PRO  87   8.660  -1.774 -10.085
  641   2HG   PRO  87          1HG       PRO  87   8.978  -3.153 -11.144
  642   1HD   PRO  87          2HD       PRO  87   6.798  -2.818  -9.367
  643   2HD   PRO  87          1HD       PRO  87   7.204  -4.267 -10.310
  644    H    MET  88           H        MET  88  11.031  -2.003  -7.265
  645    HA   MET  88           HA       MET  88   9.122  -0.771  -5.297
  646   1HB   MET  88          2HB       MET  88  11.528  -0.060  -4.371
  647   2HB   MET  88          1HB       MET  88  10.737  -1.554  -3.876
  648   1HG   MET  88          2HG       MET  88  12.525  -1.500  -6.301
  649   2HG   MET  88          1HG       MET  88  13.221  -1.651  -4.690
  650   1HE   MET  88          1HE       MET  88  13.429  -3.426  -7.145
  651   2HE   MET  88          2HE       MET  88  13.063  -5.103  -6.753
  652   3HE   MET  88          3HE       MET  88  14.202  -4.202  -5.756
  653    H    SER  89           H        SER  89  10.564  -0.253  -8.192
  654    HA   SER  89           HA       SER  89  11.161   2.607  -7.594
  655   1HB   SER  89          2HB       SER  89  11.948   0.779  -9.860
  656   2HB   SER  89          1HB       SER  89  12.414   2.471  -9.735
  657    HG   SER  89           HG       SER  89  13.379   0.266  -8.423
  658    H    LEU  90           H        LEU  90   9.161   3.544  -7.791
  659    HA   LEU  90           HA       LEU  90   7.130   3.096  -9.697
  660   1HB   LEU  90          2HB       LEU  90   7.816   4.966  -7.709
  661   2HB   LEU  90          1HB       LEU  90   7.588   5.921  -9.176
  662    HG   LEU  90           HG       LEU  90   5.619   3.844  -8.201
  663   1HD1  LEU  90          1HD1      LEU  90   5.569   5.570  -6.557
  664   2HD1  LEU  90          2HD1      LEU  90   4.243   5.944  -7.659
  665   3HD1  LEU  90          3HD1      LEU  90   5.761   6.833  -7.773
  666   1HD2  LEU  90          1HD2      LEU  90   5.821   4.635 -10.693
  667   2HD2  LEU  90          2HD2      LEU  90   5.082   6.121 -10.096
  668   3HD2  LEU  90          3HD2      LEU  90   4.227   4.586  -9.940
  669    HA   PRO  91           HA       PRO  91   9.726   4.182 -13.232
  670   1HB   PRO  91          2HB       PRO  91   8.065   3.053 -15.094
  671   2HB   PRO  91          1HB       PRO  91   9.239   2.120 -14.144
  672   1HG   PRO  91          2HG       PRO  91   6.303   2.408 -13.768
  673   2HG   PRO  91          1HG       PRO  91   7.338   0.992 -13.537
  674   1HD   PRO  91          2HD       PRO  91   6.409   2.544 -11.489
  675   2HD   PRO  91          1HD       PRO  91   7.907   1.590 -11.409
  676    HA   PRO  92           HA       PRO  92   7.596   7.768 -14.609
  677   1HB   PRO  92          2HB       PRO  92   8.629   8.083 -17.119
  678   2HB   PRO  92          1HB       PRO  92   9.565   8.395 -15.645
  679   1HG   PRO  92          2HG       PRO  92   9.621   6.047 -17.462
  680   2HG   PRO  92          1HG       PRO  92  10.942   6.827 -16.580
  681   1HD   PRO  92          2HD       PRO  92   9.727   4.490 -15.799
  682   2HD   PRO  92          1HD       PRO  92  10.579   5.593 -14.697
  683    H    ALA  93           H        ALA  93   7.195   4.773 -16.253
  684    HA   ALA  93           HA       ALA  93   5.257   5.721 -18.232
  685   1HB   ALA  93          1HB       ALA  93   6.835   3.441 -17.732
  686   2HB   ALA  93          2HB       ALA  93   5.698   3.659 -19.064
  687   3HB   ALA  93          3HB       ALA  93   5.166   2.891 -17.568
  688    H    LEU  94           H        LEU  94   5.185   5.272 -14.904
  689    HA   LEU  94           HA       LEU  94   2.329   4.434 -14.854
  690   1HB   LEU  94          2HB       LEU  94   4.659   4.485 -12.961
  691   2HB   LEU  94          1HB       LEU  94   3.025   4.455 -12.296
  692    HG   LEU  94           HG       LEU  94   4.098   2.175 -12.668
  693   1HD1  LEU  94          1HD1      LEU  94   1.932   1.465 -14.100
  694   2HD1  LEU  94          2HD1      LEU  94   1.451   3.105 -13.665
  695   3HD1  LEU  94          3HD1      LEU  94   1.830   1.934 -12.404
  696   1HD2  LEU  94          1HD2      LEU  94   4.419   1.365 -14.857
  697   2HD2  LEU  94          2HD2      LEU  94   5.018   3.021 -14.962
  698   3HD2  LEU  94          3HD2      LEU  94   3.411   2.625 -15.569
  699    H    VAL  95           H        VAL  95   4.403   7.178 -14.460
  700    HA   VAL  95           HA       VAL  95   2.812   8.771 -12.688
  701    HB   VAL  95           HB       VAL  95   4.694   9.545 -14.938
  702   1HG1  VAL  95          1HG1      VAL  95   3.196  11.058 -12.936
  703   2HG1  VAL  95          2HG1      VAL  95   4.090  11.641 -14.339
  704   3HG1  VAL  95          3HG1      VAL  95   4.933  11.339 -12.820
  705   1HG2  VAL  95          1HG2      VAL  95   6.284   9.703 -12.886
  706   2HG2  VAL  95          2HG2      VAL  95   5.926   8.101 -13.532
  707   3HG2  VAL  95          3HG2      VAL  95   5.103   8.671 -12.080
  708    HA   PRO  96           HA       PRO  96  -0.427   9.474 -15.717
  709   1HB   PRO  96          2HB       PRO  96  -2.189  10.584 -13.943
  710   2HB   PRO  96          1HB       PRO  96  -1.936   8.834 -14.078
  711   1HG   PRO  96          2HG       PRO  96  -0.945  10.739 -12.040
  712   2HG   PRO  96          1HG       PRO  96  -1.407   9.039 -11.873
  713   1HD   PRO  96          2HD       PRO  96   1.193   9.986 -12.011
  714   2HD   PRO  96          1HD       PRO  96   0.691   8.313 -12.327
  715    HA   PRO  97           HA       PRO  97  -0.085  13.763 -16.626
  716   1HB   PRO  97          2HB       PRO  97  -2.670  14.631 -16.966
  717   2HB   PRO  97          1HB       PRO  97  -1.819  13.619 -18.152
  718   1HG   PRO  97          2HG       PRO  97  -3.780  12.821 -16.047
  719   2HG   PRO  97          1HG       PRO  97  -3.650  12.277 -17.728
  720   1HD   PRO  97          2HD       PRO  97  -2.738  10.788 -15.681
  721   2HD   PRO  97          1HD       PRO  97  -1.928  10.807 -17.263
  722    H    SER  98           H        SER  98  -1.875  12.766 -13.864
  723    HA   SER  98           HA       SER  98  -2.581  15.291 -12.709
  724   1HB   SER  98          2HB       SER  98  -2.310  12.465 -11.958
  725   2HB   SER  98          1HB       SER  98  -1.980  13.563 -10.621
  726    HG   SER  98           HG       SER  98  -4.186  13.140 -10.722
  727    H    LYS  99           H        LYS  99   0.451  13.579 -13.009
  728    HA   LYS  99           HA       LYS  99   1.817  15.276 -11.008
  729   1HB   LYS  99          2HB       LYS  99   2.202  12.777 -11.481
  730   2HB   LYS  99          1HB       LYS  99   2.994  13.290 -12.971
  731   1HG   LYS  99          2HG       LYS  99   4.652  12.982 -11.180
  732   2HG   LYS  99          1HG       LYS  99   4.561  14.679 -11.652
  733   1HD   LYS  99          2HD       LYS  99   3.369  15.283  -9.712
  734   2HD   LYS  99          1HD       LYS  99   2.885  13.619  -9.382
  735   1HE   LYS  99          2HE       LYS  99   4.730  13.305  -8.107
  736   2HE   LYS  99          1HE       LYS  99   5.777  13.807  -9.449
  737   1HZ   LYS  99          1HZ       LYS  99   5.820  15.299  -7.439
  738   2HZ   LYS  99          2HZ       LYS  99   4.220  15.732  -7.816
  739   3HZ   LYS  99          3HZ       LYS  99   5.476  16.070  -8.909
  740    H    ARG 100           H        ARG 100   0.660  15.918 -13.950
  741    HA   ARG 100           HA       ARG 100   2.989  17.651 -14.695
  742   1HB   ARG 100          2HB       ARG 100   1.344  15.698 -16.275
  743   2HB   ARG 100          1HB       ARG 100   1.970  17.128 -17.095
  744   1HG   ARG 100          2HG       ARG 100   4.152  16.440 -16.928
  745   2HG   ARG 100          1HG       ARG 100   3.889  15.641 -15.378
  746   1HD   ARG 100          2HD       ARG 100   2.317  14.154 -17.133
  747   2HD   ARG 100          1HD       ARG 100   3.783  14.505 -18.069
  748    HE   ARG 100           HE       ARG 100   4.381  13.738 -15.327
  749   1HH1  ARG 100          1HH2      ARG 100   2.609  11.609 -16.718
  750   2HH1  ARG 100          2HH2      ARG 100   3.829  10.528 -17.303
  751   1HH2  ARG 100          2HH1      ARG 100   6.420  12.786 -16.845
  752   2HH2  ARG 100          1HH1      ARG 100   5.987  11.195 -17.374
  753    H    SER 107           1H       SER 107   9.273   6.082   7.642
  754    HA   SER 107           HA       SER 107   8.257   5.522   5.539
  755   1HB   SER 107          2HB       SER 107   7.159   4.120   7.996
  756   2HB   SER 107          1HB       SER 107   7.177   3.423   6.379
  757    HG   SER 107           HG       SER 107   9.120   2.814   6.893
  758    H    THR 108           H        THR 108   6.018   4.637   4.706
  759    HA   THR 108           HA       THR 108   3.650   6.019   5.783
  760    HB   THR 108           HB       THR 108   4.576   7.852   4.580
  761    HG1  THR 108           HG1      THR 108   3.138   8.078   2.882
  762   1HG2  THR 108          1HG2      THR 108   5.349   5.745   2.569
  763   2HG2  THR 108          2HG2      THR 108   6.387   6.901   3.405
  764   3HG2  THR 108          3HG2      THR 108   5.301   7.453   2.130
  765    H    ASN 109           H        ASN 109   4.365   3.253   5.268
  766    HA   ASN 109           HA       ASN 109   2.465   2.601   3.039
  767   1HB   ASN 109          2HB       ASN 109   4.801   2.025   2.571
  768   2HB   ASN 109          1HB       ASN 109   4.911   1.146   4.097
  769   1HD2  ASN 109          1HD2      ASN 109   2.582   1.202   1.337
  770   2HD2  ASN 109          2HD2      ASN 109   2.522  -0.483   1.167
  771    HA   PRO 110           HA       PRO 110   0.172   0.770   6.369
  772   1HB   PRO 110          2HB       PRO 110  -1.808  -0.316   4.830
  773   2HB   PRO 110          1HB       PRO 110  -1.728   1.412   5.220
  774   1HG   PRO 110          2HG       PRO 110  -0.983  -0.001   2.722
  775   2HG   PRO 110          1HG       PRO 110  -1.703   1.599   2.945
  776   1HD   PRO 110          2HD       PRO 110   0.951   1.146   2.381
  777   2HD   PRO 110          1HD       PRO 110   0.322   2.612   3.162
  778    H    PHE 111           H        PHE 111   2.009  -0.819   4.050
  779    HA   PHE 111           HA       PHE 111   1.236  -3.519   5.105
  780   1HB   PHE 111          2HB       PHE 111   2.610  -2.661   2.532
  781   2HB   PHE 111          1HB       PHE 111   2.266  -4.334   2.980
  782    HD1  PHE 111           HD1      PHE 111   0.979  -1.382   1.422
  783    HD2  PHE 111           HD2      PHE 111  -0.199  -4.934   3.523
  784    HE1  PHE 111           HE1      PHE 111  -1.307  -1.152   0.510
  785    HE2  PHE 111           HE2      PHE 111  -2.495  -4.704   2.608
  786    HZ   PHE 111           HZ       PHE 111  -3.046  -2.819   1.098
  787    H    LEU 112           HN       LEU 112   3.190  -1.382   6.186
  788    HA   LEU 112           HA       LEU 112   5.487  -3.267   6.502
  789   1HB   LEU 112          2HB       LEU 112   5.414  -0.472   5.427
  790   2HB   LEU 112          1HB       LEU 112   6.818  -0.963   6.376
  791    HG   LEU 112           HG       LEU 112   5.771  -2.623   4.076
  792   1HD1  LEU 112          1HD1      LEU 112   6.712  -1.224   2.581
  793   2HD1  LEU 112          2HD1      LEU 112   8.215  -1.180   3.502
  794   3HD1  LEU 112          3HD1      LEU 112   6.913  -0.052   3.883
  795   1HD2  LEU 112          1HD2      LEU 112   8.232  -3.351   4.151
  796   2HD2  LEU 112          2HD2      LEU 112   7.222  -3.872   5.500
  797   3HD2  LEU 112          3HD2      LEU 112   8.322  -2.508   5.697
  Start of MODEL   11
    1    HA   PRO   6           HA       PRO   6   1.639   8.053 -22.052
    2   1HB   PRO   6          2HB       PRO   6   0.018   5.864 -22.310
    3   2HB   PRO   6          1HB       PRO   6   0.465   6.902 -23.679
    4   1HG   PRO   6          2HG       PRO   6   1.553   4.253 -22.880
    5   2HG   PRO   6          1HG       PRO   6   1.245   4.907 -24.495
    6   1HD   PRO   6          2HD       PRO   6   3.727   4.784 -23.349
    7   2HD   PRO   6          1HD       PRO   6   3.266   5.969 -24.589
    8    H    TRP   7           H        TRP   7  -0.183   6.846 -20.444
    9    HA   TRP   7           HA       TRP   7   1.330   6.352 -17.984
   10   1HB   TRP   7          2HB       TRP   7  -0.734   7.739 -18.148
   11   2HB   TRP   7          1HB       TRP   7  -1.644   6.296 -18.596
   12    HD1  TRP   7           HD1      TRP   7   1.028   5.634 -16.108
   13    HE1  TRP   7           HE1      TRP   7   0.006   5.291 -13.765
   14    HE3  TRP   7           HE3      TRP   7  -3.739   7.214 -16.997
   15    HZ2  TRP   7           HZ2      TRP   7  -2.509   5.647 -12.444
   16    HZ3  TRP   7           HZ3      TRP   7  -5.429   7.203 -15.182
   17    HH2  TRP   7           HH2      TRP   7  -4.819   6.422 -12.910
   18    H    ALA   8           H        ALA   8   1.990   4.332 -17.411
   19    HA   ALA   8           HA       ALA   8   1.677   1.925 -18.693
   20   1HB   ALA   8          1HB       ALA   8   1.601   2.421 -15.707
   21   2HB   ALA   8          2HB       ALA   8   3.062   2.371 -16.695
   22   3HB   ALA   8          3HB       ALA   8   2.091   0.913 -16.480
   23    H    VAL   9           H        VAL   9  -0.691   3.539 -16.669
   24    HA   VAL   9           HA       VAL   9  -2.534   1.215 -16.777
   25    HB   VAL   9           HB       VAL   9  -2.683   3.959 -15.477
   26   1HG1  VAL   9          1HG1      VAL   9  -4.706   1.995 -15.956
   27   2HG1  VAL   9          2HG1      VAL   9  -4.837   3.490 -15.031
   28   3HG1  VAL   9          3HG1      VAL   9  -4.346   1.998 -14.230
   29   1HG2  VAL   9          1HG2      VAL   9  -2.234   2.650 -13.398
   30   2HG2  VAL   9          2HG2      VAL   9  -0.897   2.554 -14.546
   31   3HG2  VAL   9          3HG2      VAL   9  -2.020   1.203 -14.384
   32    H    LYS  10           H        LYS  10  -4.519   1.313 -17.908
   33    HA   LYS  10           HA       LYS  10  -4.647   3.436 -20.002
   34   1HB   LYS  10          2HB       LYS  10  -5.262   0.563 -19.740
   35   2HB   LYS  10          1HB       LYS  10  -6.473   1.474 -20.642
   36   1HG   LYS  10          2HG       LYS  10  -5.110   1.601 -22.428
   37   2HG   LYS  10          1HG       LYS  10  -3.835   2.320 -21.443
   38   1HD   LYS  10          2HD       LYS  10  -2.984   0.174 -20.811
   39   2HD   LYS  10          1HD       LYS  10  -4.399  -0.651 -21.464
   40   1HE   LYS  10          2HE       LYS  10  -2.908  -0.970 -23.224
   41   2HE   LYS  10          1HE       LYS  10  -3.605   0.587 -23.713
   42   1HZ   LYS  10          1HZ       LYS  10  -0.998   0.009 -22.544
   43   2HZ   LYS  10          2HZ       LYS  10  -1.775   1.418 -21.995
   44   3HZ   LYS  10          3HZ       LYS  10  -1.444   1.216 -23.650
   45    HA   PRO  11           HA       PRO  11  -8.435   5.118 -18.570
   46   1HB   PRO  11          2HB       PRO  11 -10.113   4.990 -20.736
   47   2HB   PRO  11          1HB       PRO  11  -8.764   6.138 -20.625
   48   1HG   PRO  11          2HG       PRO  11  -8.916   3.527 -22.060
   49   2HG   PRO  11          1HG       PRO  11  -8.194   5.058 -22.582
   50   1HD   PRO  11          2HD       PRO  11  -6.708   3.012 -21.635
   51   2HD   PRO  11          1HD       PRO  11  -6.259   4.713 -21.378
   52    H    GLU  12           H        GLU  12  -8.739   2.047 -20.278
   53    HA   GLU  12           HA       GLU  12 -11.322   1.335 -19.140
   54   1HB   GLU  12          2HB       GLU  12  -9.250  -0.573 -20.225
   55   2HB   GLU  12          1HB       GLU  12 -11.004  -0.662 -20.374
   56   1HG   GLU  12          2HG       GLU  12 -10.794   1.555 -21.709
   57   2HG   GLU  12          1HG       GLU  12  -9.084   1.141 -21.844
   58    H    ASP  13           H        ASP  13  -7.931   0.694 -18.358
   59    HA   ASP  13           HA       ASP  13  -8.544  -1.145 -16.173
   60   1HB   ASP  13          2HB       ASP  13  -6.274  -0.134 -17.658
   61   2HB   ASP  13          1HB       ASP  13  -5.946  -0.036 -15.928
   62    H    LYS  14           H        LYS  14  -7.784   2.279 -16.574
   63    HA   LYS  14           HA       LYS  14  -7.622   2.875 -13.747
   64   1HB   LYS  14          2HB       LYS  14  -6.703   4.158 -15.783
   65   2HB   LYS  14          1HB       LYS  14  -8.347   4.759 -15.996
   66   1HG   LYS  14          2HG       LYS  14  -7.612   5.024 -13.233
   67   2HG   LYS  14          1HG       LYS  14  -6.359   5.756 -14.233
   68   1HD   LYS  14          2HD       LYS  14  -7.793   7.344 -15.113
   69   2HD   LYS  14          1HD       LYS  14  -9.213   6.314 -14.927
   70   1HE   LYS  14          2HE       LYS  14  -8.541   6.627 -12.316
   71   2HE   LYS  14          1HE       LYS  14  -7.972   8.175 -12.972
   72   1HZ   LYS  14          1HZ       LYS  14 -10.671   6.976 -13.289
   73   2HZ   LYS  14          2HZ       LYS  14 -10.131   8.325 -14.170
   74   3HZ   LYS  14          3HZ       LYS  14 -10.278   8.415 -12.480
   75    H    ALA  15           H        ALA  15 -10.184   2.239 -15.926
   76    HA   ALA  15           HA       ALA  15 -12.247   3.836 -14.610
   77   1HB   ALA  15          1HB       ALA  15 -11.934   2.540 -17.014
   78   2HB   ALA  15          2HB       ALA  15 -13.487   3.094 -16.389
   79   3HB   ALA  15          3HB       ALA  15 -12.987   1.420 -16.151
   80    H    LYS  16           H        LYS  16 -11.186   0.431 -14.560
   81    HA   LYS  16           HA       LYS  16 -13.161  -0.383 -12.588
   82   1HB   LYS  16          2HB       LYS  16 -12.237  -2.467 -12.973
   83   2HB   LYS  16          1HB       LYS  16 -11.630  -1.640 -14.405
   84   1HG   LYS  16          2HG       LYS  16  -9.529  -1.147 -13.246
   85   2HG   LYS  16          1HG       LYS  16 -10.137  -1.943 -11.795
   86   1HD   LYS  16          2HD       LYS  16 -10.380  -3.634 -14.166
   87   2HD   LYS  16          1HD       LYS  16  -8.708  -3.173 -13.843
   88   1HE   LYS  16          2HE       LYS  16  -9.212  -5.231 -12.614
   89   2HE   LYS  16          1HE       LYS  16  -9.046  -3.903 -11.446
   90   1HZ   LYS  16          1HZ       LYS  16 -11.114  -5.309 -11.214
   91   2HZ   LYS  16          2HZ       LYS  16 -11.640  -4.631 -12.680
   92   3HZ   LYS  16          3HZ       LYS  16 -11.367  -3.636 -11.330
   93    H    TYR  17           H        TYR  17 -10.075   1.172 -12.555
   94    HA   TYR  17           HA       TYR  17  -9.388   0.569  -9.775
   95   1HB   TYR  17          2HB       TYR  17  -8.473   2.671 -11.773
   96   2HB   TYR  17          1HB       TYR  17  -7.698   2.369 -10.222
   97    HD1  TYR  17           HD1      TYR  17  -8.899  -0.720 -11.296
   98    HD2  TYR  17           HD2      TYR  17  -5.798   2.122 -12.148
   99    HE1  TYR  17           HE1      TYR  17  -7.543  -2.514 -12.342
  100    HE2  TYR  17           HE2      TYR  17  -4.429   0.328 -13.181
  101    HH   TYR  17           HH       TYR  17  -5.733  -2.777 -13.907
  102    H    ASP  18           H        ASP  18 -11.012   3.124 -11.586
  103    HA   ASP  18           HA       ASP  18 -11.262   4.959  -9.329
  104   1HB   ASP  18          2HB       ASP  18 -11.217   5.606 -11.729
  105   2HB   ASP  18          1HB       ASP  18 -12.741   4.750 -11.974
  106    H    ALA  19           H        ALA  19 -12.797   2.056 -10.145
  107    HA   ALA  19           HA       ALA  19 -15.410   2.778  -8.918
  108   1HB   ALA  19          1HB       ALA  19 -14.817   1.204 -10.994
  109   2HB   ALA  19          2HB       ALA  19 -16.138   0.784  -9.903
  110   3HB   ALA  19          3HB       ALA  19 -14.565   0.010  -9.721
  111    H    ILE  20           H        ILE  20 -12.476   0.947  -8.401
  112    HA   ILE  20           HA       ILE  20 -13.286  -0.226  -5.853
  113    HB   ILE  20           HB       ILE  20 -10.774   0.092  -7.511
  114   1HG1  ILE  20          2HG1      ILE  20 -11.975  -2.495  -6.578
  115   2HG1  ILE  20          1HG1      ILE  20 -12.731  -1.623  -7.912
  116   1HG2  ILE  20          1HG2      ILE  20 -10.972  -1.373  -4.877
  117   2HG2  ILE  20          2HG2      ILE  20 -10.226   0.212  -5.078
  118   3HG2  ILE  20          3HG2      ILE  20  -9.542  -1.193  -5.891
  119   1HD1  ILE  20          1HD1      ILE  20 -11.075  -3.237  -8.766
  120   2HD1  ILE  20          2HD1      ILE  20  -9.823  -2.480  -7.781
  121   3HD1  ILE  20          3HD1      ILE  20 -10.561  -1.584  -9.111
  122    H    PHE  21           H        PHE  21 -11.670   2.636  -7.062
  123    HA   PHE  21           HA       PHE  21 -10.577   3.513  -4.528
  124   1HB   PHE  21          2HB       PHE  21  -9.432   4.485  -6.254
  125   2HB   PHE  21          1HB       PHE  21 -10.813   4.388  -7.340
  126    HD1  PHE  21           HD1      PHE  21  -8.795   6.554  -5.350
  127    HD2  PHE  21           HD2      PHE  21 -12.776   6.049  -6.882
  128    HE1  PHE  21           HE1      PHE  21  -9.221   8.976  -5.037
  129    HE2  PHE  21           HE2      PHE  21 -13.205   8.469  -6.567
  130    HZ   PHE  21           HZ       PHE  21 -11.431   9.932  -5.646
  131    H    ASP  22           H        ASP  22 -13.570   3.995  -6.299
  132    HA   ASP  22           HA       ASP  22 -14.564   6.015  -4.384
  133   1HB   ASP  22          2HB       ASP  22 -15.111   6.414  -6.654
  134   2HB   ASP  22          1HB       ASP  22 -15.526   4.720  -6.940
  135    H    SER  23           H        SER  23 -14.379   2.653  -4.529
  136    HA   SER  23           HA       SER  23 -17.000   2.051  -3.332
  137   1HB   SER  23          2HB       SER  23 -16.029   0.382  -4.738
  138   2HB   SER  23          1HB       SER  23 -14.458   0.531  -3.956
  139    HG   SER  23           HG       SER  23 -16.836  -0.357  -2.678
  140    H    LEU  24           H        LEU  24 -14.014   3.238  -2.290
  141    HA   LEU  24           HA       LEU  24 -14.302   2.221   0.502
  142   1HB   LEU  24          2HB       LEU  24 -12.085   3.948  -0.572
  143   2HB   LEU  24          1HB       LEU  24 -12.005   2.706   0.674
  144    HG   LEU  24           HG       LEU  24 -12.635   2.014  -2.192
  145   1HD1  LEU  24          1HD1      LEU  24 -10.178   3.082  -1.148
  146   2HD1  LEU  24          2HD1      LEU  24 -10.536   2.553  -2.793
  147   3HD1  LEU  24          3HD1      LEU  24  -9.933   1.399  -1.604
  148   1HD2  LEU  24          1HD2      LEU  24 -11.801  -0.177  -1.498
  149   2HD2  LEU  24          2HD2      LEU  24 -13.028   0.358  -0.349
  150   3HD2  LEU  24          3HD2      LEU  24 -11.317   0.478   0.068
  151    H    SER  25           H        SER  25 -14.869   4.887  -1.527
  152    HA   SER  25           HA       SER  25 -16.057   6.897  -0.973
  153   1HB   SER  25          2HB       SER  25 -16.347   5.635   1.315
  154   2HB   SER  25          1HB       SER  25 -15.055   6.706   1.845
  155    HG   SER  25           HG       SER  25 -16.871   7.845   2.209
  156    HA   PRO  26           HA       PRO  26 -11.978   8.716  -1.592
  157   1HB   PRO  26          2HB       PRO  26 -12.870  10.584  -3.374
  158   2HB   PRO  26          1HB       PRO  26 -12.510   8.905  -3.827
  159   1HG   PRO  26          2HG       PRO  26 -15.133  10.200  -3.299
  160   2HG   PRO  26          1HG       PRO  26 -14.695   8.988  -4.512
  161   1HD   PRO  26          2HD       PRO  26 -16.009   8.397  -2.184
  162   2HD   PRO  26          1HD       PRO  26 -14.980   7.241  -3.054
  163    H    VAL  27           H        VAL  27 -11.098  10.704  -0.912
  164    HA   VAL  27           HA       VAL  27 -12.976  12.598   0.457
  165    HB   VAL  27           HB       VAL  27 -10.263  11.553   1.347
  166   1HG1  VAL  27          1HG1      VAL  27 -11.978  13.042   3.234
  167   2HG1  VAL  27          2HG1      VAL  27 -11.329  14.014   1.912
  168   3HG1  VAL  27          3HG1      VAL  27 -10.235  13.137   2.982
  169   1HG2  VAL  27          1HG2      VAL  27 -12.813  11.209   2.883
  170   2HG2  VAL  27          2HG2      VAL  27 -11.383  10.177   2.844
  171   3HG2  VAL  27          3HG2      VAL  27 -12.521  10.157   1.497
  172    H    ASN  28           H        ASN  28 -12.843  14.407  -0.858
  173    HA   ASN  28           HA       ASN  28 -11.865  16.199  -2.050
  174   1HB   ASN  28          2HB       ASN  28 -10.776  16.635   0.055
  175   2HB   ASN  28          1HB       ASN  28  -9.647  15.305  -0.183
  176   1HD2  ASN  28          1HD2      ASN  28  -7.629  15.983  -0.874
  177   2HD2  ASN  28          2HD2      ASN  28  -7.328  17.371  -1.804
  178    H    GLY  29           H        GLY  29 -11.605  13.271  -2.936
  179   1HA   GLY  29          2HA       GLY  29 -10.816  12.392  -5.001
  180   2HA   GLY  29          1HA       GLY  29  -9.759  13.797  -5.164
  181    H    PHE  30           H        PHE  30  -9.995  11.577  -2.397
  182    HA   PHE  30           HA       PHE  30  -7.358  10.415  -3.074
  183   1HB   PHE  30          2HB       PHE  30  -7.953  12.211  -0.717
  184   2HB   PHE  30          1HB       PHE  30  -6.519  11.176  -0.799
  185    HD1  PHE  30           HD1      PHE  30  -8.155  14.177  -2.059
  186    HD2  PHE  30           HD2      PHE  30  -4.855  11.491  -2.612
  187    HE1  PHE  30           HE1      PHE  30  -7.054  15.843  -3.515
  188    HE2  PHE  30           HE2      PHE  30  -3.736  13.167  -4.067
  189    HZ   PHE  30           HZ       PHE  30  -4.839  15.345  -4.521
  190    H    LEU  31           H        LEU  31  -6.844   8.579  -1.842
  191    HA   LEU  31           HA       LEU  31  -9.047   7.523  -0.101
  192   1HB   LEU  31          2HB       LEU  31  -7.332   6.266  -2.242
  193   2HB   LEU  31          1HB       LEU  31  -7.998   5.267  -0.955
  194    HG   LEU  31           HG       LEU  31  -9.469   6.823  -3.073
  195   1HD1  LEU  31          1HD1      LEU  31  -9.293   4.673  -3.832
  196   2HD1  LEU  31          2HD1      LEU  31 -10.668   4.416  -2.757
  197   3HD1  LEU  31          3HD1      LEU  31  -9.036   4.024  -2.212
  198   1HD2  LEU  31          1HD2      LEU  31 -10.498   5.835  -0.397
  199   2HD2  LEU  31          2HD2      LEU  31 -11.558   6.129  -1.778
  200   3HD2  LEU  31          3HD2      LEU  31 -10.642   7.460  -1.070
  201    H    SER  32           H        SER  32  -8.283   6.486   1.808
  202    HA   SER  32           HA       SER  32  -5.491   7.195   2.495
  203   1HB   SER  32          2HB       SER  32  -6.265   6.927   4.759
  204   2HB   SER  32          1HB       SER  32  -7.552   7.754   3.884
  205    HG   SER  32           HG       SER  32  -8.232   5.406   3.484
  206    H    GLY  33           H        GLY  33  -3.937   5.659   3.030
  207   1HA   GLY  33          2HA       GLY  33  -3.856   3.156   1.850
  208   2HA   GLY  33          1HA       GLY  33  -3.028   3.485   3.372
  209    H    ASP  34           H        ASP  34  -5.667   4.077   4.680
  210    HA   ASP  34           HA       ASP  34  -6.227   1.448   5.710
  211   1HB   ASP  34          2HB       ASP  34  -6.508   3.518   6.984
  212   2HB   ASP  34          1HB       ASP  34  -7.713   4.092   5.831
  213    H    LYS  35           H        LYS  35  -7.560   3.338   3.057
  214    HA   LYS  35           HA       LYS  35  -9.890   1.537   2.758
  215   1HB   LYS  35          2HB       LYS  35  -8.833   4.037   1.423
  216   2HB   LYS  35          1HB       LYS  35 -10.203   3.147   0.758
  217   1HG   LYS  35          2HG       LYS  35 -11.461   3.438   2.818
  218   2HG   LYS  35          1HG       LYS  35 -10.068   4.183   3.604
  219   1HD   LYS  35          2HD       LYS  35 -10.134   5.964   1.800
  220   2HD   LYS  35          1HD       LYS  35 -11.680   5.285   1.292
  221   1HE   LYS  35          2HE       LYS  35 -12.713   5.813   3.393
  222   2HE   LYS  35          1HE       LYS  35 -11.147   6.185   4.141
  223   1HZ   LYS  35          1HZ       LYS  35 -11.284   7.687   1.814
  224   2HZ   LYS  35          2HZ       LYS  35 -11.377   8.259   3.411
  225   3HZ   LYS  35          3HZ       LYS  35 -12.795   7.869   2.562
  226    H    VAL  36           H        VAL  36  -6.803   2.368   1.264
  227    HA   VAL  36           HA       VAL  36  -7.117   0.584  -1.027
  228    HB   VAL  36           HB       VAL  36  -4.695   1.842   0.290
  229   1HG1  VAL  36          1HG1      VAL  36  -4.555  -0.159  -1.444
  230   2HG1  VAL  36          2HG1      VAL  36  -3.446   1.204  -1.547
  231   3HG1  VAL  36          3HG1      VAL  36  -4.850   1.132  -2.610
  232   1HG2  VAL  36          1HG2      VAL  36  -5.879   2.902  -2.225
  233   2HG2  VAL  36          2HG2      VAL  36  -5.115   3.765  -0.893
  234   3HG2  VAL  36          3HG2      VAL  36  -6.780   3.205  -0.737
  235    H    LYS  37           H        LYS  37  -5.180   0.464   1.980
  236    HA   LYS  37           HA       LYS  37  -3.780  -1.841   1.851
  237   1HB   LYS  37          2HB       LYS  37  -3.810  -0.627   3.876
  238   2HB   LYS  37          1HB       LYS  37  -5.563  -0.736   4.019
  239   1HG   LYS  37          2HG       LYS  37  -5.491  -3.000   4.674
  240   2HG   LYS  37          1HG       LYS  37  -3.851  -3.215   4.067
  241   1HD   LYS  37          2HD       LYS  37  -3.360  -2.994   6.304
  242   2HD   LYS  37          1HD       LYS  37  -3.351  -1.287   5.857
  243   1HE   LYS  37          2HE       LYS  37  -6.003  -1.619   6.361
  244   2HE   LYS  37          1HE       LYS  37  -5.312  -2.786   7.506
  245   1HZ   LYS  37          1HZ       LYS  37  -5.055  -0.889   8.718
  246   2HZ   LYS  37          2HZ       LYS  37  -4.936   0.114   7.351
  247   3HZ   LYS  37          3HZ       LYS  37  -3.606  -0.824   7.839
  248    HA   PRO  38           HA       PRO  38  -7.547  -4.702   2.749
  249   1HB   PRO  38          2HB       PRO  38 -10.032  -3.592   2.364
  250   2HB   PRO  38          1HB       PRO  38  -9.216  -3.639   3.941
  251   1HG   PRO  38          2HG       PRO  38  -9.381  -1.411   1.961
  252   2HG   PRO  38          1HG       PRO  38  -9.546  -1.364   3.725
  253   1HD   PRO  38          2HD       PRO  38  -7.274  -0.622   2.507
  254   2HD   PRO  38          1HD       PRO  38  -7.262  -1.458   4.077
  255    H    VAL  39           H        VAL  39  -7.889  -2.170   0.318
  256    HA   VAL  39           HA       VAL  39  -9.181  -3.747  -1.717
  257    HB   VAL  39           HB       VAL  39  -7.644  -1.180  -1.491
  258   1HG1  VAL  39          1HG1      VAL  39  -8.570  -1.254  -4.129
  259   2HG1  VAL  39          2HG1      VAL  39  -7.760  -2.799  -3.909
  260   3HG1  VAL  39          3HG1      VAL  39  -6.887  -1.295  -3.608
  261   1HG2  VAL  39          1HG2      VAL  39  -9.744  -0.412  -1.340
  262   2HG2  VAL  39          2HG2      VAL  39 -10.365  -2.049  -1.554
  263   3HG2  VAL  39          3HG2      VAL  39 -10.082  -1.021  -2.961
  264    H    LEU  40           H        LEU  40  -5.816  -3.350  -0.720
  265    HA   LEU  40           HA       LEU  40  -4.787  -4.733  -3.121
  266   1HB   LEU  40          2HB       LEU  40  -3.348  -3.933  -0.577
  267   2HB   LEU  40          1HB       LEU  40  -2.652  -4.160  -2.182
  268    HG   LEU  40           HG       LEU  40  -4.662  -2.024  -1.433
  269   1HD1  LEU  40          1HD1      LEU  40  -2.344  -0.810  -2.325
  270   2HD1  LEU  40          2HD1      LEU  40  -1.738  -2.158  -1.364
  271   3HD1  LEU  40          3HD1      LEU  40  -2.824  -0.974  -0.636
  272   1HD2  LEU  40          1HD2      LEU  40  -3.066  -2.225  -3.983
  273   2HD2  LEU  40          2HD2      LEU  40  -4.508  -1.261  -3.664
  274   3HD2  LEU  40          3HD2      LEU  40  -4.636  -3.012  -3.823
  275    H    LEU  41           H        LEU  41  -5.604  -5.453   0.216
  276    HA   LEU  41           HA       LEU  41  -4.147  -7.957   0.370
  277   1HB   LEU  41          2HB       LEU  41  -6.479  -6.748   1.886
  278   2HB   LEU  41          1HB       LEU  41  -5.655  -8.230   2.376
  279    HG   LEU  41           HG       LEU  41  -4.048  -5.749   1.854
  280   1HD1  LEU  41          1HD1      LEU  41  -6.138  -5.931   3.778
  281   2HD1  LEU  41          2HD1      LEU  41  -4.933  -4.656   3.608
  282   3HD1  LEU  41          3HD1      LEU  41  -4.609  -6.040   4.652
  283   1HD2  LEU  41          1HD2      LEU  41  -2.393  -7.000   2.764
  284   2HD2  LEU  41          2HD2      LEU  41  -3.491  -8.374   2.616
  285   3HD2  LEU  41          3HD2      LEU  41  -3.408  -7.469   4.128
  286    H    ASN  42           H        ASN  42  -7.094  -6.933  -1.092
  287    HA   ASN  42           HA       ASN  42  -8.490  -9.462  -0.973
  288   1HB   ASN  42          2HB       ASN  42  -8.694  -6.848  -2.420
  289   2HB   ASN  42          1HB       ASN  42  -9.621  -8.209  -3.051
  290   1HD2  ASN  42          1HD2      ASN  42 -11.475  -6.668  -2.297
  291   2HD2  ASN  42          2HD2      ASN  42 -12.002  -6.846  -0.693
  292    H    SER  43           H        SER  43  -5.821  -8.308  -2.765
  293    HA   SER  43           HA       SER  43  -6.222  -9.910  -5.179
  294   1HB   SER  43          2HB       SER  43  -4.375  -8.740  -5.894
  295   2HB   SER  43          1HB       SER  43  -4.834  -7.693  -4.554
  296    HG   SER  43           HG       SER  43  -2.877  -8.131  -3.904
  297    H    LYS  44           H        LYS  44  -5.692 -10.898  -2.122
  298    HA   LYS  44           HA       LYS  44  -4.856 -12.910  -1.215
  299   1HB   LYS  44          2HB       LYS  44  -5.874 -13.679  -3.436
  300   2HB   LYS  44          1HB       LYS  44  -4.238 -13.621  -4.093
  301   1HG   LYS  44          2HG       LYS  44  -4.943 -15.894  -3.233
  302   2HG   LYS  44          1HG       LYS  44  -3.460 -15.263  -2.516
  303   1HD   LYS  44          2HD       LYS  44  -4.581 -14.630  -0.506
  304   2HD   LYS  44          1HD       LYS  44  -6.169 -14.860  -1.238
  305   1HE   LYS  44          2HE       LYS  44  -6.119 -17.138  -0.941
  306   2HE   LYS  44          1HE       LYS  44  -4.374 -17.238  -1.243
  307   1HZ   LYS  44          1HZ       LYS  44  -4.842 -15.656   1.045
  308   2HZ   LYS  44          2HZ       LYS  44  -3.990 -17.119   0.928
  309   3HZ   LYS  44          3HZ       LYS  44  -5.662 -17.129   1.229
  310    H    LEU  45           H        LEU  45  -3.035 -10.552  -2.503
  311    HA   LEU  45           HA       LEU  45  -0.441 -11.968  -2.585
  312   1HB   LEU  45          2HB       LEU  45  -1.493  -9.205  -3.100
  313   2HB   LEU  45          1HB       LEU  45   0.238  -9.426  -2.842
  314    HG   LEU  45           HG       LEU  45  -1.399 -10.973  -4.870
  315   1HD1  LEU  45          1HD1      LEU  45   0.175  -9.531  -6.417
  316   2HD1  LEU  45          2HD1      LEU  45   0.199  -8.441  -5.032
  317   3HD1  LEU  45          3HD1      LEU  45  -1.331  -8.844  -5.809
  318   1HD2  LEU  45          1HD2      LEU  45   0.504 -12.146  -5.336
  319   2HD2  LEU  45          2HD2      LEU  45   0.973 -11.684  -3.701
  320   3HD2  LEU  45          3HD2      LEU  45   1.545 -10.748  -5.081
  321    HA   PRO  46           HA       PRO  46   0.519 -11.188   1.615
  322   1HB   PRO  46          2HB       PRO  46   3.251 -11.080   1.473
  323   2HB   PRO  46          1HB       PRO  46   2.329 -12.588   1.328
  324   1HG   PRO  46          2HG       PRO  46   3.585 -10.932  -0.782
  325   2HG   PRO  46          1HG       PRO  46   3.424 -12.690  -0.666
  326   1HD   PRO  46          2HD       PRO  46   1.839 -11.093  -2.236
  327   2HD   PRO  46          1HD       PRO  46   1.364 -12.693  -1.635
  328    H    VAL  47           H        VAL  47   1.995  -9.591   2.956
  329    HA   VAL  47           HA       VAL  47   1.286  -6.889   2.250
  330    HB   VAL  47           HB       VAL  47   2.654  -8.439   4.399
  331   1HG1  VAL  47          1HG1      VAL  47   3.448  -5.685   3.710
  332   2HG1  VAL  47          2HG1      VAL  47   4.268  -6.875   4.711
  333   3HG1  VAL  47          3HG1      VAL  47   2.961  -5.904   5.385
  334   1HG2  VAL  47          1HG2      VAL  47   0.272  -6.802   3.974
  335   2HG2  VAL  47          2HG2      VAL  47   1.082  -6.440   5.497
  336   3HG2  VAL  47          3HG2      VAL  47   0.557  -8.086   5.148
  337    H    ASP  48           H        ASP  48   3.850  -8.932   1.311
  338    HA   ASP  48           HA       ASP  48   5.919  -6.907   1.090
  339   1HB   ASP  48          2HB       ASP  48   5.482  -9.725   0.103
  340   2HB   ASP  48          1HB       ASP  48   6.906  -8.800  -0.376
  341    H    ILE  49           H        ILE  49   3.391  -8.245  -0.970
  342    HA   ILE  49           HA       ILE  49   4.341  -6.844  -3.360
  343    HB   ILE  49           HB       ILE  49   1.610  -8.032  -2.866
  344   1HG1  ILE  49          2HG1      ILE  49   3.107  -9.727  -2.079
  345   2HG1  ILE  49          1HG1      ILE  49   2.665 -10.185  -3.720
  346   1HG2  ILE  49          1HG2      ILE  49   2.281  -8.742  -5.352
  347   2HG2  ILE  49          2HG2      ILE  49   3.325  -7.328  -5.199
  348   3HG2  ILE  49          3HG2      ILE  49   1.582  -7.162  -4.993
  349   1HD1  ILE  49          1HD1      ILE  49   5.105 -10.405  -3.294
  350   2HD1  ILE  49          2HD1      ILE  49   5.177  -8.671  -2.975
  351   3HD1  ILE  49          3HD1      ILE  49   4.742  -9.256  -4.582
  352    H    LEU  50           H        LEU  50   1.827  -6.488  -0.910
  353    HA   LEU  50           HA       LEU  50   0.631  -4.114  -2.090
  354   1HB   LEU  50          2HB       LEU  50   0.553  -5.116   0.765
  355   2HB   LEU  50          1HB       LEU  50  -0.667  -4.148  -0.061
  356    HG   LEU  50           HG       LEU  50   0.091  -7.016  -0.688
  357   1HD1  LEU  50          1HD1      LEU  50  -2.256  -7.458  -0.035
  358   2HD1  LEU  50          2HD1      LEU  50  -2.453  -5.752   0.370
  359   3HD1  LEU  50          3HD1      LEU  50  -1.329  -6.754   1.291
  360   1HD2  LEU  50          1HD2      LEU  50  -2.286  -6.036  -2.003
  361   2HD2  LEU  50          2HD2      LEU  50  -0.850  -6.762  -2.720
  362   3HD2  LEU  50          3HD2      LEU  50  -0.910  -5.026  -2.427
  363    H    GLY  51           H        GLY  51   3.203  -4.823   0.195
  364   1HA   GLY  51          2HA       GLY  51   3.451  -2.127   1.231
  365   2HA   GLY  51          1HA       GLY  51   4.696  -3.378   1.322
  366    H    ARG  52           H        ARG  52   4.409  -3.818  -1.604
  367    HA   ARG  52           HA       ARG  52   6.201  -1.616  -2.486
  368   1HB   ARG  52          2HB       ARG  52   6.337  -4.357  -2.597
  369   2HB   ARG  52          1HB       ARG  52   5.730  -3.954  -4.203
  370   1HG   ARG  52          2HG       ARG  52   7.590  -2.509  -4.638
  371   2HG   ARG  52          1HG       ARG  52   8.129  -2.598  -2.961
  372   1HD   ARG  52          2HD       ARG  52   7.873  -5.146  -4.534
  373   2HD   ARG  52          1HD       ARG  52   9.299  -4.117  -4.769
  374    HE   ARG  52           HE       ARG  52   9.043  -4.212  -2.025
  375   1HH1  ARG  52          1HH2      ARG  52   8.038  -6.885  -3.710
  376   2HH1  ARG  52          2HH2      ARG  52   9.240  -7.969  -3.095
  377   1HH2  ARG  52          2HH1      ARG  52  11.092  -5.467  -1.565
  378   2HH2  ARG  52          1HH1      ARG  52  10.971  -7.166  -1.879
  379    H    VAL  53           H        VAL  53   3.158  -3.280  -3.319
  380    HA   VAL  53           HA       VAL  53   2.800  -1.946  -5.851
  381    HB   VAL  53           HB       VAL  53   1.014  -3.334  -3.848
  382   1HG1  VAL  53          1HG1      VAL  53   0.197  -1.410  -5.841
  383   2HG1  VAL  53          2HG1      VAL  53  -0.810  -2.341  -4.732
  384   3HG1  VAL  53          3HG1      VAL  53  -0.374  -3.014  -6.303
  385   1HG2  VAL  53          1HG2      VAL  53   1.320  -4.109  -6.719
  386   2HG2  VAL  53          2HG2      VAL  53   1.190  -5.131  -5.285
  387   3HG2  VAL  53          3HG2      VAL  53   2.719  -4.337  -5.665
  388    H    TRP  54           H        TRP  54   1.765  -1.191  -2.523
  389    HA   TRP  54           HA       TRP  54   0.278   1.167  -3.203
  390   1HB   TRP  54          2HB       TRP  54  -0.086   0.280  -1.041
  391   2HB   TRP  54          1HB       TRP  54   1.642   0.093  -0.731
  392    HD1  TRP  54           HD1      TRP  54   3.066   2.384  -0.415
  393    HE1  TRP  54           HE1      TRP  54   2.377   4.655   0.545
  394    HE3  TRP  54           HE3      TRP  54  -2.001   1.906  -0.646
  395    HZ2  TRP  54           HZ2      TRP  54  -0.039   6.093   1.169
  396    HZ3  TRP  54           HZ3      TRP  54  -3.479   3.739   0.140
  397    HH2  TRP  54           HH2      TRP  54  -2.503   5.823   1.044
  398    H    GLU  55           H        GLU  55   3.647   0.781  -1.976
  399    HA   GLU  55           HA       GLU  55   4.390   3.478  -1.971
  400   1HB   GLU  55          2HB       GLU  55   5.881   0.947  -2.643
  401   2HB   GLU  55          1HB       GLU  55   6.690   2.504  -2.475
  402   1HG   GLU  55          2HG       GLU  55   4.849   1.939  -0.275
  403   2HG   GLU  55          1HG       GLU  55   6.154   0.758  -0.400
  404    H    LEU  56           H        LEU  56   4.852   1.220  -4.711
  405    HA   LEU  56           HA       LEU  56   5.649   3.270  -6.556
  406   1HB   LEU  56          2HB       LEU  56   4.274   0.622  -7.131
  407   2HB   LEU  56          1HB       LEU  56   5.352   1.508  -8.210
  408    HG   LEU  56           HG       LEU  56   6.468   0.847  -5.537
  409   1HD1  LEU  56          1HD1      LEU  56   6.526  -1.427  -5.740
  410   2HD1  LEU  56          2HD1      LEU  56   6.631  -1.368  -7.499
  411   3HD1  LEU  56          3HD1      LEU  56   5.071  -1.173  -6.703
  412   1HD2  LEU  56          1HD2      LEU  56   8.118  -0.002  -7.672
  413   2HD2  LEU  56          2HD2      LEU  56   8.286   1.479  -6.731
  414   3HD2  LEU  56          3HD2      LEU  56   7.349   1.483  -8.222
  415    H    SER  57           H        SER  57   2.648   2.507  -5.136
  416    HA   SER  57           HA       SER  57   0.998   3.655  -7.325
  417   1HB   SER  57          2HB       SER  57   0.466   2.342  -4.656
  418   2HB   SER  57          1HB       SER  57  -0.816   3.037  -5.641
  419    HG   SER  57           HG       SER  57   0.351   1.662  -7.356
  420    H    ASP  58           H        ASP  58   2.080   4.355  -4.013
  421    HA   ASP  58           HA       ASP  58   0.475   6.736  -3.652
  422   1HB   ASP  58          2HB       ASP  58   1.707   5.122  -1.995
  423   2HB   ASP  58          1HB       ASP  58   3.096   6.171  -2.287
  424    H    ILE  59           H        ILE  59   0.866   8.113  -5.499
  425    HA   ILE  59           HA       ILE  59   3.539   8.871  -6.344
  426    HB   ILE  59           HB       ILE  59   0.856  10.241  -6.724
  427   1HG1  ILE  59          2HG1      ILE  59   1.059   7.733  -7.342
  428   2HG1  ILE  59          1HG1      ILE  59   0.469   8.834  -8.587
  429   1HG2  ILE  59          1HG2      ILE  59   2.357  11.763  -7.589
  430   2HG2  ILE  59          2HG2      ILE  59   2.180  10.716  -8.996
  431   3HG2  ILE  59          3HG2      ILE  59   3.572  10.532  -7.929
  432   1HD1  ILE  59          1HD1      ILE  59   2.168   7.309  -9.511
  433   2HD1  ILE  59          2HD1      ILE  59   3.329   7.860  -8.302
  434   3HD1  ILE  59          3HD1      ILE  59   2.746   8.975  -9.539
  435    H    ASP  60           H        ASP  60   1.143  10.177  -4.090
  436    HA   ASP  60           HA       ASP  60   2.796  12.579  -3.547
  437   1HB   ASP  60          2HB       ASP  60   0.246  11.687  -2.185
  438   2HB   ASP  60          1HB       ASP  60   0.852  13.330  -2.389
  439    H    HIS  61           H        HIS  61   2.695   9.391  -2.500
  440    HA   HIS  61           HA       HIS  61   3.323   8.300  -0.489
  441   1HB   HIS  61          2HB       HIS  61   5.578   9.077   0.162
  442   2HB   HIS  61          1HB       HIS  61   5.406   9.040  -1.591
  443    HD1  HIS  61           HD1      HIS  61   5.707  11.403   1.309
  444    HD2  HIS  61           HD2      HIS  61   5.385  11.599  -2.843
  445    HE1  HIS  61           HE1      HIS  61   6.203  13.802   0.664
  446    H    ASP  62           H        ASP  62   1.165   9.742   0.228
  447    HA   ASP  62           HA       ASP  62   1.993  11.095   2.775
  448   1HB   ASP  62          2HB       ASP  62  -0.058  12.498   2.392
  449   2HB   ASP  62          1HB       ASP  62   1.147  12.693   1.119
  450    H    GLY  63           H        GLY  63   1.050   8.275   1.828
  451   1HA   GLY  63          2HA       GLY  63  -0.102   6.557   2.969
  452   2HA   GLY  63          1HA       GLY  63  -0.648   7.758   4.143
  453    H    MET  64           H        MET  64  -1.073   8.116   0.652
  454    HA   MET  64           HA       MET  64  -3.936   7.369   0.894
  455   1HB   MET  64          2HB       MET  64  -2.812  10.117   0.438
  456   2HB   MET  64          1HB       MET  64  -4.421   9.694  -0.136
  457   1HG   MET  64          2HG       MET  64  -5.104   9.092   2.122
  458   2HG   MET  64          1HG       MET  64  -3.475   9.419   2.723
  459   1HE   MET  64          1HE       MET  64  -6.822  11.987   3.044
  460   2HE   MET  64          2HE       MET  64  -6.618  10.248   2.856
  461   3HE   MET  64          3HE       MET  64  -6.915  11.250   1.437
  462    H    LEU  65           H        LEU  65  -5.033   7.364  -1.234
  463    HA   LEU  65           HA       LEU  65  -3.179   7.341  -3.587
  464   1HB   LEU  65          2HB       LEU  65  -5.027   5.219  -2.507
  465   2HB   LEU  65          1HB       LEU  65  -4.645   5.264  -4.230
  466    HG   LEU  65           HG       LEU  65  -2.572   5.200  -2.020
  467   1HD1  LEU  65          1HD1      LEU  65  -3.350   3.037  -1.900
  468   2HD1  LEU  65          2HD1      LEU  65  -2.266   2.851  -3.280
  469   3HD1  LEU  65          3HD1      LEU  65  -3.997   3.067  -3.540
  470   1HD2  LEU  65          1HD2      LEU  65  -2.404   5.968  -4.719
  471   2HD2  LEU  65          2HD2      LEU  65  -1.767   4.324  -4.669
  472   3HD2  LEU  65          3HD2      LEU  65  -1.057   5.576  -3.650
  473    H    ASP  66           H        ASP  66  -4.036   9.004  -4.824
  474    HA   ASP  66           HA       ASP  66  -6.801   9.829  -4.757
  475   1HB   ASP  66          2HB       ASP  66  -4.639  11.088  -5.396
  476   2HB   ASP  66          1HB       ASP  66  -4.815  10.319  -6.971
  477    H    ARG  67           H        ARG  67  -8.144   9.867  -6.826
  478    HA   ARG  67           HA       ARG  67  -8.885   7.321  -7.734
  479   1HB   ARG  67          2HB       ARG  67  -9.999   8.557  -9.535
  480   2HB   ARG  67          1HB       ARG  67 -10.103   9.480  -8.035
  481   1HG   ARG  67          2HG       ARG  67  -7.988  10.688  -8.781
  482   2HG   ARG  67          1HG       ARG  67  -8.222   9.935 -10.359
  483   1HD   ARG  67          2HD       ARG  67 -10.232  11.104 -10.765
  484   2HD   ARG  67          1HD       ARG  67 -10.466  11.476  -9.045
  485    HE   ARG  67           HE       ARG  67  -8.198  12.789  -9.381
  486   1HH1  ARG  67          1HH2      ARG  67 -11.030  13.928 -10.167
  487   2HH1  ARG  67          2HH2      ARG  67 -10.605  14.746 -11.634
  488   1HH2  ARG  67          2HH1      ARG  67  -7.519  13.189 -11.924
  489   2HH2  ARG  67          1HH1      ARG  67  -8.618  14.328 -12.629
  490    H    ASP  68           H        ASP  68  -6.512   9.546  -9.168
  491    HA   ASP  68           HA       ASP  68  -5.833   7.693 -11.341
  492   1HB   ASP  68          2HB       ASP  68  -5.608  10.422 -10.784
  493   2HB   ASP  68          1HB       ASP  68  -3.943   9.840 -10.718
  494    H    GLU  69           H        GLU  69  -4.520   8.675  -8.215
  495    HA   GLU  69           HA       GLU  69  -2.016   7.248  -8.400
  496   1HB   GLU  69          2HB       GLU  69  -3.340   9.019  -6.694
  497   2HB   GLU  69          1HB       GLU  69  -3.211   7.538  -5.744
  498   1HG   GLU  69          2HG       GLU  69  -0.851   7.477  -5.972
  499   2HG   GLU  69          1HG       GLU  69  -0.870   8.693  -7.247
  500    H    PHE  70           H        PHE  70  -5.044   6.553  -6.664
  501    HA   PHE  70           HA       PHE  70  -4.545   3.953  -5.752
  502   1HB   PHE  70          2HB       PHE  70  -6.531   5.560  -5.443
  503   2HB   PHE  70          1HB       PHE  70  -7.123   4.966  -6.992
  504    HD1  PHE  70           HD1      PHE  70  -6.879   4.343  -3.452
  505    HD2  PHE  70           HD2      PHE  70  -7.543   2.460  -7.253
  506    HE1  PHE  70           HE1      PHE  70  -7.917   2.405  -2.309
  507    HE2  PHE  70           HE2      PHE  70  -8.575   0.520  -6.110
  508    HZ   PHE  70           HZ       PHE  70  -8.767   0.496  -3.635
  509    H    ALA  71           H        ALA  71  -5.110   5.169  -8.971
  510    HA   ALA  71           HA       ALA  71  -5.898   2.748 -10.291
  511   1HB   ALA  71          1HB       ALA  71  -4.200   4.938 -11.480
  512   2HB   ALA  71          2HB       ALA  71  -5.879   5.243 -11.022
  513   3HB   ALA  71          3HB       ALA  71  -5.504   4.027 -12.244
  514    H    VAL  72           H        VAL  72  -2.716   4.285  -9.918
  515    HA   VAL  72           HA       VAL  72  -1.159   2.371 -11.294
  516    HB   VAL  72           HB       VAL  72  -0.424   3.919  -8.791
  517   1HG1  VAL  72          1HG1      VAL  72   1.202   2.227  -9.855
  518   2HG1  VAL  72          2HG1      VAL  72   1.804   3.868  -9.618
  519   3HG1  VAL  72          3HG1      VAL  72   1.283   3.342 -11.219
  520   1HG2  VAL  72          1HG2      VAL  72   0.288   5.620 -10.677
  521   2HG2  VAL  72          2HG2      VAL  72  -1.383   5.586 -10.112
  522   3HG2  VAL  72          3HG2      VAL  72  -0.947   4.783 -11.619
  523    H    ALA  73           H        ALA  73  -2.623   2.251  -8.109
  524    HA   ALA  73           HA       ALA  73  -1.004  -0.069  -7.258
  525   1HB   ALA  73          1HB       ALA  73  -3.298   0.516  -5.620
  526   2HB   ALA  73          2HB       ALA  73  -2.507   2.024  -6.101
  527   3HB   ALA  73          3HB       ALA  73  -1.587   0.775  -5.264
  528    H    MET  74           H        MET  74  -3.842   0.296  -9.148
  529    HA   MET  74           HA       MET  74  -4.999  -2.252  -8.164
  530   1HB   MET  74          2HB       MET  74  -5.864  -0.655 -10.576
  531   2HB   MET  74          1HB       MET  74  -6.847  -1.709  -9.568
  532   1HG   MET  74          2HG       MET  74  -5.927   1.090  -9.069
  533   2HG   MET  74          1HG       MET  74  -7.507   0.373  -8.796
  534   1HE   MET  74          1HE       MET  74  -7.227  -1.976  -7.718
  535   2HE   MET  74          2HE       MET  74  -7.535  -1.648  -6.015
  536   3HE   MET  74          3HE       MET  74  -6.017  -2.402  -6.500
  537    H    PHE  75           H        PHE  75  -3.097  -1.051 -10.886
  538    HA   PHE  75           HA       PHE  75  -3.367  -3.607 -12.328
  539   1HB   PHE  75          2HB       PHE  75  -2.314  -2.461 -14.075
  540   2HB   PHE  75          1HB       PHE  75  -3.085  -1.130 -13.213
  541    HD1  PHE  75           HD1      PHE  75   0.114  -2.887 -13.833
  542    HD2  PHE  75           HD2      PHE  75  -1.786   0.492 -11.984
  543    HE1  PHE  75           HE1      PHE  75   2.331  -1.833 -13.480
  544    HE2  PHE  75           HE2      PHE  75   0.429   1.541 -11.628
  545    HZ   PHE  75           HZ       PHE  75   2.489   0.380 -12.377
  546    H    LEU  76           H        LEU  76  -1.298  -2.135  -9.975
  547    HA   LEU  76           HA       LEU  76   0.982  -3.934 -10.451
  548   1HB   LEU  76          2HB       LEU  76   0.265  -1.584  -8.839
  549   2HB   LEU  76          1HB       LEU  76   1.285  -2.739  -7.977
  550    HG   LEU  76           HG       LEU  76   1.880  -1.616 -10.730
  551   1HD1  LEU  76          1HD1      LEU  76   3.634  -1.048  -8.406
  552   2HD1  LEU  76          2HD1      LEU  76   2.069  -0.234  -8.402
  553   3HD1  LEU  76          3HD1      LEU  76   3.177  -0.006  -9.754
  554   1HD2  LEU  76          1HD2      LEU  76   3.066  -3.732  -9.016
  555   2HD2  LEU  76          2HD2      LEU  76   4.212  -2.629  -9.778
  556   3HD2  LEU  76          3HD2      LEU  76   3.092  -3.561 -10.771
  557    H    VAL  77           H        VAL  77  -1.979  -3.950  -8.654
  558    HA   VAL  77           HA       VAL  77  -1.055  -6.061  -6.793
  559    HB   VAL  77           HB       VAL  77  -3.525  -4.369  -7.189
  560   1HG1  VAL  77          1HG1      VAL  77  -4.564  -5.610  -5.289
  561   2HG1  VAL  77          2HG1      VAL  77  -3.248  -6.780  -5.358
  562   3HG1  VAL  77          3HG1      VAL  77  -4.363  -6.629  -6.715
  563   1HG2  VAL  77          1HG2      VAL  77  -2.704  -4.462  -4.503
  564   2HG2  VAL  77          2HG2      VAL  77  -2.397  -3.157  -5.649
  565   3HG2  VAL  77          3HG2      VAL  77  -1.205  -4.437  -5.430
  566    H    TYR  78           H        TYR  78  -3.427  -5.631  -9.437
  567    HA   TYR  78           HA       TYR  78  -4.365  -8.355  -9.373
  568   1HB   TYR  78          2HB       TYR  78  -4.650  -5.909 -10.988
  569   2HB   TYR  78          1HB       TYR  78  -4.866  -7.401 -11.905
  570    HD1  TYR  78           HD1      TYR  78  -6.632  -5.008 -10.167
  571    HD2  TYR  78           HD2      TYR  78  -6.198  -9.279 -10.363
  572    HE1  TYR  78           HE1      TYR  78  -8.895  -5.283  -9.192
  573    HE2  TYR  78           HE2      TYR  78  -8.463  -9.553  -9.388
  574    HH   TYR  78           HH       TYR  78 -10.304  -6.785  -8.208
  575    H    CYS  79           H        CYS  79  -1.820  -6.702 -11.208
  576    HA   CYS  79           HA       CYS  79  -1.241  -9.077 -12.834
  577   1HB   CYS  79          2HB       CYS  79   0.204  -6.445 -12.384
  578   2HB   CYS  79          1HB       CYS  79   0.574  -7.600 -13.665
  579    HG   CYS  79           HG       CYS  79  -2.330  -6.894 -13.861
  580    H    ALA  80           H        ALA  80  -0.538  -8.072  -9.667
  581    HA   ALA  80           HA       ALA  80   2.135  -9.366  -9.577
  582   1HB   ALA  80          1HB       ALA  80   0.360  -7.977  -7.544
  583   2HB   ALA  80          2HB       ALA  80   1.757  -7.285  -8.367
  584   3HB   ALA  80          3HB       ALA  80   1.981  -8.579  -7.190
  585    H    LEU  81           H        LEU  81  -1.182  -9.872  -8.681
  586    HA   LEU  81           HA       LEU  81  -0.645 -12.330  -7.147
  587   1HB   LEU  81          2HB       LEU  81  -2.760 -11.917  -6.348
  588   2HB   LEU  81          1HB       LEU  81  -2.340 -10.291  -6.890
  589    HG   LEU  81           HG       LEU  81  -3.308 -11.275  -9.190
  590   1HD1  LEU  81          1HD1      LEU  81  -3.753 -13.354  -7.549
  591   2HD1  LEU  81          2HD1      LEU  81  -4.806 -12.982  -8.922
  592   3HD1  LEU  81          3HD1      LEU  81  -5.259 -12.464  -7.295
  593   1HD2  LEU  81          1HD2      LEU  81  -5.081 -10.263  -6.956
  594   2HD2  LEU  81          2HD2      LEU  81  -5.278  -9.999  -8.691
  595   3HD2  LEU  81          3HD2      LEU  81  -3.937  -9.235  -7.828
  596    H    GLU  82           H        GLU  82  -1.595 -11.380 -10.373
  597    HA   GLU  82           HA       GLU  82  -2.863 -13.869 -11.137
  598   1HB   GLU  82          2HB       GLU  82  -2.986 -11.494 -12.162
  599   2HB   GLU  82          1HB       GLU  82  -1.468 -11.907 -12.958
  600   1HG   GLU  82          2HG       GLU  82  -2.823 -12.764 -14.577
  601   2HG   GLU  82          1HG       GLU  82  -2.949 -14.140 -13.480
  602    H    LYS  83           H        LYS  83   0.296 -12.481 -12.057
  603    HA   LYS  83           HA       LYS  83   1.785 -14.889 -11.589
  604   1HB   LYS  83          2HB       LYS  83   0.133 -15.390 -13.533
  605   2HB   LYS  83          1HB       LYS  83   1.216 -14.397 -14.506
  606   1HG   LYS  83          2HG       LYS  83   2.884 -15.958 -14.479
  607   2HG   LYS  83          1HG       LYS  83   2.527 -16.458 -12.825
  608   1HD   LYS  83          2HD       LYS  83   1.218 -18.159 -13.528
  609   2HD   LYS  83          1HD       LYS  83   0.343 -17.111 -14.645
  610   1HE   LYS  83          2HE       LYS  83   2.861 -17.373 -15.827
  611   2HE   LYS  83          1HE       LYS  83   2.495 -18.999 -15.214
  612   1HZ   LYS  83          1HZ       LYS  83   1.293 -19.059 -17.131
  613   2HZ   LYS  83          2HZ       LYS  83   1.038 -17.379 -17.169
  614   3HZ   LYS  83          3HZ       LYS  83   0.121 -18.357 -16.127
  615    H    GLU  84           H        GLU  84   2.319 -12.179 -11.069
  616    HA   GLU  84           HA       GLU  84   4.762 -11.771 -12.720
  617   1HB   GLU  84          2HB       GLU  84   2.403 -10.483 -13.295
  618   2HB   GLU  84          1HB       GLU  84   3.178  -9.332 -12.207
  619   1HG   GLU  84          2HG       GLU  84   5.161  -9.258 -13.593
  620   2HG   GLU  84          1HG       GLU  84   4.550 -10.561 -14.613
  621    HA   PRO  85           HA       PRO  85   6.216 -10.690  -8.690
  622   1HB   PRO  85          2HB       PRO  85   8.691  -9.795  -9.429
  623   2HB   PRO  85          1HB       PRO  85   8.256 -11.514  -9.404
  624   1HG   PRO  85          2HG       PRO  85   8.527  -9.668 -11.701
  625   2HG   PRO  85          1HG       PRO  85   8.842 -11.405 -11.600
  626   1HD   PRO  85          2HD       PRO  85   6.582 -10.234 -12.720
  627   2HD   PRO  85          1HD       PRO  85   6.726 -11.931 -12.213
  628    H    VAL  86           H        VAL  86   6.598  -8.747  -7.440
  629    HA   VAL  86           HA       VAL  86   6.038  -6.202  -8.933
  630    HB   VAL  86           HB       VAL  86   5.475  -6.973  -6.054
  631   1HG1  VAL  86          1HG1      VAL  86   3.847  -4.864  -7.174
  632   2HG1  VAL  86          2HG1      VAL  86   5.555  -4.459  -7.337
  633   3HG1  VAL  86          3HG1      VAL  86   4.883  -4.824  -5.746
  634   1HG2  VAL  86          1HG2      VAL  86   3.048  -6.806  -7.124
  635   2HG2  VAL  86          2HG2      VAL  86   3.970  -8.308  -7.201
  636   3HG2  VAL  86          3HG2      VAL  86   3.920  -7.232  -8.597
  637    HA   PRO  87           HA       PRO  87  10.108  -5.293  -7.247
  638   1HB   PRO  87          2HB       PRO  87  10.695  -3.326  -9.045
  639   2HB   PRO  87          1HB       PRO  87  10.857  -5.051  -9.423
  640   1HG   PRO  87          2HG       PRO  87   8.812  -3.121 -10.294
  641   2HG   PRO  87          1HG       PRO  87   9.382  -4.598 -11.079
  642   1HD   PRO  87          2HD       PRO  87   6.997  -4.274  -9.612
  643   2HD   PRO  87          1HD       PRO  87   7.688  -5.799 -10.198
  644    H    MET  88           H        MET  88  11.095  -2.978  -6.685
  645    HA   MET  88           HA       MET  88   8.912  -1.417  -5.366
  646   1HB   MET  88          2HB       MET  88  11.634  -0.587  -4.808
  647   2HB   MET  88          1HB       MET  88  10.406  -1.158  -3.685
  648   1HG   MET  88          2HG       MET  88  10.988  -3.525  -4.445
  649   2HG   MET  88          1HG       MET  88  12.372  -2.824  -5.279
  650   1HE   MET  88          1HE       MET  88  14.967  -2.644  -3.366
  651   2HE   MET  88          2HE       MET  88  14.077  -3.515  -4.614
  652   3HE   MET  88          3HE       MET  88  14.395  -4.292  -3.065
  653    H    SER  89           H        SER  89  10.330  -1.313  -8.269
  654    HA   SER  89           HA       SER  89  11.130   1.523  -8.213
  655   1HB   SER  89          2HB       SER  89  12.383   0.932 -10.006
  656   2HB   SER  89          1HB       SER  89  12.053  -0.709  -9.460
  657    HG   SER  89           HG       SER  89  11.287  -0.821 -11.449
  658    H    LEU  90           H        LEU  90   9.644   3.006  -8.502
  659    HA   LEU  90           HA       LEU  90   7.248   2.396 -10.172
  660   1HB   LEU  90          2HB       LEU  90   6.365   3.193  -8.228
  661   2HB   LEU  90          1HB       LEU  90   7.887   3.916  -7.726
  662    HG   LEU  90           HG       LEU  90   7.470   5.877  -9.047
  663   1HD1  LEU  90          1HD1      LEU  90   4.766   5.130  -9.949
  664   2HD1  LEU  90          2HD1      LEU  90   6.048   4.189 -10.712
  665   3HD1  LEU  90          3HD1      LEU  90   6.053   5.949 -10.835
  666   1HD2  LEU  90          1HD2      LEU  90   5.932   6.764  -7.628
  667   2HD2  LEU  90          2HD2      LEU  90   5.987   5.174  -6.868
  668   3HD2  LEU  90          3HD2      LEU  90   4.718   5.550  -8.033
  669    HA   PRO  91           HA       PRO  91  10.019   4.866 -12.869
  670   1HB   PRO  91          2HB       PRO  91   9.021   3.767 -15.182
  671   2HB   PRO  91          1HB       PRO  91  10.321   3.025 -14.226
  672   1HG   PRO  91          2HG       PRO  91   7.397   2.408 -14.231
  673   2HG   PRO  91          1HG       PRO  91   8.779   1.298 -14.236
  674   1HD   PRO  91          2HD       PRO  91   7.423   1.825 -11.983
  675   2HD   PRO  91          1HD       PRO  91   9.186   1.576 -11.970
  676    HA   PRO  92           HA       PRO  92   7.223   7.986 -14.142
  677   1HB   PRO  92          2HB       PRO  92   7.975   8.551 -16.714
  678   2HB   PRO  92          1HB       PRO  92   8.938   9.018 -15.297
  679   1HG   PRO  92          2HG       PRO  92   9.278   6.692 -17.135
  680   2HG   PRO  92          1HG       PRO  92  10.505   7.771 -16.447
  681   1HD   PRO  92          2HD       PRO  92  10.039   5.311 -15.455
  682   2HD   PRO  92          1HD       PRO  92  10.526   6.674 -14.420
  683    H    ALA  93           H        ALA  93   7.167   4.977 -15.678
  684    HA   ALA  93           HA       ALA  93   5.085   5.522 -17.645
  685   1HB   ALA  93          1HB       ALA  93   5.054   2.961 -17.634
  686   2HB   ALA  93          2HB       ALA  93   6.318   3.048 -16.407
  687   3HB   ALA  93          3HB       ALA  93   6.607   3.703 -18.018
  688    H    LEU  94           H        LEU  94   5.180   5.077 -14.245
  689    HA   LEU  94           HA       LEU  94   2.350   4.156 -14.166
  690   1HB   LEU  94          2HB       LEU  94   4.608   4.400 -12.165
  691   2HB   LEU  94          1HB       LEU  94   2.959   4.102 -11.638
  692    HG   LEU  94           HG       LEU  94   3.511   1.910 -11.857
  693   1HD1  LEU  94          1HD1      LEU  94   3.127   0.939 -14.049
  694   2HD1  LEU  94          2HD1      LEU  94   3.451   2.488 -14.825
  695   3HD1  LEU  94          3HD1      LEU  94   2.009   2.287 -13.827
  696   1HD2  LEU  94          1HD2      LEU  94   5.515   2.106 -14.017
  697   2HD2  LEU  94          2HD2      LEU  94   5.594   1.249 -12.478
  698   3HD2  LEU  94          3HD2      LEU  94   5.920   2.980 -12.541
  699    H    VAL  95           H        VAL  95   4.177   7.026 -14.051
  700    HA   VAL  95           HA       VAL  95   2.334   8.477 -12.254
  701    HB   VAL  95           HB       VAL  95   4.759   9.223 -13.919
  702   1HG1  VAL  95          1HG1      VAL  95   4.286  11.157 -11.921
  703   2HG1  VAL  95          2HG1      VAL  95   2.731  10.897 -12.709
  704   3HG1  VAL  95          3HG1      VAL  95   4.134  11.373 -13.665
  705   1HG2  VAL  95          1HG2      VAL  95   5.665   9.547 -11.520
  706   2HG2  VAL  95          2HG2      VAL  95   5.434   7.889 -12.077
  707   3HG2  VAL  95          3HG2      VAL  95   4.250   8.630 -10.999
  708    HA   PRO  96           HA       PRO  96  -0.248   9.592 -15.711
  709   1HB   PRO  96          2HB       PRO  96  -1.892  11.291 -14.332
  710   2HB   PRO  96          1HB       PRO  96  -2.023   9.524 -14.221
  711   1HG   PRO  96          2HG       PRO  96  -0.777  11.452 -12.331
  712   2HG   PRO  96          1HG       PRO  96  -1.706   9.983 -11.998
  713   1HD   PRO  96          2HD       PRO  96   1.024  10.126 -11.854
  714   2HD   PRO  96          1HD       PRO  96   0.125   8.629 -12.181
  715    HA   PRO  97           HA       PRO  97   1.188  13.539 -17.027
  716   1HB   PRO  97          2HB       PRO  97  -1.035  14.783 -18.033
  717   2HB   PRO  97          1HB       PRO  97  -0.232  13.429 -18.852
  718   1HG   PRO  97          2HG       PRO  97  -2.686  13.431 -17.165
  719   2HG   PRO  97          1HG       PRO  97  -2.339  12.531 -18.649
  720   1HD   PRO  97          2HD       PRO  97  -2.211  11.415 -16.172
  721   2HD   PRO  97          1HD       PRO  97  -1.212  10.871 -17.539
  722    H    SER  98           H        SER  98  -1.092  13.337 -14.510
  723    HA   SER  98           HA       SER  98  -1.497  16.152 -13.976
  724   1HB   SER  98          2HB       SER  98  -3.054  14.902 -12.852
  725   2HB   SER  98          1HB       SER  98  -1.978  13.514 -12.719
  726    HG   SER  98           HG       SER  98  -2.550  14.828 -10.742
  727    H    LYS  99           H        LYS  99   1.019  13.838 -13.212
  728    HA   LYS  99           HA       LYS  99   2.291  15.642 -11.244
  729   1HB   LYS  99          2HB       LYS  99   2.127  12.931 -11.559
  730   2HB   LYS  99          1HB       LYS  99   3.697  13.255 -12.296
  731   1HG   LYS  99          2HG       LYS  99   3.529  14.806  -9.908
  732   2HG   LYS  99          1HG       LYS  99   3.038  13.158  -9.514
  733   1HD   LYS  99          2HD       LYS  99   5.103  12.354 -10.738
  734   2HD   LYS  99          1HD       LYS  99   5.619  14.038 -10.829
  735   1HE   LYS  99          2HE       LYS  99   6.182  14.110  -8.613
  736   2HE   LYS  99          1HE       LYS  99   4.787  13.124  -8.132
  737   1HZ   LYS  99          1HZ       LYS  99   5.848  11.171  -8.725
  738   2HZ   LYS  99          2HZ       LYS  99   7.122  12.067  -8.048
  739   3HZ   LYS  99          3HZ       LYS  99   6.965  11.950  -9.736
  740    H    ARG 100           H        ARG 100   2.019  15.815 -14.458
  741    HA   ARG 100           HA       ARG 100   4.605  17.199 -14.776
  742   1HB   ARG 100          2HB       ARG 100   5.334  15.756 -16.602
  743   2HB   ARG 100          1HB       ARG 100   5.012  14.754 -15.188
  744   1HG   ARG 100          2HG       ARG 100   3.300  13.673 -16.202
  745   2HG   ARG 100          1HG       ARG 100   2.647  15.166 -16.879
  746   1HD   ARG 100          2HD       ARG 100   3.529  14.648 -18.898
  747   2HD   ARG 100          1HD       ARG 100   5.151  14.562 -18.181
  748    HE   ARG 100           HE       ARG 100   3.414  12.240 -17.648
  749   1HH1  ARG 100          1HH2      ARG 100   4.833  13.364 -20.438
  750   2HH1  ARG 100          2HH2      ARG 100   5.909  12.026 -20.659
  751   1HH2  ARG 100          2HH1      ARG 100   5.250  10.638 -17.550
  752   2HH2  ARG 100          1HH1      ARG 100   6.146  10.483 -19.025
  753    H    SER 107           1H       SER 107   9.021   4.564   3.724
  754    HA   SER 107           HA       SER 107   7.912   6.547   3.739
  755   1HB   SER 107          2HB       SER 107   8.136   5.202   1.131
  756   2HB   SER 107          1HB       SER 107   7.015   6.560   1.124
  757    HG   SER 107           HG       SER 107   8.960   7.465   0.767
  758    H    THR 108           H        THR 108   6.065   6.294   5.151
  759    HA   THR 108           HA       THR 108   3.761   6.068   5.679
  760    HB   THR 108           HB       THR 108   2.410   7.404   4.095
  761    HG1  THR 108           HG1      THR 108   3.390   6.492   2.201
  762   1HG2  THR 108          1HG2      THR 108   4.237   8.396   5.658
  763   2HG2  THR 108          2HG2      THR 108   3.568   9.428   4.394
  764   3HG2  THR 108          3HG2      THR 108   5.142   8.665   4.169
  765    H    ASN 109           H        ASN 109   4.424   3.578   5.107
  766    HA   ASN 109           HA       ASN 109   2.577   2.655   2.933
  767   1HB   ASN 109          2HB       ASN 109   4.984   2.189   2.619
  768   2HB   ASN 109          1HB       ASN 109   5.023   1.353   4.173
  769   1HD2  ASN 109          1HD2      ASN 109   2.720   1.260   1.395
  770   2HD2  ASN 109          2HD2      ASN 109   2.750  -0.426   1.236
  771    HA   PRO 110           HA       PRO 110   0.269   0.985   6.342
  772   1HB   PRO 110          2HB       PRO 110  -1.645  -0.262   4.841
  773   2HB   PRO 110          1HB       PRO 110  -1.621   1.491   5.115
  774   1HG   PRO 110          2HG       PRO 110  -0.771  -0.063   2.733
  775   2HG   PRO 110          1HG       PRO 110  -1.560   1.518   2.829
  776   1HD   PRO 110          2HD       PRO 110   1.120   1.145   2.349
  777   2HD   PRO 110          1HD       PRO 110   0.420   2.627   3.033
  778    H    PHE 111           H        PHE 111   2.073  -0.750   4.026
  779    HA   PHE 111           HA       PHE 111   1.496  -3.344   5.425
  780   1HB   PHE 111          2HB       PHE 111   2.409  -2.693   2.606
  781   2HB   PHE 111          1HB       PHE 111   2.340  -4.333   3.250
  782    HD1  PHE 111           HD1      PHE 111   0.523  -1.840   1.519
  783    HD2  PHE 111           HD2      PHE 111   0.064  -4.992   4.399
  784    HE1  PHE 111           HE1      PHE 111  -1.895  -1.973   0.989
  785    HE2  PHE 111           HE2      PHE 111  -2.353  -5.125   3.870
  786    HZ   PHE 111           HZ       PHE 111  -3.327  -3.616   2.166
  787    H    LEU 112           HN       LEU 112   3.601  -0.972   5.731
  788    HA   LEU 112           HA       LEU 112   5.898  -2.821   6.208
  789   1HB   LEU 112          2HB       LEU 112   5.759  -0.348   4.493
  790   2HB   LEU 112          1HB       LEU 112   7.284  -0.815   5.245
  791    HG   LEU 112           HG       LEU 112   5.610  -2.681   3.543
  792   1HD1  LEU 112          1HD1      LEU 112   7.319  -2.295   1.796
  793   2HD1  LEU 112          2HD1      LEU 112   8.082  -1.077   2.817
  794   3HD1  LEU 112          3HD1      LEU 112   6.457  -0.807   2.186
  795   1HD2  LEU 112          1HD2      LEU 112   7.017  -3.917   5.030
  796   2HD2  LEU 112          2HD2      LEU 112   8.366  -2.808   4.788
  797   3HD2  LEU 112          3HD2      LEU 112   7.867  -3.889   3.485
  Start of MODEL   12
    1    HA   PRO   6           HA       PRO   6   2.203   5.908 -23.348
    2   1HB   PRO   6          2HB       PRO   6  -0.495   5.893 -22.938
    3   2HB   PRO   6          1HB       PRO   6   0.243   6.319 -24.495
    4   1HG   PRO   6          2HG       PRO   6  -1.081   3.803 -23.653
    5   2HG   PRO   6          1HG       PRO   6  -1.056   4.595 -25.234
    6   1HD   PRO   6          2HD       PRO   6   0.479   2.405 -24.539
    7   2HD   PRO   6          1HD       PRO   6   0.843   3.523 -25.871
    8    H    TRP   7           H        TRP   7   0.330   6.314 -21.316
    9    HA   TRP   7           HA       TRP   7   1.472   5.480 -18.964
   10   1HB   TRP   7          2HB       TRP   7  -0.440   7.056 -19.301
   11   2HB   TRP   7          1HB       TRP   7  -1.501   5.674 -19.571
   12    HD1  TRP   7           HD1      TRP   7   1.124   5.076 -17.020
   13    HE1  TRP   7           HE1      TRP   7   0.093   5.115 -14.656
   14    HE3  TRP   7           HE3      TRP   7  -3.482   6.957 -18.110
   15    HZ2  TRP   7           HZ2      TRP   7  -2.366   5.855 -13.393
   16    HZ3  TRP   7           HZ3      TRP   7  -5.153   7.323 -16.315
   17    HH2  TRP   7           HH2      TRP   7  -4.601   6.774 -13.960
   18    H    ALA   8           H        ALA   8   1.917   3.472 -18.191
   19    HA   ALA   8           HA       ALA   8   1.282   0.994 -19.228
   20   1HB   ALA   8          1HB       ALA   8   1.852   0.160 -17.030
   21   2HB   ALA   8          2HB       ALA   8   1.342   1.670 -16.275
   22   3HB   ALA   8          3HB       ALA   8   2.789   1.634 -17.284
   23    H    VAL   9           H        VAL   9  -0.829   3.133 -17.429
   24    HA   VAL   9           HA       VAL   9  -2.887   0.995 -17.160
   25    HB   VAL   9           HB       VAL   9  -2.508   3.797 -16.082
   26   1HG1  VAL   9          1HG1      VAL   9  -4.978   2.297 -16.479
   27   2HG1  VAL   9          2HG1      VAL   9  -4.757   3.965 -15.948
   28   3HG1  VAL   9          3HG1      VAL   9  -4.692   2.649 -14.774
   29   1HG2  VAL   9          1HG2      VAL   9  -2.879   1.143 -14.661
   30   2HG2  VAL   9          2HG2      VAL   9  -2.343   2.668 -13.955
   31   3HG2  VAL   9          3HG2      VAL   9  -1.298   1.801 -15.080
   32    H    LYS  10           H        LYS  10  -5.014   1.320 -18.076
   33    HA   LYS  10           HA       LYS  10  -5.025   3.231 -20.388
   34   1HB   LYS  10          2HB       LYS  10  -7.055   1.157 -20.493
   35   2HB   LYS  10          1HB       LYS  10  -5.773   1.503 -21.644
   36   1HG   LYS  10          2HG       LYS  10  -5.376  -0.105 -19.102
   37   2HG   LYS  10          1HG       LYS  10  -5.675  -0.813 -20.686
   38   1HD   LYS  10          2HD       LYS  10  -3.563   1.155 -20.855
   39   2HD   LYS  10          1HD       LYS  10  -3.183  -0.056 -19.628
   40   1HE   LYS  10          2HE       LYS  10  -4.267  -1.512 -21.786
   41   2HE   LYS  10          1HE       LYS  10  -3.149  -0.341 -22.512
   42   1HZ   LYS  10          1HZ       LYS  10  -1.635  -1.880 -21.856
   43   2HZ   LYS  10          2HZ       LYS  10  -2.611  -2.483 -20.603
   44   3HZ   LYS  10          3HZ       LYS  10  -1.748  -1.036 -20.390
   45    HA   PRO  11           HA       PRO  11  -8.687   5.143 -18.914
   46   1HB   PRO  11          2HB       PRO  11 -10.476   5.003 -20.981
   47   2HB   PRO  11          1HB       PRO  11  -9.056   6.069 -21.005
   48   1HG   PRO  11          2HG       PRO  11  -9.461   3.424 -22.307
   49   2HG   PRO  11          1HG       PRO  11  -8.631   4.865 -22.914
   50   1HD   PRO  11          2HD       PRO  11  -7.326   2.698 -21.906
   51   2HD   PRO  11          1HD       PRO  11  -6.674   4.351 -21.840
   52    H    GLU  12           H        GLU  12  -9.295   2.019 -20.481
   53    HA   GLU  12           HA       GLU  12 -11.839   1.540 -19.158
   54   1HB   GLU  12          2HB       GLU  12  -9.977  -0.594 -20.196
   55   2HB   GLU  12          1HB       GLU  12 -11.737  -0.531 -20.282
   56   1HG   GLU  12          2HG       GLU  12 -11.336   1.598 -21.746
   57   2HG   GLU  12          1HG       GLU  12  -9.713   0.937 -21.950
   58    H    ASP  13           H        ASP  13  -8.457   0.927 -18.424
   59    HA   ASP  13           HA       ASP  13  -9.005  -0.844 -16.159
   60   1HB   ASP  13          2HB       ASP  13  -6.596   0.640 -17.248
   61   2HB   ASP  13          1HB       ASP  13  -6.508  -0.361 -15.797
   62    H    LYS  14           H        LYS  14  -8.056   2.535 -16.670
   63    HA   LYS  14           HA       LYS  14  -7.959   3.286 -13.905
   64   1HB   LYS  14          2HB       LYS  14  -6.910   4.673 -15.537
   65   2HB   LYS  14          1HB       LYS  14  -8.367   4.726 -16.530
   66   1HG   LYS  14          2HG       LYS  14  -8.223   6.842 -15.392
   67   2HG   LYS  14          1HG       LYS  14  -9.511   5.923 -14.611
   68   1HD   LYS  14          2HD       LYS  14  -8.387   5.808 -12.648
   69   2HD   LYS  14          1HD       LYS  14  -6.865   5.415 -13.449
   70   1HE   LYS  14          2HE       LYS  14  -6.848   7.642 -12.235
   71   2HE   LYS  14          1HE       LYS  14  -6.471   7.769 -13.964
   72   1HZ   LYS  14          1HZ       LYS  14  -8.491   9.083 -12.686
   73   2HZ   LYS  14          2HZ       LYS  14  -9.290   7.784 -13.436
   74   3HZ   LYS  14          3HZ       LYS  14  -8.359   8.863 -14.361
   75    H    ALA  15           H        ALA  15 -10.531   2.594 -16.075
   76    HA   ALA  15           HA       ALA  15 -12.593   4.191 -14.748
   77   1HB   ALA  15          1HB       ALA  15 -13.476   3.702 -16.779
   78   2HB   ALA  15          2HB       ALA  15 -13.723   2.052 -16.206
   79   3HB   ALA  15          3HB       ALA  15 -12.242   2.474 -17.065
   80    H    LYS  16           H        LYS  16 -11.524   0.788 -14.747
   81    HA   LYS  16           HA       LYS  16 -13.494   0.024 -12.718
   82   1HB   LYS  16          2HB       LYS  16 -12.791  -2.105 -13.249
   83   2HB   LYS  16          1HB       LYS  16 -12.173  -1.281 -14.677
   84   1HG   LYS  16          2HG       LYS  16  -9.977  -1.049 -13.618
   85   2HG   LYS  16          1HG       LYS  16 -10.591  -1.817 -12.154
   86   1HD   LYS  16          2HD       LYS  16 -10.486  -3.115 -14.894
   87   2HD   LYS  16          1HD       LYS  16  -9.365  -3.439 -13.572
   88   1HE   LYS  16          2HE       LYS  16 -11.692  -3.860 -12.263
   89   2HE   LYS  16          1HE       LYS  16 -12.188  -4.320 -13.905
   90   1HZ   LYS  16          1HZ       LYS  16 -10.076  -5.466 -12.213
   91   2HZ   LYS  16          2HZ       LYS  16  -9.864  -5.476 -13.899
   92   3HZ   LYS  16          3HZ       LYS  16 -11.205  -6.254 -13.204
   93    H    TYR  17           H        TYR  17 -10.282   1.307 -12.876
   94    HA   TYR  17           HA       TYR  17  -9.460   0.594 -10.164
   95   1HB   TYR  17          2HB       TYR  17  -8.563   2.673 -12.195
   96   2HB   TYR  17          1HB       TYR  17  -7.731   2.377 -10.674
   97    HD1  TYR  17           HD1      TYR  17  -9.159  -0.644 -11.892
   98    HD2  TYR  17           HD2      TYR  17  -5.808   1.989 -12.425
   99    HE1  TYR  17           HE1      TYR  17  -7.891  -2.475 -12.968
  100    HE2  TYR  17           HE2      TYR  17  -4.528   0.151 -13.490
  101    HH   TYR  17           HH       TYR  17  -5.800  -2.464 -14.765
  102    H    ASP  18           H        ASP  18 -11.024   3.292 -11.813
  103    HA   ASP  18           HA       ASP  18 -11.094   5.045  -9.474
  104   1HB   ASP  18          2HB       ASP  18 -11.057   5.824 -11.829
  105   2HB   ASP  18          1HB       ASP  18 -12.616   5.042 -12.104
  106    H    ALA  19           H        ALA  19 -12.828   2.285 -10.414
  107    HA   ALA  19           HA       ALA  19 -15.350   3.108  -9.063
  108   1HB   ALA  19          1HB       ALA  19 -15.870   1.830 -10.936
  109   2HB   ALA  19          2HB       ALA  19 -15.713   0.534  -9.751
  110   3HB   ALA  19          3HB       ALA  19 -14.374   0.902 -10.838
  111    H    ILE  20           H        ILE  20 -12.555   1.023  -8.789
  112    HA   ILE  20           HA       ILE  20 -13.352  -0.263  -6.298
  113    HB   ILE  20           HB       ILE  20 -10.859   0.027  -7.997
  114   1HG1  ILE  20          2HG1      ILE  20 -12.241  -2.542  -7.288
  115   2HG1  ILE  20          1HG1      ILE  20 -12.952  -1.490  -8.514
  116   1HG2  ILE  20          1HG2      ILE  20 -11.082  -1.775  -5.595
  117   2HG2  ILE  20          2HG2      ILE  20 -10.393  -0.155  -5.491
  118   3HG2  ILE  20          3HG2      ILE  20  -9.644  -1.366  -6.528
  119   1HD1  ILE  20          1HD1      ILE  20 -10.158  -2.665  -8.536
  120   2HD1  ILE  20          2HD1      ILE  20 -10.737  -1.470  -9.698
  121   3HD1  ILE  20          3HD1      ILE  20 -11.482  -3.068  -9.628
  122    H    PHE  21           H        PHE  21 -11.506   2.518  -7.392
  123    HA   PHE  21           HA       PHE  21 -10.390   3.226  -4.813
  124   1HB   PHE  21          2HB       PHE  21  -9.175   4.153  -6.546
  125   2HB   PHE  21          1HB       PHE  21 -10.589   4.288  -7.585
  126    HD1  PHE  21           HD1      PHE  21  -8.347   6.044  -5.397
  127    HD2  PHE  21           HD2      PHE  21 -12.326   6.103  -7.015
  128    HE1  PHE  21           HE1      PHE  21  -8.539   8.454  -4.843
  129    HE2  PHE  21           HE2      PHE  21 -12.519   8.509  -6.459
  130    HZ   PHE  21           HZ       PHE  21 -10.628   9.684  -5.374
  131    H    ASP  22           H        ASP  22 -13.215   4.149  -6.717
  132    HA   ASP  22           HA       ASP  22 -14.159   6.052  -4.680
  133   1HB   ASP  22          2HB       ASP  22 -14.540   6.657  -6.945
  134   2HB   ASP  22          1HB       ASP  22 -15.108   5.040  -7.363
  135    H    SER  23           H        SER  23 -14.081   2.775  -4.792
  136    HA   SER  23           HA       SER  23 -16.863   2.275  -3.888
  137   1HB   SER  23          2HB       SER  23 -14.615   0.803  -5.017
  138   2HB   SER  23          1HB       SER  23 -15.270  -0.022  -3.607
  139    HG   SER  23           HG       SER  23 -16.233  -0.197  -5.941
  140    H    LEU  24           H        LEU  24 -13.856   3.158  -2.619
  141    HA   LEU  24           HA       LEU  24 -14.370   1.973   0.070
  142   1HB   LEU  24          2HB       LEU  24 -12.002   3.681  -0.528
  143   2HB   LEU  24          1HB       LEU  24 -12.086   2.172   0.374
  144    HG   LEU  24           HG       LEU  24 -12.228   2.453  -2.638
  145   1HD1  LEU  24          1HD1      LEU  24 -10.004   2.631  -1.061
  146   2HD1  LEU  24          2HD1      LEU  24  -9.992   1.981  -2.700
  147   3HD1  LEU  24          3HD1      LEU  24 -10.086   0.889  -1.320
  148   1HD2  LEU  24          1HD2      LEU  24 -11.998  -0.053  -0.963
  149   2HD2  LEU  24          2HD2      LEU  24 -12.271   0.054  -2.702
  150   3HD2  LEU  24          3HD2      LEU  24 -13.537   0.550  -1.577
  151    H    SER  25           H        SER  25 -14.942   4.754  -1.723
  152    HA   SER  25           HA       SER  25 -16.057   6.751  -0.998
  153   1HB   SER  25          2HB       SER  25 -14.993   6.284   1.776
  154   2HB   SER  25          1HB       SER  25 -16.479   7.094   1.284
  155    HG   SER  25           HG       SER  25 -16.954   5.037   2.072
  156    HA   PRO  26           HA       PRO  26 -11.848   8.387  -1.451
  157   1HB   PRO  26          2HB       PRO  26 -12.450   9.948  -3.604
  158   2HB   PRO  26          1HB       PRO  26 -12.046   8.226  -3.745
  159   1HG   PRO  26          2HG       PRO  26 -14.688   9.564  -3.855
  160   2HG   PRO  26          1HG       PRO  26 -14.104   8.143  -4.731
  161   1HD   PRO  26          2HD       PRO  26 -15.764   8.062  -2.527
  162   2HD   PRO  26          1HD       PRO  26 -14.748   6.716  -3.078
  163    H    VAL  27           H        VAL  27 -11.082  10.489  -0.962
  164    HA   VAL  27           HA       VAL  27 -13.182  12.408  -0.017
  165    HB   VAL  27           HB       VAL  27 -10.353  11.936   0.986
  166   1HG1  VAL  27          1HG1      VAL  27 -11.559  14.217   1.298
  167   2HG1  VAL  27          2HG1      VAL  27 -10.868  13.445   2.726
  168   3HG1  VAL  27          3HG1      VAL  27 -12.602  13.342   2.420
  169   1HG2  VAL  27          1HG2      VAL  27 -11.929  10.004   1.326
  170   2HG2  VAL  27          2HG2      VAL  27 -12.996  11.091   2.216
  171   3HG2  VAL  27          3HG2      VAL  27 -11.382  10.738   2.835
  172    H    ASN  28           H        ASN  28 -13.263  13.967  -1.609
  173    HA   ASN  28           HA       ASN  28 -12.521  15.663  -3.069
  174   1HB   ASN  28          2HB       ASN  28 -11.506  16.508  -1.027
  175   2HB   ASN  28          1HB       ASN  28 -10.157  15.385  -1.186
  176   1HD2  ASN  28          1HD2      ASN  28  -8.377  16.068  -2.440
  177   2HD2  ASN  28          2HD2      ASN  28  -8.362  17.486  -3.374
  178    H    GLY  29           H        GLY  29 -11.672  12.639  -3.321
  179   1HA   GLY  29          2HA       GLY  29 -10.882  11.709  -5.424
  180   2HA   GLY  29          1HA       GLY  29  -9.856  13.130  -5.626
  181    H    PHE  30           H        PHE  30 -10.131  11.257  -2.633
  182    HA   PHE  30           HA       PHE  30  -7.444  10.077  -3.143
  183   1HB   PHE  30          2HB       PHE  30  -8.235  11.987  -0.940
  184   2HB   PHE  30          1HB       PHE  30  -6.785  10.980  -0.848
  185    HD1  PHE  30           HD1      PHE  30  -8.338  13.891  -2.363
  186    HD2  PHE  30           HD2      PHE  30  -5.015  11.187  -2.581
  187    HE1  PHE  30           HE1      PHE  30  -7.137  15.497  -3.806
  188    HE2  PHE  30           HE2      PHE  30  -3.798  12.800  -4.028
  189    HZ   PHE  30           HZ       PHE  30  -4.860  14.959  -4.641
  190    H    LEU  31           H        LEU  31  -7.033   8.218  -1.989
  191    HA   LEU  31           HA       LEU  31  -9.242   7.195  -0.224
  192   1HB   LEU  31          2HB       LEU  31  -7.462   5.939  -2.299
  193   2HB   LEU  31          1HB       LEU  31  -8.069   4.946  -0.975
  194    HG   LEU  31           HG       LEU  31  -9.660   6.407  -3.080
  195   1HD1  LEU  31          1HD1      LEU  31 -10.615   3.901  -2.897
  196   2HD1  LEU  31          2HD1      LEU  31  -8.988   3.620  -2.273
  197   3HD1  LEU  31          3HD1      LEU  31  -9.211   4.299  -3.889
  198   1HD2  LEU  31          1HD2      LEU  31 -10.872   6.863  -1.062
  199   2HD2  LEU  31          2HD2      LEU  31 -10.526   5.263  -0.409
  200   3HD2  LEU  31          3HD2      LEU  31 -11.646   5.441  -1.760
  201    H    SER  32           H        SER  32  -8.555   6.458   1.807
  202    HA   SER  32           HA       SER  32  -5.792   7.114   2.558
  203   1HB   SER  32          2HB       SER  32  -6.652   6.550   4.819
  204   2HB   SER  32          1HB       SER  32  -7.723   7.671   3.985
  205    HG   SER  32           HG       SER  32  -8.356   5.361   5.005
  206    H    GLY  33           H        GLY  33  -4.180   5.655   3.005
  207   1HA   GLY  33          2HA       GLY  33  -4.036   3.149   1.825
  208   2HA   GLY  33          1HA       GLY  33  -3.165   3.526   3.311
  209    H    ASP  34           H        ASP  34  -5.705   4.044   4.734
  210    HA   ASP  34           HA       ASP  34  -6.164   1.437   5.839
  211   1HB   ASP  34          2HB       ASP  34  -6.468   3.827   6.789
  212   2HB   ASP  34          1HB       ASP  34  -8.046   3.785   6.006
  213    H    LYS  35           H        LYS  35  -7.606   3.135   3.131
  214    HA   LYS  35           HA       LYS  35  -9.906   1.254   3.037
  215   1HB   LYS  35          2HB       LYS  35  -9.054   3.724   1.489
  216   2HB   LYS  35          1HB       LYS  35 -10.504   2.798   1.106
  217   1HG   LYS  35          2HG       LYS  35 -11.100   3.106   3.615
  218   2HG   LYS  35          1HG       LYS  35  -9.899   4.395   3.583
  219   1HD   LYS  35          2HD       LYS  35 -11.492   4.752   1.276
  220   2HD   LYS  35          1HD       LYS  35 -12.609   4.435   2.604
  221   1HE   LYS  35          2HE       LYS  35 -10.383   6.298   3.236
  222   2HE   LYS  35          1HE       LYS  35 -11.605   6.907   2.103
  223   1HZ   LYS  35          1HZ       LYS  35 -12.003   5.849   4.837
  224   2HZ   LYS  35          2HZ       LYS  35 -13.280   5.912   3.717
  225   3HZ   LYS  35          3HZ       LYS  35 -12.500   7.342   4.205
  226    H    VAL  36           H        VAL  36  -6.926   2.172   1.412
  227    HA   VAL  36           HA       VAL  36  -7.297   0.368  -0.854
  228    HB   VAL  36           HB       VAL  36  -4.899   1.792   0.327
  229   1HG1  VAL  36          1HG1      VAL  36  -5.068   0.973  -2.535
  230   2HG1  VAL  36          2HG1      VAL  36  -4.725  -0.281  -1.346
  231   3HG1  VAL  36          3HG1      VAL  36  -3.656   1.113  -1.488
  232   1HG2  VAL  36          1HG2      VAL  36  -6.424   2.564  -2.150
  233   2HG2  VAL  36          2HG2      VAL  36  -5.393   3.566  -1.133
  234   3HG2  VAL  36          3HG2      VAL  36  -6.989   3.080  -0.562
  235    H    LYS  37           H        LYS  37  -5.418   0.262   2.190
  236    HA   LYS  37           HA       LYS  37  -3.884  -1.990   1.879
  237   1HB   LYS  37          2HB       LYS  37  -4.305  -0.468   3.916
  238   2HB   LYS  37          1HB       LYS  37  -5.602  -1.585   4.330
  239   1HG   LYS  37          2HG       LYS  37  -3.716  -3.405   3.941
  240   2HG   LYS  37          1HG       LYS  37  -2.647  -2.047   4.292
  241   1HD   LYS  37          2HD       LYS  37  -4.980  -2.768   6.076
  242   2HD   LYS  37          1HD       LYS  37  -3.368  -3.448   6.306
  243   1HE   LYS  37          2HE       LYS  37  -2.479  -1.067   6.387
  244   2HE   LYS  37          1HE       LYS  37  -4.167  -0.524   6.448
  245   1HZ   LYS  37          1HZ       LYS  37  -4.508  -2.046   8.334
  246   2HZ   LYS  37          2HZ       LYS  37  -3.363  -0.841   8.682
  247   3HZ   LYS  37          3HZ       LYS  37  -2.853  -2.421   8.323
  248    HA   PRO  38           HA       PRO  38  -7.564  -4.931   2.814
  249   1HB   PRO  38          2HB       PRO  38 -10.088  -3.919   2.462
  250   2HB   PRO  38          1HB       PRO  38  -9.250  -3.899   4.028
  251   1HG   PRO  38          2HG       PRO  38  -9.572  -1.719   2.023
  252   2HG   PRO  38          1HG       PRO  38  -9.661  -1.647   3.791
  253   1HD   PRO  38          2HD       PRO  38  -7.480  -0.851   2.406
  254   2HD   PRO  38          1HD       PRO  38  -7.383  -1.548   4.037
  255    H    VAL  39           H        VAL  39  -8.018  -2.387   0.435
  256    HA   VAL  39           HA       VAL  39  -9.317  -3.890  -1.626
  257    HB   VAL  39           HB       VAL  39  -7.684  -1.387  -1.339
  258   1HG1  VAL  39          1HG1      VAL  39  -8.761  -2.165  -4.039
  259   2HG1  VAL  39          2HG1      VAL  39  -7.120  -2.610  -3.576
  260   3HG1  VAL  39          3HG1      VAL  39  -7.586  -0.917  -3.631
  261   1HG2  VAL  39          1HG2      VAL  39 -10.503  -2.155  -2.023
  262   2HG2  VAL  39          2HG2      VAL  39  -9.888  -0.575  -2.509
  263   3HG2  VAL  39          3HG2      VAL  39  -9.921  -1.023  -0.804
  264    H    LEU  40           H        LEU  40  -5.913  -3.431  -0.747
  265    HA   LEU  40           HA       LEU  40  -4.947  -4.934  -3.093
  266   1HB   LEU  40          2HB       LEU  40  -3.462  -3.942  -0.645
  267   2HB   LEU  40          1HB       LEU  40  -2.796  -4.270  -2.243
  268    HG   LEU  40           HG       LEU  40  -4.899  -2.174  -1.699
  269   1HD1  LEU  40          1HD1      LEU  40  -3.118  -1.128  -0.705
  270   2HD1  LEU  40          2HD1      LEU  40  -2.691  -0.775  -2.380
  271   3HD1  LEU  40          3HD1      LEU  40  -1.931  -2.129  -1.543
  272   1HD2  LEU  40          1HD2      LEU  40  -4.742  -1.635  -3.945
  273   2HD2  LEU  40          2HD2      LEU  40  -4.449  -3.374  -4.026
  274   3HD2  LEU  40          3HD2      LEU  40  -3.093  -2.246  -4.082
  275    H    LEU  41           H        LEU  41  -5.730  -5.517   0.259
  276    HA   LEU  41           HA       LEU  41  -4.163  -7.943   0.567
  277   1HB   LEU  41          2HB       LEU  41  -6.509  -6.663   1.982
  278   2HB   LEU  41          1HB       LEU  41  -5.804  -8.185   2.523
  279    HG   LEU  41           HG       LEU  41  -4.072  -5.764   2.067
  280   1HD1  LEU  41          1HD1      LEU  41  -5.056  -4.716   3.806
  281   2HD1  LEU  41          2HD1      LEU  41  -4.559  -6.060   4.836
  282   3HD1  LEU  41          3HD1      LEU  41  -6.144  -6.081   4.061
  283   1HD2  LEU  41          1HD2      LEU  41  -3.727  -8.482   2.914
  284   2HD2  LEU  41          2HD2      LEU  41  -3.334  -7.421   4.269
  285   3HD2  LEU  41          3HD2      LEU  41  -2.495  -7.233   2.729
  286    H    ASN  42           H        ASN  42  -7.065  -7.115  -1.055
  287    HA   ASN  42           HA       ASN  42  -8.268  -9.781  -0.837
  288   1HB   ASN  42          2HB       ASN  42  -9.097  -7.169  -1.388
  289   2HB   ASN  42          1HB       ASN  42  -9.273  -8.011  -2.928
  290   1HD2  ASN  42          1HD2      ASN  42 -11.503  -7.122  -1.223
  291   2HD2  ASN  42          2HD2      ASN  42 -12.348  -8.519  -0.757
  292    H    SER  43           H        SER  43  -5.737  -8.494  -2.606
  293    HA   SER  43           HA       SER  43  -6.277  -9.859  -5.158
  294   1HB   SER  43          2HB       SER  43  -4.605  -8.485  -5.884
  295   2HB   SER  43          1HB       SER  43  -4.862  -7.662  -4.347
  296    HG   SER  43           HG       SER  43  -2.769  -8.143  -4.253
  297    H    LYS  44           H        LYS  44  -5.711 -11.225  -2.335
  298    HA   LYS  44           HA       LYS  44  -4.736 -13.296  -1.713
  299   1HB   LYS  44          2HB       LYS  44  -5.326 -13.356  -4.444
  300   2HB   LYS  44          1HB       LYS  44  -3.649 -13.896  -4.360
  301   1HG   LYS  44          2HG       LYS  44  -4.269 -15.580  -2.670
  302   2HG   LYS  44          1HG       LYS  44  -5.946 -15.040  -2.744
  303   1HD   LYS  44          2HD       LYS  44  -5.804 -15.530  -5.271
  304   2HD   LYS  44          1HD       LYS  44  -4.333 -16.426  -4.886
  305   1HE   LYS  44          2HE       LYS  44  -5.534 -18.179  -4.096
  306   2HE   LYS  44          1HE       LYS  44  -6.503 -17.112  -3.059
  307   1HZ   LYS  44          1HZ       LYS  44  -6.944 -17.858  -5.873
  308   2HZ   LYS  44          2HZ       LYS  44  -7.515 -16.363  -5.303
  309   3HZ   LYS  44          3HZ       LYS  44  -8.056 -17.809  -4.595
  310    H    LEU  45           H        LEU  45  -3.151 -10.615  -2.390
  311    HA   LEU  45           HA       LEU  45  -0.394 -11.744  -2.566
  312   1HB   LEU  45          2HB       LEU  45  -1.751  -9.097  -2.981
  313   2HB   LEU  45          1HB       LEU  45  -0.014  -9.135  -2.681
  314    HG   LEU  45           HG       LEU  45  -1.490 -10.591  -4.889
  315   1HD1  LEU  45          1HD1      LEU  45   0.731  -8.780  -5.523
  316   2HD1  LEU  45          2HD1      LEU  45  -0.631  -7.968  -4.754
  317   3HD1  LEU  45          3HD1      LEU  45  -0.877  -8.878  -6.242
  318   1HD2  LEU  45          1HD2      LEU  45   1.025 -11.147  -3.583
  319   2HD2  LEU  45          2HD2      LEU  45   1.324 -10.649  -5.248
  320   3HD2  LEU  45          3HD2      LEU  45   0.261 -12.015  -4.912
  321    HA   PRO  46           HA       PRO  46   0.304 -10.948   1.700
  322   1HB   PRO  46          2HB       PRO  46   3.031 -10.765   1.659
  323   2HB   PRO  46          1HB       PRO  46   2.166 -12.300   1.466
  324   1HG   PRO  46          2HG       PRO  46   3.503 -10.621  -0.557
  325   2HG   PRO  46          1HG       PRO  46   3.301 -12.375  -0.494
  326   1HD   PRO  46          2HD       PRO  46   1.804 -10.635  -2.056
  327   2HD   PRO  46          1HD       PRO  46   1.357 -12.301  -1.652
  328    H    VAL  47           H        VAL  47   1.815  -9.298   3.030
  329    HA   VAL  47           HA       VAL  47   1.047  -6.614   2.215
  330    HB   VAL  47           HB       VAL  47   2.427  -7.989   4.515
  331   1HG1  VAL  47          1HG1      VAL  47   3.451  -5.656   4.013
  332   2HG1  VAL  47          2HG1      VAL  47   2.880  -5.977   5.646
  333   3HG1  VAL  47          3HG1      VAL  47   1.891  -5.026   4.543
  334   1HG2  VAL  47          1HG2      VAL  47  -0.233  -7.156   3.832
  335   2HG2  VAL  47          2HG2      VAL  47   0.284  -6.293   5.281
  336   3HG2  VAL  47          3HG2      VAL  47   0.308  -8.057   5.250
  337    H    ASP  48           H        ASP  48   3.602  -8.624   1.382
  338    HA   ASP  48           HA       ASP  48   5.741  -6.623   1.348
  339   1HB   ASP  48          2HB       ASP  48   6.303  -8.936   1.701
  340   2HB   ASP  48          1HB       ASP  48   5.370  -9.440   0.293
  341    H    ILE  49           H        ILE  49   3.423  -8.057  -0.920
  342    HA   ILE  49           HA       ILE  49   4.556  -6.658  -3.236
  343    HB   ILE  49           HB       ILE  49   1.789  -7.849  -3.035
  344   1HG1  ILE  49          2HG1      ILE  49   3.259  -9.495  -1.985
  345   2HG1  ILE  49          1HG1      ILE  49   2.810 -10.053  -3.594
  346   1HG2  ILE  49          1HG2      ILE  49   3.626  -6.975  -5.115
  347   2HG2  ILE  49          2HG2      ILE  49   1.906  -7.350  -5.230
  348   3HG2  ILE  49          3HG2      ILE  49   3.103  -8.638  -5.373
  349   1HD1  ILE  49          1HD1      ILE  49   5.403  -8.728  -2.788
  350   2HD1  ILE  49          2HD1      ILE  49   4.942  -9.069  -4.459
  351   3HD1  ILE  49          3HD1      ILE  49   5.175 -10.396  -3.318
  352    H    LEU  50           H        LEU  50   1.832  -6.336  -1.021
  353    HA   LEU  50           HA       LEU  50   0.677  -4.010  -2.323
  354   1HB   LEU  50          2HB       LEU  50   0.422  -4.964   0.541
  355   2HB   LEU  50          1HB       LEU  50  -0.751  -4.029  -0.384
  356    HG   LEU  50           HG       LEU  50   0.094  -6.882  -0.948
  357   1HD1  LEU  50          1HD1      LEU  50  -2.492  -5.669   0.064
  358   2HD1  LEU  50          2HD1      LEU  50  -1.410  -6.740   0.958
  359   3HD1  LEU  50          3HD1      LEU  50  -2.310  -7.351  -0.431
  360   1HD2  LEU  50          1HD2      LEU  50  -1.030  -4.854  -2.650
  361   2HD2  LEU  50          2HD2      LEU  50  -2.217  -6.134  -2.401
  362   3HD2  LEU  50          3HD2      LEU  50  -0.623  -6.523  -3.047
  363    H    GLY  51           H        GLY  51   3.175  -4.629   0.037
  364   1HA   GLY  51          2HA       GLY  51   3.304  -1.923   1.089
  365   2HA   GLY  51          1HA       GLY  51   4.558  -3.155   1.260
  366    H    ARG  52           H        ARG  52   4.458  -3.624  -1.668
  367    HA   ARG  52           HA       ARG  52   6.248  -1.386  -2.475
  368   1HB   ARG  52          2HB       ARG  52   6.615  -4.046  -2.473
  369   2HB   ARG  52          1HB       ARG  52   5.882  -3.873  -4.068
  370   1HG   ARG  52          2HG       ARG  52   7.565  -2.019  -4.508
  371   2HG   ARG  52          1HG       ARG  52   8.385  -2.532  -3.033
  372   1HD   ARG  52          2HD       ARG  52   7.720  -4.558  -5.162
  373   2HD   ARG  52          1HD       ARG  52   9.182  -3.559  -5.289
  374    HE   ARG  52           HE       ARG  52   8.976  -4.592  -2.627
  375   1HH1  ARG  52          1HH2      ARG  52   8.725  -6.350  -5.459
  376   2HH1  ARG  52          2HH2      ARG  52  10.146  -7.309  -5.205
  377   1HH2  ARG  52          2HH1      ARG  52  11.211  -5.475  -2.459
  378   2HH2  ARG  52          1HH1      ARG  52  11.554  -6.813  -3.503
  379    H    VAL  53           H        VAL  53   3.275  -3.105  -3.387
  380    HA   VAL  53           HA       VAL  53   3.015  -1.810  -5.977
  381    HB   VAL  53           HB       VAL  53   1.237  -3.336  -4.077
  382   1HG1  VAL  53          1HG1      VAL  53   0.413  -1.524  -6.245
  383   2HG1  VAL  53          2HG1      VAL  53  -0.554  -2.253  -4.963
  384   3HG1  VAL  53          3HG1      VAL  53  -0.204  -3.165  -6.430
  385   1HG2  VAL  53          1HG2      VAL  53   1.472  -5.071  -5.638
  386   2HG2  VAL  53          2HG2      VAL  53   3.047  -4.282  -5.739
  387   3HG2  VAL  53          3HG2      VAL  53   1.818  -3.962  -6.970
  388    H    TRP  54           H        TRP  54   1.987  -1.092  -2.673
  389    HA   TRP  54           HA       TRP  54   0.285   1.146  -3.332
  390   1HB   TRP  54          2HB       TRP  54   0.023   0.257  -1.156
  391   2HB   TRP  54          1HB       TRP  54   1.766   0.174  -0.886
  392    HD1  TRP  54           HD1      TRP  54   3.057   2.558  -0.623
  393    HE1  TRP  54           HE1      TRP  54   2.265   4.783   0.344
  394    HE3  TRP  54           HE3      TRP  54  -1.987   1.774  -0.686
  395    HZ2  TRP  54           HZ2      TRP  54  -0.203   6.075   1.061
  396    HZ3  TRP  54           HZ3      TRP  54  -3.539   3.524   0.160
  397    HH2  TRP  54           HH2      TRP  54  -2.652   5.662   1.027
  398    H    GLU  55           H        GLU  55   3.672   0.982  -2.124
  399    HA   GLU  55           HA       GLU  55   4.320   3.678  -2.113
  400   1HB   GLU  55          2HB       GLU  55   5.826   1.205  -2.913
  401   2HB   GLU  55          1HB       GLU  55   6.615   2.781  -2.872
  402   1HG   GLU  55          2HG       GLU  55   5.464   2.898  -0.478
  403   2HG   GLU  55          1HG       GLU  55   5.547   1.142  -0.621
  404    H    LEU  56           H        LEU  56   4.830   1.563  -4.953
  405    HA   LEU  56           HA       LEU  56   5.364   3.714  -6.767
  406   1HB   LEU  56          2HB       LEU  56   4.228   0.928  -7.220
  407   2HB   LEU  56          1HB       LEU  56   4.958   1.942  -8.467
  408    HG   LEU  56           HG       LEU  56   6.625   1.591  -6.056
  409   1HD1  LEU  56          1HD1      LEU  56   5.311  -0.684  -6.875
  410   2HD1  LEU  56          2HD1      LEU  56   6.875  -0.662  -6.059
  411   3HD1  LEU  56          3HD1      LEU  56   6.799  -0.758  -7.819
  412   1HD2  LEU  56          1HD2      LEU  56   8.377   1.647  -7.629
  413   2HD2  LEU  56          2HD2      LEU  56   7.133   2.611  -8.421
  414   3HD2  LEU  56          3HD2      LEU  56   7.379   0.934  -8.899
  415    H    SER  57           H        SER  57   2.467   2.553  -5.323
  416    HA   SER  57           HA       SER  57   0.654   3.742  -7.340
  417   1HB   SER  57          2HB       SER  57   0.090   1.647  -6.166
  418   2HB   SER  57          1HB       SER  57   0.218   2.472  -4.617
  419    HG   SER  57           HG       SER  57  -1.570   3.147  -6.720
  420    H    ASP  58           H        ASP  58   2.216   4.510  -4.324
  421    HA   ASP  58           HA       ASP  58   0.565   6.963  -3.937
  422   1HB   ASP  58          2HB       ASP  58   1.240   5.081  -2.185
  423   2HB   ASP  58          1HB       ASP  58   2.725   6.025  -2.087
  424    H    ILE  59           H        ILE  59   1.788   7.764  -5.971
  425    HA   ILE  59           HA       ILE  59   4.586   8.258  -5.982
  426    HB   ILE  59           HB       ILE  59   2.210   9.657  -7.240
  427   1HG1  ILE  59          2HG1      ILE  59   4.027   8.079  -8.903
  428   2HG1  ILE  59          1HG1      ILE  59   3.305   7.125  -7.604
  429   1HG2  ILE  59          1HG2      ILE  59   3.604  11.149  -8.203
  430   2HG2  ILE  59          2HG2      ILE  59   4.720   9.871  -8.681
  431   3HG2  ILE  59          3HG2      ILE  59   4.853  10.605  -7.083
  432   1HD1  ILE  59          1HD1      ILE  59   1.287   7.136  -8.599
  433   2HD1  ILE  59          2HD1      ILE  59   2.092   7.784 -10.028
  434   3HD1  ILE  59          3HD1      ILE  59   1.350   8.878  -8.862
  435    H    ASP  60           H        ASP  60   2.041   9.817  -4.191
  436    HA   ASP  60           HA       ASP  60   3.793  12.157  -3.607
  437   1HB   ASP  60          2HB       ASP  60   1.746  13.116  -2.680
  438   2HB   ASP  60          1HB       ASP  60   1.398  12.448  -4.274
  439    H    HIS  61           H        HIS  61   2.738   9.145  -2.297
  440    HA   HIS  61           HA       HIS  61   3.221   8.083  -0.252
  441   1HB   HIS  61          2HB       HIS  61   5.290  10.237  -0.562
  442   2HB   HIS  61          1HB       HIS  61   5.261   9.255   0.902
  443    HD1  HIS  61           HD1      HIS  61   6.302   6.974   0.756
  444    HD2  HIS  61           HD2      HIS  61   5.547   8.585  -3.013
  445    HE1  HIS  61           HE1      HIS  61   7.320   5.375  -0.922
  446    H    ASP  62           H        ASP  62   1.019   9.818  -0.121
  447    HA   ASP  62           HA       ASP  62   1.388  11.286   2.461
  448   1HB   ASP  62          2HB       ASP  62  -0.728  12.395   1.750
  449   2HB   ASP  62          1HB       ASP  62   0.520  12.539   0.510
  450    H    GLY  63           H        GLY  63   0.951   8.277   1.845
  451   1HA   GLY  63          2HA       GLY  63  -0.202   6.518   2.890
  452   2HA   GLY  63          1HA       GLY  63  -0.786   7.705   4.062
  453    H    MET  64           H        MET  64  -1.258   7.996   0.591
  454    HA   MET  64           HA       MET  64  -4.111   7.194   0.852
  455   1HB   MET  64          2HB       MET  64  -2.985   9.908   0.224
  456   2HB   MET  64          1HB       MET  64  -4.569   9.441  -0.374
  457   1HG   MET  64          2HG       MET  64  -4.033   8.967   2.506
  458   2HG   MET  64          1HG       MET  64  -4.222  10.642   1.993
  459   1HE   MET  64          1HE       MET  64  -5.902  11.581   2.562
  460   2HE   MET  64          2HE       MET  64  -6.813  10.559   3.670
  461   3HE   MET  64          3HE       MET  64  -7.614  11.253   2.264
  462    H    LEU  65           H        LEU  65  -5.164   7.051  -1.288
  463    HA   LEU  65           HA       LEU  65  -3.249   6.878  -3.589
  464   1HB   LEU  65          2HB       LEU  65  -5.162   4.868  -2.436
  465   2HB   LEU  65          1HB       LEU  65  -4.841   4.842  -4.168
  466    HG   LEU  65           HG       LEU  65  -2.798   4.602  -1.946
  467   1HD1  LEU  65          1HD1      LEU  65  -4.366   2.652  -2.914
  468   2HD1  LEU  65          2HD1      LEU  65  -2.683   2.362  -2.472
  469   3HD1  LEU  65          3HD1      LEU  65  -3.118   2.630  -4.159
  470   1HD2  LEU  65          1HD2      LEU  65  -1.685   5.846  -3.616
  471   2HD2  LEU  65          2HD2      LEU  65  -2.525   5.011  -4.923
  472   3HD2  LEU  65          3HD2      LEU  65  -1.272   4.177  -4.003
  473    H    ASP  66           H        ASP  66  -4.057   8.750  -4.627
  474    HA   ASP  66           HA       ASP  66  -6.879   9.374  -4.779
  475   1HB   ASP  66          2HB       ASP  66  -6.125  11.231  -6.052
  476   2HB   ASP  66          1HB       ASP  66  -4.795  10.889  -4.945
  477    H    ARG  67           H        ARG  67  -8.056   9.535  -6.880
  478    HA   ARG  67           HA       ARG  67  -8.607   7.198  -8.169
  479   1HB   ARG  67          2HB       ARG  67  -9.232   8.685 -10.131
  480   2HB   ARG  67          1HB       ARG  67  -9.856   9.205  -8.568
  481   1HG   ARG  67          2HG       ARG  67  -7.421  10.467  -8.625
  482   2HG   ARG  67          1HG       ARG  67  -7.879  10.506 -10.327
  483   1HD   ARG  67          2HD       ARG  67  -9.422  11.617  -7.966
  484   2HD   ARG  67          1HD       ARG  67  -8.844  12.484  -9.402
  485    HE   ARG  67           HE       ARG  67 -10.414  10.771 -10.648
  486   1HH1  ARG  67          1HH2      ARG  67 -11.498  13.390  -9.351
  487   2HH1  ARG  67          2HH2      ARG  67 -12.957  12.788  -8.640
  488   1HH2  ARG  67          2HH1      ARG  67 -12.048   9.456  -8.953
  489   2HH2  ARG  67          1HH1      ARG  67 -13.269  10.560  -8.415
  490    H    ASP  68           H        ASP  68  -6.001   9.418  -9.187
  491    HA   ASP  68           HA       ASP  68  -5.181   7.655 -11.375
  492   1HB   ASP  68          2HB       ASP  68  -4.240  10.215 -10.100
  493   2HB   ASP  68          1HB       ASP  68  -3.207   9.387 -11.267
  494    H    GLU  69           H        GLU  69  -4.139   8.288  -8.059
  495    HA   GLU  69           HA       GLU  69  -1.705   6.689  -8.274
  496   1HB   GLU  69          2HB       GLU  69  -3.293   8.125  -6.186
  497   2HB   GLU  69          1HB       GLU  69  -2.143   6.903  -5.638
  498   1HG   GLU  69          2HG       GLU  69  -0.368   8.011  -6.964
  499   2HG   GLU  69          1HG       GLU  69  -1.521   9.257  -7.438
  500    H    PHE  70           H        PHE  70  -4.920   6.248  -6.795
  501    HA   PHE  70           HA       PHE  70  -4.562   3.575  -5.897
  502   1HB   PHE  70          2HB       PHE  70  -6.423   5.217  -5.380
  503   2HB   PHE  70          1HB       PHE  70  -7.068   4.897  -6.990
  504    HD1  PHE  70           HD1      PHE  70  -6.867   3.744  -3.580
  505    HD2  PHE  70           HD2      PHE  70  -7.657   2.494  -7.613
  506    HE1  PHE  70           HE1      PHE  70  -8.008   1.715  -2.728
  507    HE2  PHE  70           HE2      PHE  70  -8.798   0.464  -6.760
  508    HZ   PHE  70           HZ       PHE  70  -8.973   0.078  -4.317
  509    H    ALA  71           H        ALA  71  -4.870   4.935  -9.070
  510    HA   ALA  71           HA       ALA  71  -5.923   2.563 -10.404
  511   1HB   ALA  71          1HB       ALA  71  -5.650   3.884 -12.322
  512   2HB   ALA  71          2HB       ALA  71  -4.182   4.645 -11.700
  513   3HB   ALA  71          3HB       ALA  71  -5.761   5.122 -11.070
  514    H    VAL  72           H        VAL  72  -2.716   4.063 -10.259
  515    HA   VAL  72           HA       VAL  72  -1.188   2.122 -11.587
  516    HB   VAL  72           HB       VAL  72  -0.555   3.799  -9.142
  517   1HG1  VAL  72          1HG1      VAL  72   1.766   3.746 -10.016
  518   2HG1  VAL  72          2HG1      VAL  72   1.245   2.641 -11.288
  519   3HG1  VAL  72          3HG1      VAL  72   1.184   2.134  -9.601
  520   1HG2  VAL  72          1HG2      VAL  72  -1.266   5.398 -10.652
  521   2HG2  VAL  72          2HG2      VAL  72  -0.882   4.398 -12.051
  522   3HG2  VAL  72          3HG2      VAL  72   0.408   5.239 -11.186
  523    H    ALA  73           H        ALA  73  -2.679   2.017  -8.433
  524    HA   ALA  73           HA       ALA  73  -1.004  -0.197  -7.459
  525   1HB   ALA  73          1HB       ALA  73  -1.679   0.903  -5.614
  526   2HB   ALA  73          2HB       ALA  73  -3.249   0.121  -5.833
  527   3HB   ALA  73          3HB       ALA  73  -2.960   1.731  -6.500
  528    H    MET  74           H        MET  74  -3.961   0.071  -9.308
  529    HA   MET  74           HA       MET  74  -4.975  -2.546  -8.427
  530   1HB   MET  74          2HB       MET  74  -5.801  -1.007 -10.890
  531   2HB   MET  74          1HB       MET  74  -6.785  -2.076  -9.896
  532   1HG   MET  74          2HG       MET  74  -5.933   0.750  -9.375
  533   2HG   MET  74          1HG       MET  74  -7.519   0.019  -9.186
  534   1HE   MET  74          1HE       MET  74  -7.753  -1.988  -6.552
  535   2HE   MET  74          2HE       MET  74  -6.133  -2.679  -6.587
  536   3HE   MET  74          3HE       MET  74  -7.019  -2.452  -8.092
  537    H    PHE  75           H        PHE  75  -3.334  -1.285 -11.335
  538    HA   PHE  75           HA       PHE  75  -3.329  -3.905 -12.620
  539   1HB   PHE  75          2HB       PHE  75  -2.409  -2.725 -14.406
  540   2HB   PHE  75          1HB       PHE  75  -3.211  -1.415 -13.541
  541    HD1  PHE  75           HD1      PHE  75  -0.076  -2.706 -14.742
  542    HD2  PHE  75           HD2      PHE  75  -1.848  -0.067 -11.860
  543    HE1  PHE  75           HE1      PHE  75   2.105  -1.565 -14.449
  544    HE2  PHE  75           HE2      PHE  75   0.325   1.072 -11.567
  545    HZ   PHE  75           HZ       PHE  75   2.308   0.326 -12.858
  546    H    LEU  76           H        LEU  76  -1.436  -2.269 -10.265
  547    HA   LEU  76           HA       LEU  76   1.033  -3.798 -10.673
  548   1HB   LEU  76          2HB       LEU  76  -0.053  -1.660  -8.931
  549   2HB   LEU  76          1HB       LEU  76   1.179  -2.681  -8.189
  550    HG   LEU  76           HG       LEU  76   1.438  -1.127 -10.779
  551   1HD1  LEU  76          1HD1      LEU  76   2.111  -0.622  -7.988
  552   2HD1  LEU  76          2HD1      LEU  76   2.128   0.488  -9.359
  553   3HD1  LEU  76          3HD1      LEU  76   3.531  -0.532  -9.031
  554   1HD2  LEU  76          1HD2      LEU  76   3.099  -3.291  -9.518
  555   2HD2  LEU  76          2HD2      LEU  76   3.898  -2.011 -10.430
  556   3HD2  LEU  76          3HD2      LEU  76   2.705  -3.042 -11.220
  557    H    VAL  77           H        VAL  77  -1.935  -4.068  -8.884
  558    HA   VAL  77           HA       VAL  77  -0.903  -6.197  -7.113
  559    HB   VAL  77           HB       VAL  77  -3.450  -4.618  -7.478
  560   1HG1  VAL  77          1HG1      VAL  77  -3.148  -7.300  -6.301
  561   2HG1  VAL  77          2HG1      VAL  77  -4.610  -6.443  -6.787
  562   3HG1  VAL  77          3HG1      VAL  77  -3.885  -6.124  -5.212
  563   1HG2  VAL  77          1HG2      VAL  77  -2.749  -4.570  -4.832
  564   2HG2  VAL  77          2HG2      VAL  77  -2.214  -3.379  -6.014
  565   3HG2  VAL  77          3HG2      VAL  77  -1.171  -4.736  -5.599
  566    H    TYR  78           H        TYR  78  -3.026  -5.815  -9.931
  567    HA   TYR  78           HA       TYR  78  -4.029  -8.528  -9.911
  568   1HB   TYR  78          2HB       TYR  78  -4.145  -6.091 -11.525
  569   2HB   TYR  78          1HB       TYR  78  -4.160  -7.550 -12.514
  570    HD1  TYR  78           HD1      TYR  78  -6.179  -5.316 -10.698
  571    HD2  TYR  78           HD2      TYR  78  -5.718  -9.500 -11.555
  572    HE1  TYR  78           HE1      TYR  78  -8.555  -5.697 -10.106
  573    HE2  TYR  78           HE2      TYR  78  -8.098  -9.883 -10.963
  574    HH   TYR  78           HH       TYR  78  -9.958  -8.974 -10.146
  575    H    CYS  79           H        CYS  79  -1.163  -6.984 -11.278
  576    HA   CYS  79           HA       CYS  79  -0.487  -9.225 -13.023
  577   1HB   CYS  79          2HB       CYS  79   0.584  -6.579 -12.215
  578   2HB   CYS  79          1HB       CYS  79   1.797  -7.760 -12.706
  579    HG   CYS  79           HG       CYS  79  -0.550  -6.821 -14.548
  580    H    ALA  80           H        ALA  80  -0.129  -8.492  -9.680
  581    HA   ALA  80           HA       ALA  80   2.183 -10.285  -9.313
  582   1HB   ALA  80          1HB       ALA  80   1.671  -9.650  -6.876
  583   2HB   ALA  80          2HB       ALA  80   0.423  -8.590  -7.534
  584   3HB   ALA  80          3HB       ALA  80   2.114  -8.324  -7.948
  585    H    LEU  81           H        LEU  81  -1.122 -10.583  -9.715
  586    HA   LEU  81           HA       LEU  81  -1.511 -12.857  -7.864
  587   1HB   LEU  81          2HB       LEU  81  -3.396 -11.913 -10.017
  588   2HB   LEU  81          1HB       LEU  81  -3.787 -12.594  -8.439
  589    HG   LEU  81           HG       LEU  81  -2.811  -9.831  -9.109
  590   1HD1  LEU  81          1HD1      LEU  81  -4.744  -9.193  -7.716
  591   2HD1  LEU  81          2HD1      LEU  81  -5.082 -10.896  -7.408
  592   3HD1  LEU  81          3HD1      LEU  81  -5.237 -10.248  -9.041
  593   1HD2  LEU  81          1HD2      LEU  81  -2.782  -9.632  -6.490
  594   2HD2  LEU  81          2HD2      LEU  81  -1.371 -10.296  -7.313
  595   3HD2  LEU  81          3HD2      LEU  81  -2.529 -11.376  -6.541
  596    H    GLU  82           H        GLU  82  -1.453 -12.183 -11.352
  597    HA   GLU  82           HA       GLU  82  -1.789 -14.939 -12.150
  598   1HB   GLU  82          2HB       GLU  82  -0.953 -12.342 -13.411
  599   2HB   GLU  82          1HB       GLU  82  -0.780 -13.842 -14.323
  600   1HG   GLU  82          2HG       GLU  82  -3.347 -13.950 -13.159
  601   2HG   GLU  82          1HG       GLU  82  -3.177 -12.313 -13.796
  602    H    LYS  83           H        LYS  83   1.037 -12.764 -12.145
  603    HA   LYS  83           HA       LYS  83   2.870 -14.696 -11.106
  604   1HB   LYS  83          2HB       LYS  83   2.050 -15.525 -13.489
  605   2HB   LYS  83          1HB       LYS  83   3.281 -14.397 -14.050
  606   1HG   LYS  83          2HG       LYS  83   4.483 -15.806 -11.936
  607   2HG   LYS  83          1HG       LYS  83   3.621 -17.024 -12.877
  608   1HD   LYS  83          2HD       LYS  83   5.853 -16.766 -13.806
  609   2HD   LYS  83          1HD       LYS  83   4.686 -16.100 -14.948
  610   1HE   LYS  83          2HE       LYS  83   5.409 -13.940 -14.635
  611   2HE   LYS  83          1HE       LYS  83   5.778 -14.206 -12.919
  612   1HZ   LYS  83          1HZ       LYS  83   7.317 -15.793 -14.799
  613   2HZ   LYS  83          2HZ       LYS  83   7.818 -15.002 -13.381
  614   3HZ   LYS  83          3HZ       LYS  83   7.646 -14.130 -14.829
  615    H    GLU  84           H        GLU  84   2.349 -11.871 -13.139
  616    HA   GLU  84           HA       GLU  84   5.032 -10.902 -13.244
  617   1HB   GLU  84          2HB       GLU  84   2.277  -9.690 -13.403
  618   2HB   GLU  84          1HB       GLU  84   3.718  -8.681 -13.535
  619   1HG   GLU  84          2HG       GLU  84   4.141 -10.955 -15.189
  620   2HG   GLU  84          1HG       GLU  84   2.521 -10.352 -15.544
  621    HA   PRO  85           HA       PRO  85   5.236 -10.028  -8.841
  622   1HB   PRO  85          2HB       PRO  85   7.919  -9.464  -8.853
  623   2HB   PRO  85          1HB       PRO  85   7.276 -11.118  -8.809
  624   1HG   PRO  85          2HG       PRO  85   8.328  -9.559 -11.121
  625   2HG   PRO  85          1HG       PRO  85   8.559 -11.268 -10.713
  626   1HD   PRO  85          2HD       PRO  85   6.803 -10.437 -12.602
  627   2HD   PRO  85          1HD       PRO  85   6.544 -11.897 -11.621
  628    H    VAL  86           H        VAL  86   6.262  -8.007  -7.676
  629    HA   VAL  86           HA       VAL  86   5.884  -5.615  -9.450
  630    HB   VAL  86           HB       VAL  86   5.193  -6.032  -6.525
  631   1HG1  VAL  86          1HG1      VAL  86   5.567  -3.666  -8.064
  632   2HG1  VAL  86          2HG1      VAL  86   4.937  -3.800  -6.422
  633   3HG1  VAL  86          3HG1      VAL  86   3.832  -3.849  -7.797
  634   1HG2  VAL  86          1HG2      VAL  86   3.812  -6.684  -8.996
  635   2HG2  VAL  86          2HG2      VAL  86   2.890  -5.515  -8.050
  636   3HG2  VAL  86          3HG2      VAL  86   3.354  -7.060  -7.334
  637    HA   PRO  87           HA       PRO  87   9.927  -4.715  -7.793
  638   1HB   PRO  87          2HB       PRO  87  10.488  -2.686  -9.540
  639   2HB   PRO  87          1HB       PRO  87  10.609  -4.397  -9.989
  640   1HG   PRO  87          2HG       PRO  87   8.604  -2.399 -10.755
  641   2HG   PRO  87          1HG       PRO  87   9.066  -3.903 -11.559
  642   1HD   PRO  87          2HD       PRO  87   6.783  -3.432  -9.931
  643   2HD   PRO  87          1HD       PRO  87   7.299  -4.971 -10.656
  644    H    MET  88           H        MET  88  10.940  -2.361  -7.255
  645    HA   MET  88           HA       MET  88   8.751  -0.831  -5.886
  646   1HB   MET  88          2HB       MET  88  10.935   0.011  -4.659
  647   2HB   MET  88          1HB       MET  88  10.148  -1.491  -4.180
  648   1HG   MET  88          2HG       MET  88  12.286  -1.522  -6.299
  649   2HG   MET  88          1HG       MET  88  12.744  -1.467  -4.598
  650   1HE   MET  88          1HE       MET  88  13.894  -3.234  -6.000
  651   2HE   MET  88          2HE       MET  88  13.135  -4.672  -6.674
  652   3HE   MET  88          3HE       MET  88  13.758  -4.706  -5.027
  653    H    SER  89           H        SER  89  10.308  -0.619  -8.639
  654    HA   SER  89           HA       SER  89  11.190   2.206  -8.317
  655   1HB   SER  89          2HB       SER  89  11.637   0.091 -10.417
  656   2HB   SER  89          1HB       SER  89  12.235   1.742 -10.554
  657    HG   SER  89           HG       SER  89  13.867   0.976  -9.458
  658    H    LEU  90           H        LEU  90   9.454   3.493  -8.593
  659    HA   LEU  90           HA       LEU  90   7.158   3.118 -10.192
  660   1HB   LEU  90          2HB       LEU  90   8.565   5.239  -8.807
  661   2HB   LEU  90          1HB       LEU  90   7.866   5.851 -10.305
  662    HG   LEU  90           HG       LEU  90   6.403   4.364  -8.114
  663   1HD1  LEU  90          1HD1      LEU  90   6.692   6.627  -7.450
  664   2HD1  LEU  90          2HD1      LEU  90   5.078   6.570  -8.159
  665   3HD1  LEU  90          3HD1      LEU  90   6.427   7.222  -9.088
  666   1HD2  LEU  90          1HD2      LEU  90   4.509   5.354  -9.839
  667   2HD2  LEU  90          2HD2      LEU  90   5.083   3.685  -9.841
  668   3HD2  LEU  90          3HD2      LEU  90   5.784   4.862 -10.953
  669    HA   PRO  91           HA       PRO  91   9.423   3.197 -14.098
  670   1HB   PRO  91          2HB       PRO  91   7.374   2.135 -15.582
  671   2HB   PRO  91          1HB       PRO  91   8.511   1.153 -14.641
  672   1HG   PRO  91          2HG       PRO  91   5.730   1.958 -13.996
  673   2HG   PRO  91          1HG       PRO  91   6.575   0.445 -13.650
  674   1HD   PRO  91          2HD       PRO  91   6.143   2.413 -11.795
  675   2HD   PRO  91          1HD       PRO  91   7.477   1.242 -11.710
  676    HA   PRO  92           HA       PRO  92   7.823   7.073 -15.440
  677   1HB   PRO  92          2HB       PRO  92   9.092   7.185 -17.854
  678   2HB   PRO  92          1HB       PRO  92   9.928   7.446 -16.310
  679   1HG   PRO  92          2HG       PRO  92   9.816   5.005 -18.015
  680   2HG   PRO  92          1HG       PRO  92  11.189   5.704 -17.142
  681   1HD   PRO  92          2HD       PRO  92   9.809   3.570 -16.220
  682   2HD   PRO  92          1HD       PRO  92  10.564   4.764 -15.140
  683    H    ALA  93           H        ALA  93   6.955   4.142 -16.782
  684    HA   ALA  93           HA       ALA  93   5.385   5.337 -19.021
  685   1HB   ALA  93          1HB       ALA  93   6.900   3.065 -18.775
  686   2HB   ALA  93          2HB       ALA  93   5.618   3.266 -19.970
  687   3HB   ALA  93          3HB       ALA  93   5.285   2.433 -18.450
  688    H    LEU  94           H        LEU  94   5.081   4.428 -15.780
  689    HA   LEU  94           HA       LEU  94   2.136   3.957 -16.007
  690   1HB   LEU  94          2HB       LEU  94   3.168   2.130 -14.973
  691   2HB   LEU  94          1HB       LEU  94   4.390   3.136 -14.211
  692    HG   LEU  94           HG       LEU  94   2.624   2.139 -12.672
  693   1HD1  LEU  94          1HD1      LEU  94   3.979   4.575 -12.653
  694   2HD1  LEU  94          2HD1      LEU  94   3.215   3.792 -11.267
  695   3HD1  LEU  94          3HD1      LEU  94   2.324   4.994 -12.201
  696   1HD2  LEU  94          1HD2      LEU  94   0.937   3.464 -14.572
  697   2HD2  LEU  94          2HD2      LEU  94   0.704   4.214 -12.995
  698   3HD2  LEU  94          3HD2      LEU  94   0.465   2.478 -13.188
  699    H    VAL  95           H        VAL  95   4.525   6.216 -14.967
  700    HA   VAL  95           HA       VAL  95   2.823   7.493 -12.923
  701    HB   VAL  95           HB       VAL  95   5.531   8.064 -14.152
  702   1HG1  VAL  95          1HG1      VAL  95   4.123   9.503 -11.879
  703   2HG1  VAL  95          2HG1      VAL  95   4.455  10.183 -13.472
  704   3HG1  VAL  95          3HG1      VAL  95   5.789   9.779 -12.391
  705   1HG2  VAL  95          1HG2      VAL  95   6.223   6.591 -12.594
  706   2HG2  VAL  95          2HG2      VAL  95   4.564   6.376 -12.036
  707   3HG2  VAL  95          3HG2      VAL  95   5.573   7.644 -11.337
  708    HA   PRO  96           HA       PRO  96   0.930  10.215 -15.853
  709   1HB   PRO  96          2HB       PRO  96  -0.221  11.918 -14.047
  710   2HB   PRO  96          1HB       PRO  96  -0.859  10.297 -14.384
  711   1HG   PRO  96          2HG       PRO  96   0.771  11.249 -12.091
  712   2HG   PRO  96          1HG       PRO  96  -0.533  10.052 -12.134
  713   1HD   PRO  96          2HD       PRO  96   2.145   9.435 -12.029
  714   2HD   PRO  96          1HD       PRO  96   0.886   8.348 -12.655
  715    HA   PRO  97           HA       PRO  97   3.773  13.567 -16.091
  716   1HB   PRO  97          2HB       PRO  97   2.363  15.282 -17.683
  717   2HB   PRO  97          1HB       PRO  97   3.100  13.787 -18.292
  718   1HG   PRO  97          2HG       PRO  97   0.268  14.367 -17.633
  719   2HG   PRO  97          1HG       PRO  97   0.947  13.337 -18.899
  720   1HD   PRO  97          2HD       PRO  97  -0.121  12.423 -16.522
  721   2HD   PRO  97          1HD       PRO  97   1.018  11.517 -17.541
  722    H    SER  98           H        SER  98   0.891  13.792 -14.381
  723    HA   SER  98           HA       SER  98   1.019  16.675 -13.828
  724   1HB   SER  98          2HB       SER  98  -0.923  16.176 -12.442
  725   2HB   SER  98          1HB       SER  98  -1.081  15.298 -13.960
  726    HG   SER  98           HG       SER  98  -1.376  13.707 -12.568
  727    H    LYS  99           H        LYS  99   2.063  13.672 -12.326
  728    HA   LYS  99           HA       LYS  99   2.877  15.062  -9.845
  729   1HB   LYS  99          2HB       LYS  99   2.535  12.301 -10.871
  730   2HB   LYS  99          1HB       LYS  99   3.832  12.510  -9.693
  731   1HG   LYS  99          2HG       LYS  99   2.258  12.432  -8.079
  732   2HG   LYS  99          1HG       LYS  99   1.687  13.995  -8.664
  733   1HD   LYS  99          2HD       LYS  99   0.045  13.003 -10.055
  734   2HD   LYS  99          1HD       LYS  99   0.797  11.411  -9.945
  735   1HE   LYS  99          2HE       LYS  99  -0.730  11.002  -8.300
  736   2HE   LYS  99          1HE       LYS  99   0.281  12.050  -7.285
  737   1HZ   LYS  99          1HZ       LYS  99  -2.099  12.769  -7.507
  738   2HZ   LYS  99          2HZ       LYS  99  -1.781  13.097  -9.142
  739   3HZ   LYS  99          3HZ       LYS  99  -0.952  13.946  -7.926
  740    H    ARG 100           H        ARG 100   4.114  15.038 -12.860
  741    HA   ARG 100           HA       ARG 100   6.933  15.090 -11.828
  742   1HB   ARG 100          2HB       ARG 100   7.629  13.895 -13.845
  743   2HB   ARG 100          1HB       ARG 100   6.377  12.962 -13.025
  744   1HG   ARG 100          2HG       ARG 100   5.039  13.083 -14.826
  745   2HG   ARG 100          1HG       ARG 100   5.161  14.843 -14.844
  746   1HD   ARG 100          2HD       ARG 100   6.115  14.282 -16.920
  747   2HD   ARG 100          1HD       ARG 100   7.555  14.354 -15.885
  748    HE   ARG 100           HE       ARG 100   6.531  11.739 -15.637
  749   1HH1  ARG 100          1HH2      ARG 100   8.638  13.646 -17.464
  750   2HH1  ARG 100          2HH2      ARG 100   8.932  12.449 -18.681
  751   1HH2  ARG 100          2HH1      ARG 100   6.537  10.250 -17.477
  752   2HH2  ARG 100          1HH1      ARG 100   7.742  10.528 -18.688
  753    H    SER 107           1H       SER 107   9.852   4.533   6.905
  754    HA   SER 107           HA       SER 107   8.996   3.474   4.296
  755   1HB   SER 107          2HB       SER 107  10.269   1.852   6.057
  756   2HB   SER 107          1HB       SER 107   8.638   1.790   6.721
  757    HG   SER 107           HG       SER 107   8.133   1.497   4.298
  758    H    THR 108           H        THR 108   7.193   4.810   4.189
  759    HA   THR 108           HA       THR 108   5.546   5.192   6.650
  760    HB   THR 108           HB       THR 108   6.404   7.113   5.236
  761    HG1  THR 108           HG1      THR 108   4.586   7.401   6.516
  762   1HG2  THR 108          1HG2      THR 108   5.397   7.510   3.076
  763   2HG2  THR 108          2HG2      THR 108   4.344   6.108   3.258
  764   3HG2  THR 108          3HG2      THR 108   6.083   5.885   3.064
  765    H    ASN 109           H        ASN 109   5.634   3.434   3.693
  766    HA   ASN 109           HA       ASN 109   3.000   3.170   2.841
  767   1HB   ASN 109          2HB       ASN 109   4.754   2.001   1.734
  768   2HB   ASN 109          1HB       ASN 109   5.258   1.195   3.219
  769   1HD2  ASN 109          1HD2      ASN 109   3.074   1.019   0.507
  770   2HD2  ASN 109          2HD2      ASN 109   2.290  -0.411   0.965
  771    HA   PRO 110           HA       PRO 110   0.822   1.568   6.313
  772   1HB   PRO 110          2HB       PRO 110  -1.278   0.375   5.020
  773   2HB   PRO 110          1HB       PRO 110  -1.119   2.133   5.202
  774   1HG   PRO 110          2HG       PRO 110  -0.545   0.417   2.848
  775   2HG   PRO 110          1HG       PRO 110  -1.229   2.048   2.921
  776   1HD   PRO 110          2HD       PRO 110   1.378   1.503   2.263
  777   2HD   PRO 110          1HD       PRO 110   0.825   3.044   2.953
  778    H    PHE 111           H        PHE 111   1.319  -0.693   3.576
  779    HA   PHE 111           HA       PHE 111   0.902  -3.101   5.102
  780   1HB   PHE 111          2HB       PHE 111   2.259  -2.367   2.508
  781   2HB   PHE 111          1HB       PHE 111   2.267  -4.035   3.085
  782    HD1  PHE 111           HD1      PHE 111   0.390  -1.509   1.372
  783    HD2  PHE 111           HD2      PHE 111  -0.003  -5.077   3.726
  784    HE1  PHE 111           HE1      PHE 111  -1.916  -1.819   0.520
  785    HE2  PHE 111           HE2      PHE 111  -2.310  -5.387   2.875
  786    HZ   PHE 111           HZ       PHE 111  -3.264  -3.759   1.270
  787    H    LEU 112           HN       LEU 112   3.830  -1.206   4.339
  788    HA   LEU 112           HA       LEU 112   5.633  -3.105   5.631
  789   1HB   LEU 112          2HB       LEU 112   5.847  -0.253   4.631
  790   2HB   LEU 112          1HB       LEU 112   7.219  -1.131   5.308
  791    HG   LEU 112           HG       LEU 112   5.688  -2.594   3.241
  792   1HD1  LEU 112          1HD1      LEU 112   7.273  -1.176   1.580
  793   2HD1  LEU 112          2HD1      LEU 112   6.903   0.080   2.762
  794   3HD1  LEU 112          3HD1      LEU 112   5.596  -0.733   1.901
  795   1HD2  LEU 112          1HD2      LEU 112   8.345  -2.466   4.403
  796   2HD2  LEU 112          2HD2      LEU 112   8.434  -2.413   2.642
  797   3HD2  LEU 112          3HD2      LEU 112   7.616  -3.754   3.443
  Start of MODEL   13
    1    HA   PRO   6           HA       PRO   6  -0.256   5.768 -23.753
    2   1HB   PRO   6          2HB       PRO   6  -2.221   4.005 -23.028
    3   2HB   PRO   6          1HB       PRO   6  -2.061   4.649 -24.674
    4   1HG   PRO   6          2HG       PRO   6  -1.207   2.012 -23.584
    5   2HG   PRO   6          1HG       PRO   6  -1.932   2.404 -25.151
    6   1HD   PRO   6          2HD       PRO   6   0.728   1.937 -24.812
    7   2HD   PRO   6          1HD       PRO   6   0.077   3.000 -26.079
    8    H    TRP   7           H        TRP   7  -1.300   5.830 -21.478
    9    HA   TRP   7           HA       TRP   7   0.539   5.532 -19.421
   10   1HB   TRP   7          2HB       TRP   7  -1.619   6.758 -19.369
   11   2HB   TRP   7          1HB       TRP   7  -2.485   5.223 -19.345
   12    HD1  TRP   7           HD1      TRP   7   0.582   4.967 -17.383
   13    HE1  TRP   7           HE1      TRP   7   0.085   5.130 -14.850
   14    HE3  TRP   7           HE3      TRP   7  -4.217   6.659 -17.558
   15    HZ2  TRP   7           HZ2      TRP   7  -2.079   5.893 -13.137
   16    HZ3  TRP   7           HZ3      TRP   7  -5.477   7.102 -15.470
   17    HH2  TRP   7           HH2      TRP   7  -4.415   6.720 -13.262
   18    H    ALA   8           H        ALA   8   1.439   3.722 -18.462
   19    HA   ALA   8           HA       ALA   8   1.143   1.074 -19.154
   20   1HB   ALA   8          1HB       ALA   8   2.384   2.517 -17.158
   21   2HB   ALA   8          2HB       ALA   8   2.455   0.761 -17.309
   22   3HB   ALA   8          3HB       ALA   8   1.266   1.507 -16.239
   23    H    VAL   9           H        VAL   9  -1.041   3.012 -17.219
   24    HA   VAL   9           HA       VAL   9  -2.734   0.690 -16.505
   25    HB   VAL   9           HB       VAL   9  -2.581   3.634 -15.888
   26   1HG1  VAL   9          1HG1      VAL   9  -4.959   1.831 -15.335
   27   2HG1  VAL   9          2HG1      VAL   9  -4.955   3.269 -16.357
   28   3HG1  VAL   9          3HG1      VAL   9  -4.715   3.423 -14.617
   29   1HG2  VAL   9          1HG2      VAL   9  -2.776   2.626 -13.542
   30   2HG2  VAL   9          2HG2      VAL   9  -1.311   2.218 -14.437
   31   3HG2  VAL   9          3HG2      VAL   9  -2.627   1.049 -14.316
   32    H    LYS  10           H        LYS  10  -4.377   0.060 -17.906
   33    HA   LYS  10           HA       LYS  10  -4.895   1.540 -20.348
   34   1HB   LYS  10          2HB       LYS  10  -5.653  -0.992 -19.015
   35   2HB   LYS  10          1HB       LYS  10  -6.849  -0.359 -20.146
   36   1HG   LYS  10          2HG       LYS  10  -5.374  -0.470 -21.968
   37   2HG   LYS  10          1HG       LYS  10  -3.946  -0.500 -20.930
   38   1HD   LYS  10          2HD       LYS  10  -5.566  -2.746 -20.239
   39   2HD   LYS  10          1HD       LYS  10  -5.401  -2.722 -21.994
   40   1HE   LYS  10          2HE       LYS  10  -2.923  -2.178 -20.424
   41   2HE   LYS  10          1HE       LYS  10  -3.528  -3.848 -20.425
   42   1HZ   LYS  10          1HZ       LYS  10  -3.796  -3.591 -22.888
   43   2HZ   LYS  10          2HZ       LYS  10  -2.185  -3.617 -22.349
   44   3HZ   LYS  10          3HZ       LYS  10  -2.917  -2.145 -22.778
   45    HA   PRO  11           HA       PRO  11  -8.310   4.024 -19.168
   46   1HB   PRO  11          2HB       PRO  11 -10.003   3.676 -21.299
   47   2HB   PRO  11          1HB       PRO  11  -8.535   4.672 -21.385
   48   1HG   PRO  11          2HG       PRO  11  -8.985   1.871 -22.306
   49   2HG   PRO  11          1HG       PRO  11  -8.095   3.186 -23.092
   50   1HD   PRO  11          2HD       PRO  11  -6.844   1.203 -21.755
   51   2HD   PRO  11          1HD       PRO  11  -6.209   2.865 -21.802
   52    H    GLU  12           H        GLU  12  -8.849   0.730 -20.200
   53    HA   GLU  12           HA       GLU  12 -11.494   0.504 -18.945
   54   1HB   GLU  12          2HB       GLU  12 -11.324  -0.906 -20.771
   55   2HB   GLU  12          1HB       GLU  12  -9.584  -1.101 -20.581
   56   1HG   GLU  12          2HG       GLU  12 -10.620  -3.221 -20.091
   57   2HG   GLU  12          1HG       GLU  12 -10.044  -2.543 -18.571
   58    H    ASP  13           H        ASP  13  -8.154   0.159 -18.098
   59    HA   ASP  13           HA       ASP  13  -8.645  -1.532 -15.738
   60   1HB   ASP  13          2HB       ASP  13  -6.271  -0.079 -16.940
   61   2HB   ASP  13          1HB       ASP  13  -6.160  -0.981 -15.428
   62    H    LYS  14           H        LYS  14  -7.809   1.831 -16.507
   63    HA   LYS  14           HA       LYS  14  -7.741   2.761 -13.774
   64   1HB   LYS  14          2HB       LYS  14  -6.903   3.738 -16.103
   65   2HB   LYS  14          1HB       LYS  14  -8.497   4.495 -16.102
   66   1HG   LYS  14          2HG       LYS  14  -7.461   4.854 -13.497
   67   2HG   LYS  14          1HG       LYS  14  -6.147   5.244 -14.607
   68   1HD   LYS  14          2HD       LYS  14  -7.467   6.880 -15.749
   69   2HD   LYS  14          1HD       LYS  14  -8.946   6.338 -14.954
   70   1HE   LYS  14          2HE       LYS  14  -8.264   7.235 -12.844
   71   2HE   LYS  14          1HE       LYS  14  -6.595   7.466 -13.402
   72   1HZ   LYS  14          1HZ       LYS  14  -7.574   9.556 -13.664
   73   2HZ   LYS  14          2HZ       LYS  14  -9.033   8.913 -14.248
   74   3HZ   LYS  14          3HZ       LYS  14  -7.640   8.886 -15.221
   75    H    ALA  15           H        ALA  15 -10.260   2.031 -16.030
   76    HA   ALA  15           HA       ALA  15 -12.336   3.708 -14.871
   77   1HB   ALA  15          1HB       ALA  15 -12.154   2.652 -17.216
   78   2HB   ALA  15          2HB       ALA  15 -13.730   2.546 -16.429
   79   3HB   ALA  15          3HB       ALA  15 -12.658   1.145 -16.451
   80    H    LYS  16           H        LYS  16 -11.391   0.279 -14.584
   81    HA   LYS  16           HA       LYS  16 -13.452  -0.325 -12.626
   82   1HB   LYS  16          2HB       LYS  16 -12.637  -2.471 -12.872
   83   2HB   LYS  16          1HB       LYS  16 -11.948  -1.763 -14.331
   84   1HG   LYS  16          2HG       LYS  16  -9.848  -1.330 -13.149
   85   2HG   LYS  16          1HG       LYS  16 -10.532  -1.998 -11.667
   86   1HD   LYS  16          2HD       LYS  16  -9.905  -3.449 -14.246
   87   2HD   LYS  16          1HD       LYS  16  -9.272  -3.780 -12.634
   88   1HE   LYS  16          2HE       LYS  16 -11.541  -4.453 -11.881
   89   2HE   LYS  16          1HE       LYS  16 -12.155  -4.162 -13.522
   90   1HZ   LYS  16          1HZ       LYS  16 -11.484  -6.494 -13.162
   91   2HZ   LYS  16          2HZ       LYS  16  -9.895  -5.974 -12.860
   92   3HZ   LYS  16          3HZ       LYS  16 -10.590  -5.742 -14.393
   93    H    TYR  17           H        TYR  17 -10.157   0.865 -12.576
   94    HA   TYR  17           HA       TYR  17  -9.607   0.432  -9.773
   95   1HB   TYR  17          2HB       TYR  17  -8.622   2.524 -11.750
   96   2HB   TYR  17          1HB       TYR  17  -7.857   2.147 -10.210
   97    HD1  TYR  17           HD1      TYR  17  -6.031   1.930 -12.282
   98    HD2  TYR  17           HD2      TYR  17  -9.091  -0.899 -11.247
   99    HE1  TYR  17           HE1      TYR  17  -4.719   0.125 -13.369
  100    HE2  TYR  17           HE2      TYR  17  -7.788  -2.705 -12.342
  101    HH   TYR  17           HH       TYR  17  -4.963  -2.029 -14.272
  102    H    ASP  18           H        ASP  18 -11.108   3.023 -11.662
  103    HA   ASP  18           HA       ASP  18 -11.381   4.906  -9.477
  104   1HB   ASP  18          2HB       ASP  18 -12.305   4.528 -12.282
  105   2HB   ASP  18          1HB       ASP  18 -13.270   5.619 -11.286
  106    H    ALA  19           H        ALA  19 -12.969   1.984 -10.193
  107    HA   ALA  19           HA       ALA  19 -15.523   2.782  -8.889
  108   1HB   ALA  19          1HB       ALA  19 -15.413   1.317 -10.939
  109   2HB   ALA  19          2HB       ALA  19 -16.216   0.535  -9.578
  110   3HB   ALA  19          3HB       ALA  19 -14.551   0.114  -9.980
  111    H    ILE  20           H        ILE  20 -12.585   0.969  -8.423
  112    HA   ILE  20           HA       ILE  20 -13.348  -0.165  -5.833
  113    HB   ILE  20           HB       ILE  20 -10.876   0.039  -7.575
  114   1HG1  ILE  20          2HG1      ILE  20 -12.223  -2.485  -6.653
  115   2HG1  ILE  20          1HG1      ILE  20 -12.931  -1.550  -7.971
  116   1HG2  ILE  20          1HG2      ILE  20 -10.660  -0.081  -4.889
  117   2HG2  ILE  20          2HG2      ILE  20  -9.535  -0.875  -5.987
  118   3HG2  ILE  20          3HG2      ILE  20 -10.848  -1.793  -5.254
  119   1HD1  ILE  20          1HD1      ILE  20 -10.317  -1.591  -8.738
  120   2HD1  ILE  20          2HD1      ILE  20 -11.512  -2.776  -9.269
  121   3HD1  ILE  20          3HD1      ILE  20 -10.442  -3.148  -7.918
  122    H    PHE  21           H        PHE  21 -11.727   2.634  -7.170
  123    HA   PHE  21           HA       PHE  21 -10.549   3.568  -4.676
  124   1HB   PHE  21          2HB       PHE  21  -9.429   4.428  -6.503
  125   2HB   PHE  21          1HB       PHE  21 -10.873   4.413  -7.510
  126    HD1  PHE  21           HD1      PHE  21  -8.681   6.436  -5.500
  127    HD2  PHE  21           HD2      PHE  21 -12.683   6.178  -7.039
  128    HE1  PHE  21           HE1      PHE  21  -8.988   8.868  -5.115
  129    HE2  PHE  21           HE2      PHE  21 -12.990   8.607  -6.652
  130    HZ   PHE  21           HZ       PHE  21 -11.145   9.951  -5.692
  131    H    ASP  22           H        ASP  22 -13.484   4.190  -6.544
  132    HA   ASP  22           HA       ASP  22 -14.483   6.179  -4.605
  133   1HB   ASP  22          2HB       ASP  22 -14.959   6.635  -6.884
  134   2HB   ASP  22          1HB       ASP  22 -15.415   4.960  -7.211
  135    H    SER  23           H        SER  23 -14.306   2.860  -4.653
  136    HA   SER  23           HA       SER  23 -17.011   2.319  -3.566
  137   1HB   SER  23          2HB       SER  23 -14.608   0.802  -4.491
  138   2HB   SER  23          1HB       SER  23 -15.653   0.009  -3.316
  139    HG   SER  23           HG       SER  23 -17.371   0.862  -4.895
  140    H    LEU  24           H        LEU  24 -14.116   3.525  -2.462
  141    HA   LEU  24           HA       LEU  24 -14.415   2.399   0.296
  142   1HB   LEU  24          2HB       LEU  24 -12.082   4.049  -0.582
  143   2HB   LEU  24          1HB       LEU  24 -12.107   2.642   0.475
  144    HG   LEU  24           HG       LEU  24 -12.615   2.467  -2.501
  145   1HD1  LEU  24          1HD1      LEU  24 -10.210   3.194  -1.277
  146   2HD1  LEU  24          2HD1      LEU  24 -10.401   2.562  -2.913
  147   3HD1  LEU  24          3HD1      LEU  24 -10.045   1.465  -1.579
  148   1HD2  LEU  24          1HD2      LEU  24 -11.398   0.206  -1.141
  149   2HD2  LEU  24          2HD2      LEU  24 -12.878   0.258  -2.098
  150   3HD2  LEU  24          3HD2      LEU  24 -12.923   0.657  -0.381
  151    H    SER  25           H        SER  25 -15.000   5.085  -1.659
  152    HA   SER  25           HA       SER  25 -16.024   7.154  -1.055
  153   1HB   SER  25          2HB       SER  25 -16.391   5.826   1.176
  154   2HB   SER  25          1HB       SER  25 -15.043   6.796   1.757
  155    HG   SER  25           HG       SER  25 -16.433   8.344   1.981
  156    HA   PRO  26           HA       PRO  26 -11.841   8.766  -1.613
  157   1HB   PRO  26          2HB       PRO  26 -12.618  10.641  -3.442
  158   2HB   PRO  26          1HB       PRO  26 -12.316   8.945  -3.869
  159   1HG   PRO  26          2HG       PRO  26 -14.897  10.347  -3.399
  160   2HG   PRO  26          1HG       PRO  26 -14.485   9.118  -4.605
  161   1HD   PRO  26          2HD       PRO  26 -15.868   8.575  -2.312
  162   2HD   PRO  26          1HD       PRO  26 -14.846   7.384  -3.147
  163    H    VAL  27           H        VAL  27 -10.919  10.726  -0.898
  164    HA   VAL  27           HA       VAL  27 -12.791  12.645   0.445
  165    HB   VAL  27           HB       VAL  27 -10.022  11.702   1.270
  166   1HG1  VAL  27          1HG1      VAL  27 -10.198  13.097   3.126
  167   2HG1  VAL  27          2HG1      VAL  27 -11.958  13.167   3.035
  168   3HG1  VAL  27          3HG1      VAL  27 -10.978  14.083   1.888
  169   1HG2  VAL  27          1HG2      VAL  27 -11.532   9.883   1.618
  170   2HG2  VAL  27          2HG2      VAL  27 -12.814  10.958   2.178
  171   3HG2  VAL  27          3HG2      VAL  27 -11.393  10.679   3.186
  172    H    ASN  28           H        ASN  28 -12.737  14.351  -1.021
  173    HA   ASN  28           HA       ASN  28 -11.841  16.144  -2.265
  174   1HB   ASN  28          2HB       ASN  28 -10.807  16.674  -0.126
  175   2HB   ASN  28          1HB       ASN  28  -9.539  15.480  -0.400
  176   1HD2  ASN  28          1HD2      ASN  28  -7.679  16.199  -1.488
  177   2HD2  ASN  28          2HD2      ASN  28  -7.557  17.688  -2.294
  178    H    GLY  29           H        GLY  29 -11.352  13.183  -2.998
  179   1HA   GLY  29          2HA       GLY  29 -10.518  12.371  -5.095
  180   2HA   GLY  29          1HA       GLY  29  -9.446  13.768  -5.182
  181    H    PHE  30           H        PHE  30  -9.784  11.590  -2.402
  182    HA   PHE  30           HA       PHE  30  -7.167  10.338  -3.014
  183   1HB   PHE  30          2HB       PHE  30  -7.764  12.125  -0.647
  184   2HB   PHE  30          1HB       PHE  30  -6.343  11.072  -0.736
  185    HD1  PHE  30           HD1      PHE  30  -7.844  14.182  -1.803
  186    HD2  PHE  30           HD2      PHE  30  -4.731  11.356  -2.656
  187    HE1  PHE  30           HE1      PHE  30  -6.693  15.878  -3.184
  188    HE2  PHE  30           HE2      PHE  30  -3.565  13.058  -4.042
  189    HZ   PHE  30           HZ       PHE  30  -4.547  15.324  -4.305
  190    H    LEU  31           H        LEU  31  -6.765   8.471  -1.814
  191    HA   LEU  31           HA       LEU  31  -9.031   7.486  -0.106
  192   1HB   LEU  31          2HB       LEU  31  -7.218   6.143  -2.126
  193   2HB   LEU  31          1HB       LEU  31  -8.050   5.202  -0.889
  194    HG   LEU  31           HG       LEU  31  -9.260   6.839  -3.114
  195   1HD1  LEU  31          1HD1      LEU  31  -8.948   4.002  -2.338
  196   2HD1  LEU  31          2HD1      LEU  31  -9.130   4.716  -3.945
  197   3HD1  LEU  31          3HD1      LEU  31 -10.551   4.441  -2.935
  198   1HD2  LEU  31          1HD2      LEU  31 -10.564   7.458  -1.188
  199   2HD2  LEU  31          2HD2      LEU  31 -10.536   5.809  -0.562
  200   3HD2  LEU  31          3HD2      LEU  31 -11.471   6.188  -2.011
  201    H    SER  32           H        SER  32  -8.295   6.336   1.809
  202    HA   SER  32           HA       SER  32  -5.523   7.085   2.568
  203   1HB   SER  32          2HB       SER  32  -6.336   6.675   4.838
  204   2HB   SER  32          1HB       SER  32  -7.511   7.670   3.982
  205    HG   SER  32           HG       SER  32  -8.378   5.815   5.147
  206    H    GLY  33           H        GLY  33  -3.979   5.540   3.141
  207   1HA   GLY  33          2HA       GLY  33  -3.826   3.078   1.911
  208   2HA   GLY  33          1HA       GLY  33  -3.084   3.363   3.487
  209    H    ASP  34           H        ASP  34  -5.761   3.904   4.698
  210    HA   ASP  34           HA       ASP  34  -6.384   1.251   5.601
  211   1HB   ASP  34          2HB       ASP  34  -7.613   3.989   5.800
  212   2HB   ASP  34          1HB       ASP  34  -8.450   2.588   6.468
  213    H    LYS  35           H        LYS  35  -7.694   3.290   3.018
  214    HA   LYS  35           HA       LYS  35  -9.977   1.489   2.536
  215   1HB   LYS  35          2HB       LYS  35  -8.810   3.913   1.120
  216   2HB   LYS  35          1HB       LYS  35 -10.286   3.098   0.607
  217   1HG   LYS  35          2HG       LYS  35 -11.277   3.530   2.845
  218   2HG   LYS  35          1HG       LYS  35  -9.818   4.411   3.300
  219   1HD   LYS  35          2HD       LYS  35 -10.193   6.039   1.521
  220   2HD   LYS  35          1HD       LYS  35 -11.583   5.124   0.937
  221   1HE   LYS  35          2HE       LYS  35 -12.940   6.136   2.439
  222   2HE   LYS  35          1HE       LYS  35 -11.859   5.695   3.776
  223   1HZ   LYS  35          1HZ       LYS  35 -10.435   7.530   3.250
  224   2HZ   LYS  35          2HZ       LYS  35 -12.017   8.128   3.410
  225   3HZ   LYS  35          3HZ       LYS  35 -11.340   7.912   1.867
  226    H    VAL  36           H        VAL  36  -6.804   2.273   1.223
  227    HA   VAL  36           HA       VAL  36  -7.043   0.476  -1.079
  228    HB   VAL  36           HB       VAL  36  -4.678   1.822   0.258
  229   1HG1  VAL  36          1HG1      VAL  36  -4.159  -0.056  -1.320
  230   2HG1  VAL  36          2HG1      VAL  36  -3.547   1.508  -1.860
  231   3HG1  VAL  36          3HG1      VAL  36  -5.006   0.833  -2.587
  232   1HG2  VAL  36          1HG2      VAL  36  -6.630   3.289  -0.521
  233   2HG2  VAL  36          2HG2      VAL  36  -6.226   2.771  -2.159
  234   3HG2  VAL  36          3HG2      VAL  36  -5.047   3.665  -1.199
  235    H    LYS  37           H        LYS  37  -5.303   0.443   2.036
  236    HA   LYS  37           HA       LYS  37  -3.791  -1.826   1.916
  237   1HB   LYS  37          2HB       LYS  37  -3.899  -0.489   3.898
  238   2HB   LYS  37          1HB       LYS  37  -5.618  -0.801   4.100
  239   1HG   LYS  37          2HG       LYS  37  -4.695  -3.347   4.135
  240   2HG   LYS  37          1HG       LYS  37  -3.289  -2.511   4.790
  241   1HD   LYS  37          2HD       LYS  37  -4.626  -1.512   6.548
  242   2HD   LYS  37          1HD       LYS  37  -6.108  -2.156   5.842
  243   1HE   LYS  37          2HE       LYS  37  -5.812  -4.151   6.883
  244   2HE   LYS  37          1HE       LYS  37  -4.143  -4.270   6.291
  245   1HZ   LYS  37          1HZ       LYS  37  -3.317  -3.201   8.099
  246   2HZ   LYS  37          2HZ       LYS  37  -4.687  -3.881   8.839
  247   3HZ   LYS  37          3HZ       LYS  37  -4.708  -2.259   8.335
  248    HA   PRO  38           HA       PRO  38  -7.541  -4.716   2.832
  249   1HB   PRO  38          2HB       PRO  38 -10.036  -3.654   2.404
  250   2HB   PRO  38          1HB       PRO  38  -9.229  -3.626   3.986
  251   1HG   PRO  38          2HG       PRO  38  -9.420  -1.478   1.924
  252   2HG   PRO  38          1HG       PRO  38  -9.595  -1.366   3.683
  253   1HD   PRO  38          2HD       PRO  38  -7.332  -0.637   2.437
  254   2HD   PRO  38          1HD       PRO  38  -7.320  -1.393   4.048
  255    H    VAL  39           H        VAL  39  -7.896  -2.233   0.368
  256    HA   VAL  39           HA       VAL  39  -9.172  -3.819  -1.659
  257    HB   VAL  39           HB       VAL  39  -7.628  -1.263  -1.418
  258   1HG1  VAL  39          1HG1      VAL  39  -7.766  -2.895  -3.864
  259   2HG1  VAL  39          2HG1      VAL  39  -6.725  -1.524  -3.482
  260   3HG1  VAL  39          3HG1      VAL  39  -8.364  -1.251  -4.072
  261   1HG2  VAL  39          1HG2      VAL  39 -10.298  -1.981  -1.354
  262   2HG2  VAL  39          2HG2      VAL  39 -10.099  -1.365  -2.995
  263   3HG2  VAL  39          3HG2      VAL  39  -9.685  -0.348  -1.614
  264    H    LEU  40           H        LEU  40  -5.837  -3.420  -0.616
  265    HA   LEU  40           HA       LEU  40  -4.747  -4.812  -2.976
  266   1HB   LEU  40          2HB       LEU  40  -3.510  -3.846  -0.379
  267   2HB   LEU  40          1HB       LEU  40  -2.621  -4.347  -1.814
  268    HG   LEU  40           HG       LEU  40  -4.589  -2.051  -1.696
  269   1HD1  LEU  40          1HD1      LEU  40  -1.600  -2.253  -1.495
  270   2HD1  LEU  40          2HD1      LEU  40  -2.710  -1.217  -0.598
  271   3HD1  LEU  40          3HD1      LEU  40  -2.314  -0.841  -2.276
  272   1HD2  LEU  40          1HD2      LEU  40  -4.677  -2.727  -3.911
  273   2HD2  LEU  40          2HD2      LEU  40  -3.052  -3.410  -3.872
  274   3HD2  LEU  40          3HD2      LEU  40  -3.269  -1.664  -3.975
  275    H    LEU  41           H        LEU  41  -5.654  -5.524   0.340
  276    HA   LEU  41           HA       LEU  41  -4.209  -8.034   0.538
  277   1HB   LEU  41          2HB       LEU  41  -6.552  -6.780   1.994
  278   2HB   LEU  41          1HB       LEU  41  -5.807  -8.299   2.492
  279    HG   LEU  41           HG       LEU  41  -4.097  -5.866   2.061
  280   1HD1  LEU  41          1HD1      LEU  41  -5.681  -4.974   3.581
  281   2HD1  LEU  41          2HD1      LEU  41  -4.385  -5.575   4.617
  282   3HD1  LEU  41          3HD1      LEU  41  -5.865  -6.514   4.421
  283   1HD2  LEU  41          1HD2      LEU  41  -3.726  -8.563   2.864
  284   2HD2  LEU  41          2HD2      LEU  41  -3.458  -7.569   4.297
  285   3HD2  LEU  41          3HD2      LEU  41  -2.515  -7.280   2.834
  286    H    ASN  42           H        ASN  42  -7.018  -7.009  -1.112
  287    HA   ASN  42           HA       ASN  42  -8.447  -9.546  -0.972
  288   1HB   ASN  42          2HB       ASN  42 -10.009  -8.414  -2.397
  289   2HB   ASN  42          1HB       ASN  42  -9.365  -7.174  -1.321
  290   1HD2  ASN  42          1HD2      ASN  42 -10.431  -6.419  -3.839
  291   2HD2  ASN  42          2HD2      ASN  42  -9.166  -5.899  -4.845
  292    H    SER  43           H        SER  43  -5.682  -8.558  -2.612
  293    HA   SER  43           HA       SER  43  -6.187 -10.041  -5.111
  294   1HB   SER  43          2HB       SER  43  -3.470  -9.148  -4.522
  295   2HB   SER  43          1HB       SER  43  -4.532  -8.673  -5.841
  296    HG   SER  43           HG       SER  43  -3.928  -7.361  -3.581
  297    H    LYS  44           H        LYS  44  -5.739 -11.198  -2.161
  298    HA   LYS  44           HA       LYS  44  -4.811 -13.204  -1.317
  299   1HB   LYS  44          2HB       LYS  44  -5.142 -13.444  -4.217
  300   2HB   LYS  44          1HB       LYS  44  -3.856 -14.485  -3.603
  301   1HG   LYS  44          2HG       LYS  44  -5.900 -14.759  -1.725
  302   2HG   LYS  44          1HG       LYS  44  -6.742 -14.732  -3.274
  303   1HD   LYS  44          2HD       LYS  44  -4.723 -16.372  -3.941
  304   2HD   LYS  44          1HD       LYS  44  -4.790 -16.717  -2.211
  305   1HE   LYS  44          2HE       LYS  44  -7.482 -16.645  -3.204
  306   2HE   LYS  44          1HE       LYS  44  -6.524 -17.719  -4.242
  307   1HZ   LYS  44          1HZ       LYS  44  -6.836 -17.818  -1.299
  308   2HZ   LYS  44          2HZ       LYS  44  -5.547 -18.593  -2.087
  309   3HZ   LYS  44          3HZ       LYS  44  -7.149 -19.045  -2.428
  310    H    LEU  45           H        LEU  45  -3.097 -10.710  -2.324
  311    HA   LEU  45           HA       LEU  45  -0.432 -12.012  -2.522
  312   1HB   LEU  45          2HB       LEU  45  -1.635  -9.302  -2.980
  313   2HB   LEU  45          1HB       LEU  45   0.104  -9.423  -2.706
  314    HG   LEU  45           HG       LEU  45  -1.417 -11.017  -4.787
  315   1HD1  LEU  45          1HD1      LEU  45   0.495  -8.730  -5.280
  316   2HD1  LEU  45          2HD1      LEU  45  -1.244  -8.474  -5.127
  317   3HD1  LEU  45          3HD1      LEU  45  -0.612  -9.490  -6.423
  318   1HD2  LEU  45          1HD2      LEU  45   0.556 -12.067  -5.249
  319   2HD2  LEU  45          2HD2      LEU  45   0.985 -11.598  -3.605
  320   3HD2  LEU  45          3HD2      LEU  45   1.507 -10.610  -4.968
  321    HA   PRO  46           HA       PRO  46   0.470 -11.263   1.699
  322   1HB   PRO  46          2HB       PRO  46   3.197 -11.094   1.569
  323   2HB   PRO  46          1HB       PRO  46   2.311 -12.620   1.395
  324   1HG   PRO  46          2HG       PRO  46   3.564 -10.918  -0.672
  325   2HG   PRO  46          1HG       PRO  46   3.399 -12.677  -0.601
  326   1HD   PRO  46          2HD       PRO  46   1.820 -11.007  -2.130
  327   2HD   PRO  46          1HD       PRO  46   1.374 -12.649  -1.630
  328    H    VAL  47           H        VAL  47   1.827  -9.648   3.079
  329    HA   VAL  47           HA       VAL  47   1.136  -6.942   2.357
  330    HB   VAL  47           HB       VAL  47   2.587  -8.409   4.560
  331   1HG1  VAL  47          1HG1      VAL  47   3.684  -6.133   4.120
  332   2HG1  VAL  47          2HG1      VAL  47   3.070  -6.410   5.745
  333   3HG1  VAL  47          3HG1      VAL  47   2.148  -5.422   4.615
  334   1HG2  VAL  47          1HG2      VAL  47  -0.071  -7.274   4.051
  335   2HG2  VAL  47          2HG2      VAL  47   0.588  -6.827   5.624
  336   3HG2  VAL  47          3HG2      VAL  47   0.418  -8.528   5.193
  337    H    ASP  48           H        ASP  48   3.659  -8.946   1.388
  338    HA   ASP  48           HA       ASP  48   5.786  -6.941   1.370
  339   1HB   ASP  48          2HB       ASP  48   6.065  -9.440   1.630
  340   2HB   ASP  48          1HB       ASP  48   5.558  -9.614  -0.050
  341    H    ILE  49           H        ILE  49   3.431  -8.311  -0.889
  342    HA   ILE  49           HA       ILE  49   4.511  -6.866  -3.194
  343    HB   ILE  49           HB       ILE  49   1.738  -8.025  -2.931
  344   1HG1  ILE  49          2HG1      ILE  49   3.157  -9.727  -1.970
  345   2HG1  ILE  49          1HG1      ILE  49   2.760 -10.222  -3.613
  346   1HG2  ILE  49          1HG2      ILE  49   2.891  -8.796  -5.324
  347   2HG2  ILE  49          2HG2      ILE  49   3.564  -7.187  -5.060
  348   3HG2  ILE  49          3HG2      ILE  49   1.816  -7.415  -5.103
  349   1HD1  ILE  49          1HD1      ILE  49   5.312  -8.821  -2.779
  350   2HD1  ILE  49          2HD1      ILE  49   4.912  -9.358  -4.412
  351   3HD1  ILE  49          3HD1      ILE  49   5.156 -10.543  -3.128
  352    H    LEU  50           H        LEU  50   1.853  -6.550  -0.900
  353    HA   LEU  50           HA       LEU  50   0.636  -4.228  -2.117
  354   1HB   LEU  50          2HB       LEU  50   0.601  -5.160   0.765
  355   2HB   LEU  50          1HB       LEU  50  -0.635  -4.212  -0.061
  356    HG   LEU  50           HG       LEU  50   0.129  -7.085  -0.636
  357   1HD1  LEU  50          1HD1      LEU  50  -2.272  -7.472  -0.052
  358   2HD1  LEU  50          2HD1      LEU  50  -2.389  -5.775   0.414
  359   3HD1  LEU  50          3HD1      LEU  50  -1.316  -6.861   1.298
  360   1HD2  LEU  50          1HD2      LEU  50  -0.980  -5.082  -2.373
  361   2HD2  LEU  50          2HD2      LEU  50  -2.206  -6.302  -2.040
  362   3HD2  LEU  50          3HD2      LEU  50  -0.652  -6.779  -2.722
  363    H    GLY  51           H        GLY  51   3.290  -4.759   0.116
  364   1HA   GLY  51          2HA       GLY  51   3.418  -2.031   1.097
  365   2HA   GLY  51          1HA       GLY  51   4.722  -3.221   1.196
  366    H    ARG  52           H        ARG  52   4.406  -3.709  -1.743
  367    HA   ARG  52           HA       ARG  52   6.110  -1.449  -2.653
  368   1HB   ARG  52          2HB       ARG  52   6.202  -4.245  -2.812
  369   2HB   ARG  52          1HB       ARG  52   5.808  -3.703  -4.444
  370   1HG   ARG  52          2HG       ARG  52   7.701  -2.012  -4.191
  371   2HG   ARG  52          1HG       ARG  52   8.184  -2.917  -2.757
  372   1HD   ARG  52          2HD       ARG  52   7.682  -4.701  -5.001
  373   2HD   ARG  52          1HD       ARG  52   8.937  -3.508  -5.382
  374    HE   ARG  52           HE       ARG  52   9.750  -4.211  -2.930
  375   1HH1  ARG  52          1HH2      ARG  52   8.059  -6.639  -2.851
  376   2HH1  ARG  52          2HH2      ARG  52   9.095  -7.850  -3.527
  377   1HH2  ARG  52          2HH1      ARG  52  11.290  -5.564  -4.935
  378   2HH2  ARG  52          1HH1      ARG  52  10.924  -7.241  -4.707
  379    H    VAL  53           H        VAL  53   3.082  -3.157  -3.397
  380    HA   VAL  53           HA       VAL  53   2.678  -1.907  -5.974
  381    HB   VAL  53           HB       VAL  53   0.978  -3.312  -3.915
  382   1HG1  VAL  53          1HG1      VAL  53  -0.205  -1.397  -5.390
  383   2HG1  VAL  53          2HG1      VAL  53  -0.994  -2.927  -5.039
  384   3HG1  VAL  53          3HG1      VAL  53  -0.189  -2.687  -6.589
  385   1HG2  VAL  53          1HG2      VAL  53   1.161  -5.124  -5.340
  386   2HG2  VAL  53          2HG2      VAL  53   2.673  -4.302  -5.727
  387   3HG2  VAL  53          3HG2      VAL  53   1.271  -4.113  -6.786
  388    H    TRP  54           H        TRP  54   1.731  -1.071  -2.653
  389    HA   TRP  54           HA       TRP  54   0.134   1.225  -3.353
  390   1HB   TRP  54          2HB       TRP  54  -0.183   0.376  -1.183
  391   2HB   TRP  54          1HB       TRP  54   1.547   0.168  -0.911
  392    HD1  TRP  54           HD1      TRP  54   2.999   2.469  -0.641
  393    HE1  TRP  54           HE1      TRP  54   2.338   4.721   0.386
  394    HE3  TRP  54           HE3      TRP  54  -2.075   1.973  -0.672
  395    HZ2  TRP  54           HZ2      TRP  54  -0.045   6.130   1.143
  396    HZ3  TRP  54           HZ3      TRP  54  -3.522   3.787   0.221
  397    HH2  TRP  54           HH2      TRP  54  -2.512   5.850   1.125
  398    H    GLU  55           H        GLU  55   3.532   0.918  -2.210
  399    HA   GLU  55           HA       GLU  55   4.256   3.613  -2.200
  400   1HB   GLU  55          2HB       GLU  55   5.766   1.137  -3.055
  401   2HB   GLU  55          1HB       GLU  55   6.539   2.693  -2.746
  402   1HG   GLU  55          2HG       GLU  55   5.569   2.681  -0.453
  403   2HG   GLU  55          1HG       GLU  55   4.920   1.073  -0.766
  404    H    LEU  56           H        LEU  56   4.654   1.414  -4.996
  405    HA   LEU  56           HA       LEU  56   5.357   3.450  -6.878
  406   1HB   LEU  56          2HB       LEU  56   3.943   0.779  -7.223
  407   2HB   LEU  56          1HB       LEU  56   4.732   1.681  -8.517
  408    HG   LEU  56           HG       LEU  56   6.427   1.257  -6.143
  409   1HD1  LEU  56          1HD1      LEU  56   6.457  -1.010  -6.053
  410   2HD1  LEU  56          2HD1      LEU  56   6.313  -1.170  -7.804
  411   3HD1  LEU  56          3HD1      LEU  56   4.872  -0.910  -6.821
  412   1HD2  LEU  56          1HD2      LEU  56   7.796   1.911  -7.842
  413   2HD2  LEU  56          2HD2      LEU  56   6.619   1.453  -9.073
  414   3HD2  LEU  56          3HD2      LEU  56   7.696   0.237  -8.388
  415    H    SER  57           H        SER  57   2.389   2.674  -5.332
  416    HA   SER  57           HA       SER  57   0.683   3.981  -7.385
  417   1HB   SER  57          2HB       SER  57   0.138   2.660  -4.708
  418   2HB   SER  57          1HB       SER  57  -1.106   3.272  -5.791
  419    HG   SER  57           HG       SER  57   0.171   1.851  -7.379
  420    H    ASP  58           H        ASP  58   2.070   4.509  -4.193
  421    HA   ASP  58           HA       ASP  58   0.620   7.053  -3.782
  422   1HB   ASP  58          2HB       ASP  58   1.168   5.306  -2.006
  423   2HB   ASP  58          1HB       ASP  58   2.855   5.794  -2.171
  424    H    ILE  59           H        ILE  59   1.459   8.495  -5.351
  425    HA   ILE  59           HA       ILE  59   4.396   8.724  -5.661
  426    HB   ILE  59           HB       ILE  59   1.942   9.829  -7.025
  427   1HG1  ILE  59          2HG1      ILE  59   4.052   8.532  -8.590
  428   2HG1  ILE  59          1HG1      ILE  59   3.418   7.490  -7.315
  429   1HG2  ILE  59          1HG2      ILE  59   4.842  10.499  -7.619
  430   2HG2  ILE  59          2HG2      ILE  59   3.655  11.616  -6.949
  431   3HG2  ILE  59          3HG2      ILE  59   3.452  10.993  -8.586
  432   1HD1  ILE  59          1HD1      ILE  59   1.096   8.498  -8.265
  433   2HD1  ILE  59          2HD1      ILE  59   1.828   7.022  -8.899
  434   3HD1  ILE  59          3HD1      ILE  59   2.065   8.556  -9.737
  435    H    ASP  60           H        ASP  60   1.760  10.388  -4.057
  436    HA   ASP  60           HA       ASP  60   3.360  12.859  -3.716
  437   1HB   ASP  60          2HB       ASP  60   1.301  13.658  -2.624
  438   2HB   ASP  60          1HB       ASP  60   0.922  12.906  -4.173
  439    H    HIS  61           H        HIS  61   2.796   9.881  -2.080
  440    HA   HIS  61           HA       HIS  61   3.680   9.075  -0.042
  441   1HB   HIS  61          2HB       HIS  61   5.061  11.757   0.168
  442   2HB   HIS  61          1HB       HIS  61   5.622  10.195   0.758
  443    HD1  HIS  61           HD1      HIS  61   7.152  12.100  -1.339
  444    HD2  HIS  61           HD2      HIS  61   4.975   8.664  -2.250
  445    HE1  HIS  61           HE1      HIS  61   8.028  11.266  -3.563
  446    H    ASP  62           H        ASP  62   1.116  10.340   0.006
  447    HA   ASP  62           HA       ASP  62   1.195  11.839   2.598
  448   1HB   ASP  62          2HB       ASP  62  -0.943  12.771   1.842
  449   2HB   ASP  62          1HB       ASP  62   0.267  12.975   0.575
  450    H    GLY  63           H        GLY  63   1.075   8.795   1.828
  451   1HA   GLY  63          2HA       GLY  63   0.100   6.895   2.802
  452   2HA   GLY  63          1HA       GLY  63  -0.548   7.970   4.041
  453    H    MET  64           H        MET  64  -1.193   8.278   0.570
  454    HA   MET  64           HA       MET  64  -3.922   7.167   0.926
  455   1HB   MET  64          2HB       MET  64  -3.287  10.035   0.183
  456   2HB   MET  64          1HB       MET  64  -4.884   9.308   0.052
  457   1HG   MET  64          2HG       MET  64  -5.011   8.963   2.415
  458   2HG   MET  64          1HG       MET  64  -3.324   9.432   2.634
  459   1HE   MET  64          1HE       MET  64  -6.872  10.830   1.290
  460   2HE   MET  64          2HE       MET  64  -7.006  11.896   2.685
  461   3HE   MET  64          3HE       MET  64  -6.704  10.176   2.924
  462    H    LEU  65           H        LEU  65  -5.067   7.004  -1.190
  463    HA   LEU  65           HA       LEU  65  -3.200   7.101  -3.538
  464   1HB   LEU  65          2HB       LEU  65  -5.017   4.981  -2.457
  465   2HB   LEU  65          1HB       LEU  65  -4.823   5.083  -4.203
  466    HG   LEU  65           HG       LEU  65  -2.652   4.656  -2.137
  467   1HD1  LEU  65          1HD1      LEU  65  -3.067   2.995  -4.588
  468   2HD1  LEU  65          2HD1      LEU  65  -4.206   2.797  -3.257
  469   3HD1  LEU  65          3HD1      LEU  65  -2.484   2.515  -2.995
  470   1HD2  LEU  65          1HD2      LEU  65  -1.534   6.060  -3.626
  471   2HD2  LEU  65          2HD2      LEU  65  -2.534   5.571  -4.993
  472   3HD2  LEU  65          3HD2      LEU  65  -1.275   4.493  -4.392
  473    H    ASP  66           H        ASP  66  -4.021   8.880  -4.662
  474    HA   ASP  66           HA       ASP  66  -6.815   9.616  -4.660
  475   1HB   ASP  66          2HB       ASP  66  -5.277  11.339  -5.067
  476   2HB   ASP  66          1HB       ASP  66  -4.337  10.366  -6.192
  477    H    ARG  67           H        ARG  67  -7.991   9.827  -6.830
  478    HA   ARG  67           HA       ARG  67  -8.683   7.315  -7.868
  479   1HB   ARG  67          2HB       ARG  67  -9.480   8.780  -9.852
  480   2HB   ARG  67          1HB       ARG  67 -10.124   9.138  -8.252
  481   1HG   ARG  67          2HG       ARG  67  -9.214  11.196  -8.272
  482   2HG   ARG  67          1HG       ARG  67  -7.630  10.548  -8.699
  483   1HD   ARG  67          2HD       ARG  67  -8.239  11.957 -10.537
  484   2HD   ARG  67          1HD       ARG  67  -8.585  10.309 -11.099
  485    HE   ARG  67           HE       ARG  67 -10.794  11.692  -9.707
  486   1HH1  ARG  67          1HH2      ARG  67 -10.196  13.076 -12.325
  487   2HH1  ARG  67          2HH2      ARG  67 -11.228  12.215 -13.418
  488   1HH2  ARG  67          2HH1      ARG  67 -11.745   9.555 -11.255
  489   2HH2  ARG  67          1HH1      ARG  67 -12.105  10.222 -12.812
  490    H    ASP  68           H        ASP  68  -6.127   9.506  -8.986
  491    HA   ASP  68           HA       ASP  68  -5.515   7.797 -11.312
  492   1HB   ASP  68          2HB       ASP  68  -3.942  10.121 -10.171
  493   2HB   ASP  68          1HB       ASP  68  -3.975   9.558 -11.843
  494    H    GLU  69           H        GLU  69  -4.215   8.497  -8.105
  495    HA   GLU  69           HA       GLU  69  -1.774   6.922  -8.475
  496   1HB   GLU  69          2HB       GLU  69  -3.166   7.792  -5.925
  497   2HB   GLU  69          1HB       GLU  69  -1.446   7.465  -6.142
  498   1HG   GLU  69          2HG       GLU  69  -1.366   9.349  -7.803
  499   2HG   GLU  69          1HG       GLU  69  -3.034   9.730  -7.377
  500    H    PHE  70           H        PHE  70  -4.965   6.460  -7.027
  501    HA   PHE  70           HA       PHE  70  -4.544   3.863  -5.898
  502   1HB   PHE  70          2HB       PHE  70  -6.426   5.514  -5.507
  503   2HB   PHE  70          1HB       PHE  70  -7.053   5.090  -7.099
  504    HD1  PHE  70           HD1      PHE  70  -6.748   4.085  -3.621
  505    HD2  PHE  70           HD2      PHE  70  -7.789   2.737  -7.563
  506    HE1  PHE  70           HE1      PHE  70  -7.920   2.130  -2.642
  507    HE2  PHE  70           HE2      PHE  70  -8.958   0.783  -6.586
  508    HZ   PHE  70           HZ       PHE  70  -9.024   0.481  -4.125
  509    H    ALA  71           H        ALA  71  -5.220   5.030  -9.138
  510    HA   ALA  71           HA       ALA  71  -6.071   2.573 -10.357
  511   1HB   ALA  71          1HB       ALA  71  -5.808   3.807 -12.343
  512   2HB   ALA  71          2HB       ALA  71  -4.392   4.663 -11.726
  513   3HB   ALA  71          3HB       ALA  71  -6.005   5.085 -11.142
  514    H    VAL  72           H        VAL  72  -2.897   4.141 -10.228
  515    HA   VAL  72           HA       VAL  72  -1.327   2.240 -11.554
  516    HB   VAL  72           HB       VAL  72  -0.868   4.089  -9.206
  517   1HG1  VAL  72          1HG1      VAL  72   1.001   2.187 -10.549
  518   2HG1  VAL  72          2HG1      VAL  72   0.962   2.725  -8.872
  519   3HG1  VAL  72          3HG1      VAL  72   1.616   3.783 -10.122
  520   1HG2  VAL  72          1HG2      VAL  72  -1.480   4.958 -11.521
  521   2HG2  VAL  72          2HG2      VAL  72   0.060   4.302 -12.084
  522   3HG2  VAL  72          3HG2      VAL  72   0.038   5.575 -10.858
  523    H    ALA  73           H        ALA  73  -2.679   2.138  -8.309
  524    HA   ALA  73           HA       ALA  73  -1.015  -0.110  -7.418
  525   1HB   ALA  73          1HB       ALA  73  -1.912   0.440  -5.379
  526   2HB   ALA  73          2HB       ALA  73  -3.532   0.669  -6.040
  527   3HB   ALA  73          3HB       ALA  73  -2.314   1.936  -6.225
  528    H    MET  74           H        MET  74  -3.952   0.165  -9.236
  529    HA   MET  74           HA       MET  74  -5.018  -2.411  -8.280
  530   1HB   MET  74          2HB       MET  74  -5.927  -0.873 -10.703
  531   2HB   MET  74          1HB       MET  74  -6.889  -1.870  -9.621
  532   1HG   MET  74          2HG       MET  74  -5.842   0.914  -9.208
  533   2HG   MET  74          1HG       MET  74  -7.471   0.301  -8.965
  534   1HE   MET  74          1HE       MET  74  -6.031  -2.549  -6.702
  535   2HE   MET  74          2HE       MET  74  -7.302  -2.093  -7.833
  536   3HE   MET  74          3HE       MET  74  -7.524  -1.809  -6.110
  537    H    PHE  75           H        PHE  75  -3.207  -1.235 -11.091
  538    HA   PHE  75           HA       PHE  75  -3.458  -3.849 -12.430
  539   1HB   PHE  75          2HB       PHE  75  -2.481  -2.750 -14.249
  540   2HB   PHE  75          1HB       PHE  75  -3.267  -1.410 -13.420
  541    HD1  PHE  75           HD1      PHE  75  -0.052  -3.063 -14.134
  542    HD2  PHE  75           HD2      PHE  75  -1.983   0.259 -12.224
  543    HE1  PHE  75           HE1      PHE  75   2.139  -1.930 -13.892
  544    HE2  PHE  75           HE2      PHE  75   0.199   1.388 -11.983
  545    HZ   PHE  75           HZ       PHE  75   2.268   0.301 -12.815
  546    H    LEU  76           H        LEU  76  -1.425  -2.305 -10.125
  547    HA   LEU  76           HA       LEU  76   0.923  -4.031 -10.579
  548   1HB   LEU  76          2HB       LEU  76   0.121  -1.688  -9.002
  549   2HB   LEU  76          1HB       LEU  76   1.142  -2.809  -8.101
  550    HG   LEU  76           HG       LEU  76   1.795  -1.729 -10.856
  551   1HD1  LEU  76          1HD1      LEU  76   3.694  -0.860  -8.986
  552   2HD1  LEU  76          2HD1      LEU  76   2.138  -0.603  -8.198
  553   3HD1  LEU  76          3HD1      LEU  76   2.463   0.131  -9.769
  554   1HD2  LEU  76          1HD2      LEU  76   3.897  -2.857  -9.114
  555   2HD2  LEU  76          2HD2      LEU  76   3.613  -3.102 -10.838
  556   3HD2  LEU  76          3HD2      LEU  76   2.693  -4.029  -9.652
  557    H    VAL  77           H        VAL  77  -2.097  -4.216  -8.981
  558    HA   VAL  77           HA       VAL  77  -1.203  -6.156  -6.938
  559    HB   VAL  77           HB       VAL  77  -3.813  -4.833  -7.736
  560   1HG1  VAL  77          1HG1      VAL  77  -4.611  -5.863  -5.513
  561   2HG1  VAL  77          2HG1      VAL  77  -3.250  -6.974  -5.678
  562   3HG1  VAL  77          3HG1      VAL  77  -4.518  -6.943  -6.903
  563   1HG2  VAL  77          1HG2      VAL  77  -3.511  -3.542  -5.783
  564   2HG2  VAL  77          2HG2      VAL  77  -1.900  -3.630  -6.494
  565   3HG2  VAL  77          3HG2      VAL  77  -2.315  -4.658  -5.124
  566    H    TYR  78           H        TYR  78  -3.407  -6.075  -9.755
  567    HA   TYR  78           HA       TYR  78  -3.971  -8.901  -9.658
  568   1HB   TYR  78          2HB       TYR  78  -4.420  -6.573 -11.465
  569   2HB   TYR  78          1HB       TYR  78  -4.594  -8.179 -12.174
  570    HD1  TYR  78           HD1      TYR  78  -6.299  -5.628 -10.461
  571    HD2  TYR  78           HD2      TYR  78  -5.937  -9.905 -10.628
  572    HE1  TYR  78           HE1      TYR  78  -8.530  -5.855  -9.405
  573    HE2  TYR  78           HE2      TYR  78  -8.171 -10.134  -9.572
  574    HH   TYR  78           HH       TYR  78 -10.075  -9.012  -9.036
  575    H    CYS  79           H        CYS  79  -1.493  -6.949 -11.218
  576    HA   CYS  79           HA       CYS  79  -0.558  -9.146 -12.923
  577   1HB   CYS  79          2HB       CYS  79  -0.452  -6.664 -13.431
  578   2HB   CYS  79          1HB       CYS  79   0.777  -6.526 -12.172
  579    HG   CYS  79           HG       CYS  79   1.969  -6.941 -14.495
  580    H    ALA  80           H        ALA  80  -0.243  -8.277  -9.642
  581    HA   ALA  80           HA       ALA  80   2.480  -9.436  -9.356
  582   1HB   ALA  80          1HB       ALA  80   1.785  -7.400  -8.121
  583   2HB   ALA  80          2HB       ALA  80   2.161  -8.716  -7.011
  584   3HB   ALA  80          3HB       ALA  80   0.481  -8.315  -7.364
  585    H    LEU  81           H        LEU  81  -0.875 -10.067  -8.627
  586    HA   LEU  81           HA       LEU  81  -0.345 -12.629  -7.269
  587   1HB   LEU  81          2HB       LEU  81  -2.473 -12.268  -6.475
  588   2HB   LEU  81          1HB       LEU  81  -2.058 -10.612  -6.918
  589    HG   LEU  81           HG       LEU  81  -2.981 -11.458  -9.285
  590   1HD1  LEU  81          1HD1      LEU  81  -4.918 -12.808  -7.468
  591   2HD1  LEU  81          2HD1      LEU  81  -3.415 -13.661  -7.839
  592   3HD1  LEU  81          3HD1      LEU  81  -4.504 -13.174  -9.146
  593   1HD2  LEU  81          1HD2      LEU  81  -5.068 -10.334  -8.660
  594   2HD2  LEU  81          2HD2      LEU  81  -3.683  -9.496  -7.944
  595   3HD2  LEU  81          3HD2      LEU  81  -4.690 -10.556  -6.949
  596    H    GLU  82           H        GLU  82  -1.113 -11.476 -10.449
  597    HA   GLU  82           HA       GLU  82  -2.478 -13.811 -11.447
  598   1HB   GLU  82          2HB       GLU  82  -2.681 -11.704 -12.573
  599   2HB   GLU  82          1HB       GLU  82  -0.929 -11.528 -12.690
  600   1HG   GLU  82          2HG       GLU  82  -0.760 -12.990 -14.456
  601   2HG   GLU  82          1HG       GLU  82  -2.125 -13.967 -13.914
  602    H    LYS  83           H        LYS  83   0.846 -12.669 -12.099
  603    HA   LYS  83           HA       LYS  83   2.066 -15.228 -11.626
  604   1HB   LYS  83          2HB       LYS  83   0.563 -15.582 -13.666
  605   2HB   LYS  83          1HB       LYS  83   1.667 -14.522 -14.541
  606   1HG   LYS  83          2HG       LYS  83   3.536 -16.093 -13.661
  607   2HG   LYS  83          1HG       LYS  83   2.223 -17.223 -13.328
  608   1HD   LYS  83          2HD       LYS  83   1.511 -17.115 -15.680
  609   2HD   LYS  83          1HD       LYS  83   2.801 -15.961 -16.026
  610   1HE   LYS  83          2HE       LYS  83   4.132 -17.744 -16.477
  611   2HE   LYS  83          1HE       LYS  83   4.073 -18.132 -14.745
  612   1HZ   LYS  83          1HZ       LYS  83   2.512 -19.242 -16.949
  613   2HZ   LYS  83          2HZ       LYS  83   1.696 -19.004 -15.477
  614   3HZ   LYS  83          3HZ       LYS  83   3.076 -19.994 -15.537
  615    H    GLU  84           H        GLU  84   2.740 -12.520 -11.020
  616    HA   GLU  84           HA       GLU  84   5.444 -12.407 -12.190
  617   1HB   GLU  84          2HB       GLU  84   3.172 -10.802 -13.095
  618   2HB   GLU  84          1HB       GLU  84   4.526  -9.801 -12.571
  619   1HG   GLU  84          2HG       GLU  84   5.951 -11.505 -13.990
  620   2HG   GLU  84          1HG       GLU  84   4.412 -11.814 -14.793
  621    HA   PRO  85           HA       PRO  85   6.089 -10.727  -8.156
  622   1HB   PRO  85          2HB       PRO  85   8.629  -9.776  -8.512
  623   2HB   PRO  85          1HB       PRO  85   8.266 -11.505  -8.340
  624   1HG   PRO  85          2HG       PRO  85   8.859  -9.932 -10.787
  625   2HG   PRO  85          1HG       PRO  85   9.303 -11.595 -10.378
  626   1HD   PRO  85          2HD       PRO  85   7.248 -10.906 -12.071
  627   2HD   PRO  85          1HD       PRO  85   7.346 -12.443 -11.186
  628    H    VAL  86           H        VAL  86   7.077  -8.464  -7.286
  629    HA   VAL  86           HA       VAL  86   6.165  -6.294  -9.149
  630    HB   VAL  86           HB       VAL  86   5.586  -6.702  -6.200
  631   1HG1  VAL  86          1HG1      VAL  86   4.019  -4.611  -7.163
  632   2HG1  VAL  86          2HG1      VAL  86   5.603  -4.310  -7.877
  633   3HG1  VAL  86          3HG1      VAL  86   5.437  -4.449  -6.127
  634   1HG2  VAL  86          1HG2      VAL  86   4.118  -8.070  -7.479
  635   2HG2  VAL  86          2HG2      VAL  86   3.940  -6.841  -8.732
  636   3HG2  VAL  86          3HG2      VAL  86   3.193  -6.605  -7.152
  637    HA   PRO  87           HA       PRO  87  10.146  -4.804  -7.711
  638   1HB   PRO  87          2HB       PRO  87  10.520  -3.045  -9.769
  639   2HB   PRO  87          1HB       PRO  87  10.819  -4.785  -9.930
  640   1HG   PRO  87          2HG       PRO  87   8.604  -3.156 -10.975
  641   2HG   PRO  87          1HG       PRO  87   9.268  -4.682 -11.572
  642   1HD   PRO  87          2HD       PRO  87   6.901  -4.326 -10.065
  643   2HD   PRO  87          1HD       PRO  87   7.680  -5.866 -10.491
  644    H    MET  88           H        MET  88  10.865  -2.599  -6.991
  645    HA   MET  88           HA       MET  88   8.573  -0.971  -6.054
  646   1HB   MET  88          2HB       MET  88  11.526  -0.499  -5.662
  647   2HB   MET  88          1HB       MET  88  10.204   0.008  -4.616
  648   1HG   MET  88          2HG       MET  88   9.851  -2.178  -3.799
  649   2HG   MET  88          1HG       MET  88  10.720  -2.922  -5.139
  650   1HE   MET  88          1HE       MET  88  14.368  -2.507  -4.451
  651   2HE   MET  88          2HE       MET  88  13.266  -1.816  -5.639
  652   3HE   MET  88          3HE       MET  88  13.101  -3.506  -5.173
  653    H    SER  89           H        SER  89   9.851  -1.034  -8.955
  654    HA   SER  89           HA       SER  89  10.624   1.812  -9.121
  655   1HB   SER  89          2HB       SER  89  11.935   1.081 -10.795
  656   2HB   SER  89          1HB       SER  89  11.530  -0.536 -10.236
  657    HG   SER  89           HG       SER  89   9.924  -0.643 -11.754
  658    H    LEU  90           H        LEU  90   9.053   3.196  -9.446
  659    HA   LEU  90           HA       LEU  90   6.684   2.408 -11.078
  660   1HB   LEU  90          2HB       LEU  90   5.793   3.288  -9.154
  661   2HB   LEU  90          1HB       LEU  90   7.285   4.119  -8.741
  662    HG   LEU  90           HG       LEU  90   6.753   5.972 -10.125
  663   1HD1  LEU  90          1HD1      LEU  90   5.706   5.600 -12.095
  664   2HD1  LEU  90          2HD1      LEU  90   4.197   5.426 -11.200
  665   3HD1  LEU  90          3HD1      LEU  90   5.179   4.006 -11.558
  666   1HD2  LEU  90          1HD2      LEU  90   5.029   5.099  -8.063
  667   2HD2  LEU  90          2HD2      LEU  90   3.988   5.759  -9.324
  668   3HD2  LEU  90          3HD2      LEU  90   5.267   6.752  -8.626
  669    HA   PRO  91           HA       PRO  91   9.413   4.806 -13.901
  670   1HB   PRO  91          2HB       PRO  91   8.462   3.558 -16.159
  671   2HB   PRO  91          1HB       PRO  91   9.783   2.908 -15.163
  672   1HG   PRO  91          2HG       PRO  91   6.877   2.201 -15.144
  673   2HG   PRO  91          1HG       PRO  91   8.294   1.136 -15.089
  674   1HD   PRO  91          2HD       PRO  91   6.921   1.726 -12.866
  675   2HD   PRO  91          1HD       PRO  91   8.694   1.552 -12.844
  676    HA   PRO  92           HA       PRO  92   6.478   7.771 -15.212
  677   1HB   PRO  92          2HB       PRO  92   7.503   8.561 -17.624
  678   2HB   PRO  92          1HB       PRO  92   8.241   9.000 -16.071
  679   1HG   PRO  92          2HG       PRO  92   9.006   6.858 -17.994
  680   2HG   PRO  92          1HG       PRO  92  10.037   7.953 -17.057
  681   1HD   PRO  92          2HD       PRO  92   9.604   5.375 -16.342
  682   2HD   PRO  92          1HD       PRO  92   9.909   6.667 -15.158
  683    H    ALA  93           H        ALA  93   6.883   4.876 -16.900
  684    HA   ALA  93           HA       ALA  93   5.101   5.331 -19.139
  685   1HB   ALA  93          1HB       ALA  93   6.748   3.249 -17.983
  686   2HB   ALA  93          2HB       ALA  93   6.149   3.386 -19.636
  687   3HB   ALA  93          3HB       ALA  93   5.164   2.595 -18.403
  688    H    LEU  94           H        LEU  94   4.688   4.815 -15.765
  689    HA   LEU  94           HA       LEU  94   1.787   4.390 -16.242
  690   1HB   LEU  94          2HB       LEU  94   1.741   2.560 -14.842
  691   2HB   LEU  94          1HB       LEU  94   3.372   2.404 -15.482
  692    HG   LEU  94           HG       LEU  94   3.706   4.095 -13.302
  693   1HD1  LEU  94          1HD1      LEU  94   1.918   3.802 -11.949
  694   2HD1  LEU  94          2HD1      LEU  94   2.424   2.124 -11.763
  695   3HD1  LEU  94          3HD1      LEU  94   1.252   2.560 -13.011
  696   1HD2  LEU  94          1HD2      LEU  94   3.933   1.076 -13.519
  697   2HD2  LEU  94          2HD2      LEU  94   4.661   2.038 -12.231
  698   3HD2  LEU  94          3HD2      LEU  94   5.190   2.253 -13.900
  699    H    VAL  95           H        VAL  95   3.041   6.911 -15.742
  700    HA   VAL  95           HA       VAL  95   2.266   7.474 -12.903
  701    HB   VAL  95           HB       VAL  95   4.045   8.882 -14.915
  702   1HG1  VAL  95          1HG1      VAL  95   2.908  10.556 -13.547
  703   2HG1  VAL  95          2HG1      VAL  95   4.585  10.413 -13.019
  704   3HG1  VAL  95          3HG1      VAL  95   3.297   9.658 -12.080
  705   1HG2  VAL  95          1HG2      VAL  95   5.786   8.337 -13.187
  706   2HG2  VAL  95          2HG2      VAL  95   5.066   6.909 -13.929
  707   3HG2  VAL  95          3HG2      VAL  95   4.565   7.410 -12.315
  708    HA   PRO  96           HA       PRO  96  -1.237   9.585 -14.585
  709   1HB   PRO  96          2HB       PRO  96  -1.989  10.903 -12.307
  710   2HB   PRO  96          1HB       PRO  96  -2.277   9.169 -12.559
  711   1HG   PRO  96          2HG       PRO  96  -0.155  10.525 -10.972
  712   2HG   PRO  96          1HG       PRO  96  -1.056   9.041 -10.620
  713   1HD   PRO  96          2HD       PRO  96   1.500   9.067 -11.586
  714   2HD   PRO  96          1HD       PRO  96   0.354   7.737 -11.862
  715    HA   PRO  97           HA       PRO  97   0.078  13.696 -15.424
  716   1HB   PRO  97          2HB       PRO  97  -2.285  15.063 -15.547
  717   2HB   PRO  97          1HB       PRO  97  -1.781  13.898 -16.786
  718   1HG   PRO  97          2HG       PRO  97  -3.746  13.588 -14.587
  719   2HG   PRO  97          1HG       PRO  97  -3.752  12.900 -16.216
  720   1HD   PRO  97          2HD       PRO  97  -3.040  11.532 -13.924
  721   2HD   PRO  97          1HD       PRO  97  -2.569  11.071 -15.573
  722    H    SER  98           H        SER  98  -1.784  13.116 -12.542
  723    HA   SER  98           HA       SER  98  -1.876  15.693 -11.372
  724   1HB   SER  98          2HB       SER  98  -2.645  13.192 -10.694
  725   2HB   SER  98          1HB       SER  98  -1.217  13.335  -9.673
  726    HG   SER  98           HG       SER  98  -3.603  14.315  -9.225
  727    H    LYS  99           H        LYS  99   0.824  13.546 -11.890
  728    HA   LYS  99           HA       LYS  99   2.561  15.018  -9.996
  729   1HB   LYS  99          2HB       LYS  99   2.495  12.468 -10.532
  730   2HB   LYS  99          1HB       LYS  99   3.381  12.907 -11.992
  731   1HG   LYS  99          2HG       LYS  99   4.845  14.270 -10.194
  732   2HG   LYS  99          1HG       LYS  99   4.265  12.971  -9.150
  733   1HD   LYS  99          2HD       LYS  99   4.987  11.406 -11.114
  734   2HD   LYS  99          1HD       LYS  99   5.962  12.783 -11.628
  735   1HE   LYS  99          2HE       LYS  99   6.120  12.000  -8.743
  736   2HE   LYS  99          1HE       LYS  99   6.946  10.967  -9.927
  737   1HZ   LYS  99          1HZ       LYS  99   7.397  13.800  -9.305
  738   2HZ   LYS  99          2HZ       LYS  99   7.655  13.274 -10.899
  739   3HZ   LYS  99          3HZ       LYS  99   8.527  12.575  -9.619
  740    H    ARG 100           H        ARG 100   1.344  15.817 -12.892
  741    HA   ARG 100           HA       ARG 100   3.930  17.019 -13.849
  742   1HB   ARG 100          2HB       ARG 100   1.534  16.303 -15.554
  743   2HB   ARG 100          1HB       ARG 100   3.189  16.609 -16.080
  744   1HG   ARG 100          2HG       ARG 100   3.867  14.581 -14.683
  745   2HG   ARG 100          1HG       ARG 100   2.146  14.218 -14.549
  746   1HD   ARG 100          2HD       ARG 100   2.461  14.686 -17.268
  747   2HD   ARG 100          1HD       ARG 100   3.943  13.816 -16.828
  748    HE   ARG 100           HE       ARG 100   1.693  12.587 -15.538
  749   1HH1  ARG 100          1HH2      ARG 100   4.061  11.896 -17.682
  750   2HH1  ARG 100          2HH2      ARG 100   3.121  10.889 -18.731
  751   1HH2  ARG 100          2HH1      ARG 100   0.090  11.759 -17.291
  752   2HH2  ARG 100          1HH1      ARG 100   0.873  10.812 -18.511
  753    H    SER 107           1H       SER 107   8.024   3.525   0.035
  754    HA   SER 107           HA       SER 107   8.382   6.374   0.764
  755   1HB   SER 107          2HB       SER 107   6.588   4.905  -1.195
  756   2HB   SER 107          1HB       SER 107   6.891   6.639  -1.134
  757    HG   SER 107           HG       SER 107   8.295   5.963  -2.626
  758    H    THR 108           H        THR 108   7.664   5.671   3.029
  759    HA   THR 108           HA       THR 108   5.982   5.179   4.642
  760    HB   THR 108           HB       THR 108   5.694   7.499   4.465
  761    HG1  THR 108           HG1      THR 108   3.501   7.779   4.559
  762   1HG2  THR 108          1HG2      THR 108   6.081   7.661   2.040
  763   2HG2  THR 108          2HG2      THR 108   4.675   8.612   2.513
  764   3HG2  THR 108          3HG2      THR 108   4.457   7.045   1.734
  765    H    ASN 109           H        ASN 109   5.303   3.028   4.216
  766    HA   ASN 109           HA       ASN 109   2.811   2.796   2.557
  767   1HB   ASN 109          2HB       ASN 109   4.682   1.733   1.449
  768   2HB   ASN 109          1HB       ASN 109   5.166   0.925   2.940
  769   1HD2  ASN 109          1HD2      ASN 109   2.960   0.794   0.223
  770   2HD2  ASN 109          2HD2      ASN 109   2.217  -0.672   0.646
  771    HA   PRO 110           HA       PRO 110   1.038   1.284   6.298
  772   1HB   PRO 110          2HB       PRO 110  -1.149   0.016   5.244
  773   2HB   PRO 110          1HB       PRO 110  -1.015   1.782   5.358
  774   1HG   PRO 110          2HG       PRO 110  -0.628   0.005   3.012
  775   2HG   PRO 110          1HG       PRO 110  -1.335   1.626   3.102
  776   1HD   PRO 110          2HD       PRO 110   1.212   1.096   2.220
  777   2HD   PRO 110          1HD       PRO 110   0.689   2.654   2.896
  778    H    PHE 111           H        PHE 111   1.472  -0.988   3.580
  779    HA   PHE 111           HA       PHE 111   1.231  -3.391   5.186
  780   1HB   PHE 111          2HB       PHE 111   2.475  -2.758   2.491
  781   2HB   PHE 111          1HB       PHE 111   2.294  -4.400   3.114
  782    HD1  PHE 111           HD1      PHE 111   0.545  -1.451   1.793
  783    HD2  PHE 111           HD2      PHE 111   0.083  -5.401   3.416
  784    HE1  PHE 111           HE1      PHE 111  -1.801  -1.505   1.000
  785    HE2  PHE 111           HE2      PHE 111  -2.264  -5.451   2.623
  786    HZ   PHE 111           HZ       PHE 111  -3.202  -3.505   1.415
  787    H    LEU 112           HN       LEU 112   3.595  -0.993   5.120
  788    HA   LEU 112           HA       LEU 112   5.642  -2.907   6.194
  789   1HB   LEU 112          2HB       LEU 112   5.840  -0.620   4.235
  790   2HB   LEU 112          1HB       LEU 112   7.256  -1.161   5.141
  791    HG   LEU 112           HG       LEU 112   5.570  -3.196   3.724
  792   1HD1  LEU 112          1HD1      LEU 112   7.073  -2.881   1.726
  793   2HD1  LEU 112          2HD1      LEU 112   7.635  -1.376   2.455
  794   3HD1  LEU 112          3HD1      LEU 112   5.944  -1.552   1.985
  795   1HD2  LEU 112          1HD2      LEU 112   7.247  -4.250   4.933
  796   2HD2  LEU 112          2HD2      LEU 112   8.365  -2.897   4.757
  797   3HD2  LEU 112          3HD2      LEU 112   8.087  -3.991   3.403
  Start of MODEL   14
    1    HA   PRO   6           HA       PRO   6   1.835   5.697 -23.712
    2   1HB   PRO   6          2HB       PRO   6  -0.691   4.832 -23.140
    3   2HB   PRO   6          1HB       PRO   6  -0.185   5.318 -24.770
    4   1HG   PRO   6          2HG       PRO   6  -0.555   2.603 -23.635
    5   2HG   PRO   6          1HG       PRO   6  -0.852   3.194 -25.275
    6   1HD   PRO   6          2HD       PRO   6   1.352   1.722 -24.506
    7   2HD   PRO   6          1HD       PRO   6   1.279   2.765 -25.942
    8    H    TRP   7           H        TRP   7   0.065   5.732 -21.585
    9    HA   TRP   7           HA       TRP   7   1.636   5.296 -19.300
   10   1HB   TRP   7          2HB       TRP   7  -0.438   6.672 -19.505
   11   2HB   TRP   7          1HB       TRP   7  -1.388   5.189 -19.583
   12    HD1  TRP   7           HD1      TRP   7   1.466   4.785 -17.320
   13    HE1  TRP   7           HE1      TRP   7   0.728   4.952 -14.855
   14    HE3  TRP   7           HE3      TRP   7  -3.243   6.648 -17.945
   15    HZ2  TRP   7           HZ2      TRP   7  -1.560   5.772 -13.351
   16    HZ3  TRP   7           HZ3      TRP   7  -4.680   7.112 -15.979
   17    HH2  TRP   7           HH2      TRP   7  -3.845   6.677 -13.685
   18    H    ALA   8           H        ALA   8   2.275   3.412 -18.314
   19    HA   ALA   8           HA       ALA   8   1.825   0.811 -19.142
   20   1HB   ALA   8          1HB       ALA   8   2.701   0.210 -17.041
   21   2HB   ALA   8          2HB       ALA   8   1.855   1.520 -16.214
   22   3HB   ALA   8          3HB       ALA   8   3.254   1.874 -17.231
   23    H    VAL   9           H        VAL   9  -0.359   2.893 -17.363
   24    HA   VAL   9           HA       VAL   9  -2.239   0.662 -16.819
   25    HB   VAL   9           HB       VAL   9  -2.014   3.590 -16.114
   26   1HG1  VAL   9          1HG1      VAL   9  -4.352   3.373 -16.576
   27   2HG1  VAL   9          2HG1      VAL   9  -4.190   3.208 -14.828
   28   3HG1  VAL   9          3HG1      VAL   9  -4.421   1.777 -15.833
   29   1HG2  VAL   9          1HG2      VAL   9  -0.789   2.188 -14.639
   30   2HG2  VAL   9          2HG2      VAL   9  -2.050   0.953 -14.633
   31   3HG2  VAL   9          3HG2      VAL   9  -2.309   2.484 -13.795
   32    H    LYS  10           H        LYS  10  -4.122   0.370 -18.067
   33    HA   LYS  10           HA       LYS  10  -4.329   2.029 -20.522
   34   1HB   LYS  10          2HB       LYS  10  -4.938  -0.700 -19.633
   35   2HB   LYS  10          1HB       LYS  10  -6.229   0.005 -20.609
   36   1HG   LYS  10          2HG       LYS  10  -4.746   0.433 -22.434
   37   2HG   LYS  10          1HG       LYS  10  -3.323   0.104 -21.446
   38   1HD   LYS  10          2HD       LYS  10  -3.743  -2.219 -21.399
   39   2HD   LYS  10          1HD       LYS  10  -5.423  -2.013 -21.897
   40   1HE   LYS  10          2HE       LYS  10  -4.869  -2.014 -24.103
   41   2HE   LYS  10          1HE       LYS  10  -3.499  -0.918 -23.838
   42   1HZ   LYS  10          1HZ       LYS  10  -3.605  -3.851 -23.476
   43   2HZ   LYS  10          2HZ       LYS  10  -2.437  -2.912 -22.677
   44   3HZ   LYS  10          3HZ       LYS  10  -2.495  -2.938 -24.376
   45    HA   PRO  11           HA       PRO  11  -8.030   4.089 -19.404
   46   1HB   PRO  11          2HB       PRO  11  -9.694   3.668 -21.539
   47   2HB   PRO  11          1HB       PRO  11  -8.290   4.754 -21.607
   48   1HG   PRO  11          2HG       PRO  11  -8.580   1.963 -22.605
   49   2HG   PRO  11          1HG       PRO  11  -7.736   3.340 -23.331
   50   1HD   PRO  11          2HD       PRO  11  -6.456   1.341 -22.001
   51   2HD   PRO  11          1HD       PRO  11  -5.841   3.006 -22.083
   52    H    GLU  12           H        GLU  12  -8.481   0.783 -20.565
   53    HA   GLU  12           HA       GLU  12 -11.103   0.453 -19.292
   54   1HB   GLU  12          2HB       GLU  12  -9.272  -1.777 -20.164
   55   2HB   GLU  12          1HB       GLU  12 -11.027  -1.676 -20.294
   56   1HG   GLU  12          2HG       GLU  12 -10.125   0.492 -21.792
   57   2HG   GLU  12          1HG       GLU  12  -8.979  -0.793 -22.174
   58    H    ASP  13           H        ASP  13  -7.740  -0.058 -18.491
   59    HA   ASP  13           HA       ASP  13  -8.269  -1.739 -16.155
   60   1HB   ASP  13          2HB       ASP  13  -6.031  -0.701 -17.719
   61   2HB   ASP  13          1HB       ASP  13  -5.711  -0.600 -15.987
   62    H    LYS  14           H        LYS  14  -7.507   1.655 -16.822
   63    HA   LYS  14           HA       LYS  14  -7.420   2.458 -14.045
   64   1HB   LYS  14          2HB       LYS  14  -6.289   3.753 -15.723
   65   2HB   LYS  14          1HB       LYS  14  -7.757   3.886 -16.690
   66   1HG   LYS  14          2HG       LYS  14  -7.548   5.979 -15.571
   67   2HG   LYS  14          1HG       LYS  14  -8.794   5.096 -14.689
   68   1HD   LYS  14          2HD       LYS  14  -7.191   4.430 -12.986
   69   2HD   LYS  14          1HD       LYS  14  -5.868   5.158 -13.899
   70   1HE   LYS  14          2HE       LYS  14  -6.391   6.825 -12.306
   71   2HE   LYS  14          1HE       LYS  14  -7.313   7.350 -13.729
   72   1HZ   LYS  14          1HZ       LYS  14  -9.102   5.770 -12.795
   73   2HZ   LYS  14          2HZ       LYS  14  -8.922   7.305 -12.087
   74   3HZ   LYS  14          3HZ       LYS  14  -8.270   5.933 -11.326
   75    H    ALA  15           H        ALA  15  -9.926   1.867 -16.347
   76    HA   ALA  15           HA       ALA  15 -11.992   3.533 -15.185
   77   1HB   ALA  15          1HB       ALA  15 -11.592   1.699 -17.358
   78   2HB   ALA  15          2HB       ALA  15 -12.921   2.837 -17.132
   79   3HB   ALA  15          3HB       ALA  15 -13.039   1.203 -16.480
   80    H    LYS  16           H        LYS  16 -11.030   0.114 -14.813
   81    HA   LYS  16           HA       LYS  16 -13.110  -0.436 -12.848
   82   1HB   LYS  16          2HB       LYS  16 -12.380  -2.577 -13.185
   83   2HB   LYS  16          1HB       LYS  16 -11.469  -1.876 -14.517
   84   1HG   LYS  16          2HG       LYS  16  -9.505  -1.647 -13.136
   85   2HG   LYS  16          1HG       LYS  16 -10.399  -2.146 -11.701
   86   1HD   LYS  16          2HD       LYS  16  -9.442  -4.174 -12.265
   87   2HD   LYS  16          1HD       LYS  16 -10.919  -4.277 -13.226
   88   1HE   LYS  16          2HE       LYS  16  -9.661  -3.286 -15.167
   89   2HE   LYS  16          1HE       LYS  16  -8.178  -3.404 -14.200
   90   1HZ   LYS  16          1HZ       LYS  16  -9.190  -5.820 -13.810
   91   2HZ   LYS  16          2HZ       LYS  16  -8.131  -5.468 -15.090
   92   3HZ   LYS  16          3HZ       LYS  16  -9.806  -5.523 -15.362
   93    H    TYR  17           H        TYR  17  -9.796   0.697 -12.860
   94    HA   TYR  17           HA       TYR  17  -9.192   0.381 -10.064
   95   1HB   TYR  17          2HB       TYR  17  -8.308   2.413 -12.150
   96   2HB   TYR  17          1HB       TYR  17  -7.512   2.166 -10.600
   97    HD1  TYR  17           HD1      TYR  17  -8.682  -0.976 -11.540
   98    HD2  TYR  17           HD2      TYR  17  -5.653   1.890 -12.567
   99    HE1  TYR  17           HE1      TYR  17  -7.312  -2.779 -12.541
  100    HE2  TYR  17           HE2      TYR  17  -4.273   0.086 -13.561
  101    HH   TYR  17           HH       TYR  17  -5.532  -3.104 -14.080
  102    H    ASP  18           H        ASP  18 -10.665   2.958 -12.001
  103    HA   ASP  18           HA       ASP  18 -10.987   4.838  -9.812
  104   1HB   ASP  18          2HB       ASP  18 -10.878   5.520 -12.152
  105   2HB   ASP  18          1HB       ASP  18 -12.277   4.519 -12.545
  106    H    ALA  19           H        ALA  19 -12.579   1.949 -10.571
  107    HA   ALA  19           HA       ALA  19 -15.177   2.809  -9.391
  108   1HB   ALA  19          1HB       ALA  19 -14.167   0.207 -10.603
  109   2HB   ALA  19          2HB       ALA  19 -15.165   1.408 -11.424
  110   3HB   ALA  19          3HB       ALA  19 -15.825   0.487 -10.072
  111    H    ILE  20           H        ILE  20 -12.338   0.847  -8.856
  112    HA   ILE  20           HA       ILE  20 -13.241  -0.289  -6.320
  113    HB   ILE  20           HB       ILE  20 -10.669  -0.122  -7.916
  114   1HG1  ILE  20          2HG1      ILE  20 -12.188  -2.614  -7.182
  115   2HG1  ILE  20          1HG1      ILE  20 -12.747  -1.608  -8.519
  116   1HG2  ILE  20          1HG2      ILE  20  -9.574  -1.473  -6.324
  117   2HG2  ILE  20          2HG2      ILE  20 -11.074  -1.827  -5.469
  118   3HG2  ILE  20          3HG2      ILE  20 -10.366  -0.215  -5.378
  119   1HD1  ILE  20          1HD1      ILE  20 -10.525  -1.779  -9.583
  120   2HD1  ILE  20          2HD1      ILE  20 -11.225  -3.378  -9.326
  121   3HD1  ILE  20          3HD1      ILE  20  -9.964  -2.783  -8.246
  122    H    PHE  21           H        PHE  21 -11.493   2.491  -7.526
  123    HA   PHE  21           HA       PHE  21 -10.367   3.335  -4.977
  124   1HB   PHE  21          2HB       PHE  21  -9.169   4.224  -6.734
  125   2HB   PHE  21          1HB       PHE  21 -10.572   4.255  -7.796
  126    HD1  PHE  21           HD1      PHE  21  -8.464   6.181  -5.580
  127    HD2  PHE  21           HD2      PHE  21 -12.340   6.060  -7.428
  128    HE1  PHE  21           HE1      PHE  21  -8.748   8.607  -5.146
  129    HE2  PHE  21           HE2      PHE  21 -12.623   8.485  -6.993
  130    HZ   PHE  21           HZ       PHE  21 -10.829   9.758  -5.853
  131    H    ASP  22           H        ASP  22 -13.211   4.099  -6.920
  132    HA   ASP  22           HA       ASP  22 -14.216   6.076  -4.977
  133   1HB   ASP  22          2HB       ASP  22 -14.496   6.460  -7.359
  134   2HB   ASP  22          1HB       ASP  22 -15.256   4.881  -7.568
  135    H    SER  23           H        SER  23 -14.151   2.754  -5.071
  136    HA   SER  23           HA       SER  23 -16.915   2.297  -4.105
  137   1HB   SER  23          2HB       SER  23 -14.658   0.787  -5.194
  138   2HB   SER  23          1HB       SER  23 -15.373  -0.015  -3.798
  139    HG   SER  23           HG       SER  23 -17.223  -0.240  -4.860
  140    H    LEU  24           H        LEU  24 -13.953   3.272  -2.853
  141    HA   LEU  24           HA       LEU  24 -14.441   2.103  -0.147
  142   1HB   LEU  24          2HB       LEU  24 -12.036   3.713  -0.957
  143   2HB   LEU  24          1HB       LEU  24 -12.135   2.357   0.162
  144    HG   LEU  24           HG       LEU  24 -12.583   2.030  -2.809
  145   1HD1  LEU  24          1HD1      LEU  24 -10.370   2.230  -3.172
  146   2HD1  LEU  24          2HD1      LEU  24 -10.051   1.002  -1.948
  147   3HD1  LEU  24          3HD1      LEU  24 -10.149   2.701  -1.486
  148   1HD2  LEU  24          1HD2      LEU  24 -11.627   0.057  -0.727
  149   2HD2  LEU  24          2HD2      LEU  24 -12.242  -0.294  -2.342
  150   3HD2  LEU  24          3HD2      LEU  24 -13.337   0.291  -1.089
  151    H    SER  25           H        SER  25 -14.702   4.920  -2.033
  152    HA   SER  25           HA       SER  25 -15.795   6.966  -1.397
  153   1HB   SER  25          2HB       SER  25 -16.308   5.653   0.779
  154   2HB   SER  25          1HB       SER  25 -14.896   6.477   1.429
  155    HG   SER  25           HG       SER  25 -16.248   8.050   1.763
  156    HA   PRO  26           HA       PRO  26 -11.579   8.548  -1.741
  157   1HB   PRO  26          2HB       PRO  26 -12.225  10.376  -3.662
  158   2HB   PRO  26          1HB       PRO  26 -11.898   8.669  -4.027
  159   1HG   PRO  26          2HG       PRO  26 -14.495  10.092  -3.800
  160   2HG   PRO  26          1HG       PRO  26 -14.007   8.801  -4.908
  161   1HD   PRO  26          2HD       PRO  26 -15.552   8.411  -2.670
  162   2HD   PRO  26          1HD       PRO  26 -14.549   7.154  -3.421
  163    H    VAL  27           H        VAL  27 -10.713  10.544  -1.016
  164    HA   VAL  27           HA       VAL  27 -12.702  12.420   0.215
  165    HB   VAL  27           HB       VAL  27  -9.871  11.748   1.082
  166   1HG1  VAL  27          1HG1      VAL  27 -10.584  12.855   3.188
  167   2HG1  VAL  27          2HG1      VAL  27 -12.137  13.237   2.446
  168   3HG1  VAL  27          3HG1      VAL  27 -10.658  13.959   1.814
  169   1HG2  VAL  27          1HG2      VAL  27 -11.954  10.881   2.885
  170   2HG2  VAL  27          2HG2      VAL  27 -10.691   9.919   2.115
  171   3HG2  VAL  27          3HG2      VAL  27 -12.226  10.187   1.286
  172    H    ASN  28           H        ASN  28 -12.759  14.084  -1.287
  173    HA   ASN  28           HA       ASN  28 -11.981  15.905  -2.562
  174   1HB   ASN  28          2HB       ASN  28 -11.008  16.704  -0.560
  175   2HB   ASN  28          1HB       ASN  28  -9.814  15.410  -0.519
  176   1HD2  ASN  28          1HD2      ASN  28  -7.777  15.951  -1.300
  177   2HD2  ASN  28          2HD2      ASN  28  -7.443  17.272  -2.312
  178    H    GLY  29           H        GLY  29 -11.125  12.898  -3.073
  179   1HA   GLY  29          2HA       GLY  29 -10.333  12.223  -5.294
  180   2HA   GLY  29          1HA       GLY  29  -9.237  13.605  -5.271
  181    H    PHE  30           H        PHE  30  -9.674  11.441  -2.510
  182    HA   PHE  30           HA       PHE  30  -7.102  10.081  -3.122
  183   1HB   PHE  30          2HB       PHE  30  -7.649  11.905  -0.767
  184   2HB   PHE  30          1HB       PHE  30  -6.268  10.801  -0.837
  185    HD1  PHE  30           HD1      PHE  30  -7.643  13.956  -1.953
  186    HD2  PHE  30           HD2      PHE  30  -4.640  10.995  -2.740
  187    HE1  PHE  30           HE1      PHE  30  -6.418  15.583  -3.355
  188    HE2  PHE  30           HE2      PHE  30  -3.397  12.628  -4.142
  189    HZ   PHE  30           HZ       PHE  30  -4.287  14.925  -4.450
  190    H    LEU  31           H        LEU  31  -6.801   8.165  -1.986
  191    HA   LEU  31           HA       LEU  31  -9.105   7.254  -0.280
  192   1HB   LEU  31          2HB       LEU  31  -7.287   5.883  -2.262
  193   2HB   LEU  31          1HB       LEU  31  -8.067   4.949  -0.985
  194    HG   LEU  31           HG       LEU  31  -9.391   6.530  -3.192
  195   1HD1  LEU  31          1HD1      LEU  31 -10.542   4.082  -3.058
  196   2HD1  LEU  31          2HD1      LEU  31  -8.938   3.703  -2.423
  197   3HD1  LEU  31          3HD1      LEU  31  -9.109   4.415  -4.033
  198   1HD2  LEU  31          1HD2      LEU  31 -10.683   7.033  -1.215
  199   2HD2  LEU  31          2HD2      LEU  31 -10.558   5.370  -0.644
  200   3HD2  LEU  31          3HD2      LEU  31 -11.532   5.744  -2.067
  201    H    SER  32           H        SER  32  -8.514   6.595   1.787
  202    HA   SER  32           HA       SER  32  -5.743   7.097   2.611
  203   1HB   SER  32          2HB       SER  32  -6.977   6.112   4.801
  204   2HB   SER  32          1HB       SER  32  -7.212   7.771   4.259
  205    HG   SER  32           HG       SER  32  -9.193   6.650   4.609
  206    H    GLY  33           H        GLY  33  -4.233   5.528   3.174
  207   1HA   GLY  33          2HA       GLY  33  -4.173   3.032   1.969
  208   2HA   GLY  33          1HA       GLY  33  -3.355   3.345   3.503
  209    H    ASP  34           H        ASP  34  -5.959   4.000   4.803
  210    HA   ASP  34           HA       ASP  34  -6.600   1.429   5.885
  211   1HB   ASP  34          2HB       ASP  34  -6.928   3.566   7.048
  212   2HB   ASP  34          1HB       ASP  34  -8.103   4.068   5.833
  213    H    LYS  35           H        LYS  35  -7.770   3.153   3.060
  214    HA   LYS  35           HA       LYS  35 -10.072   1.299   2.771
  215   1HB   LYS  35          2HB       LYS  35  -9.117   3.813   1.361
  216   2HB   LYS  35          1HB       LYS  35 -10.561   2.920   0.884
  217   1HG   LYS  35          2HG       LYS  35 -11.198   3.155   3.426
  218   2HG   LYS  35          1HG       LYS  35 -10.053   4.495   3.389
  219   1HD   LYS  35          2HD       LYS  35 -11.630   4.786   1.073
  220   2HD   LYS  35          1HD       LYS  35 -12.757   4.389   2.371
  221   1HE   LYS  35          2HE       LYS  35 -10.617   6.509   2.704
  222   2HE   LYS  35          1HE       LYS  35 -12.243   6.883   2.098
  223   1HZ   LYS  35          1HZ       LYS  35 -12.084   5.160   4.440
  224   2HZ   LYS  35          2HZ       LYS  35 -13.205   6.379   4.065
  225   3HZ   LYS  35          3HZ       LYS  35 -11.678   6.789   4.687
  226    H    VAL  36           H        VAL  36  -7.013   2.294   1.328
  227    HA   VAL  36           HA       VAL  36  -7.213   0.533  -0.991
  228    HB   VAL  36           HB       VAL  36  -4.922   1.966   0.365
  229   1HG1  VAL  36          1HG1      VAL  36  -4.714   1.398  -2.498
  230   2HG1  VAL  36          2HG1      VAL  36  -4.769  -0.061  -1.504
  231   3HG1  VAL  36          3HG1      VAL  36  -3.532   1.157  -1.212
  232   1HG2  VAL  36          1HG2      VAL  36  -5.445   3.815  -0.900
  233   2HG2  VAL  36          2HG2      VAL  36  -7.064   3.132  -0.761
  234   3HG2  VAL  36          3HG2      VAL  36  -6.109   2.853  -2.220
  235    H    LYS  37           H        LYS  37  -5.529   0.447   2.139
  236    HA   LYS  37           HA       LYS  37  -3.897  -1.733   1.951
  237   1HB   LYS  37          2HB       LYS  37  -4.048  -0.539   3.988
  238   2HB   LYS  37          1HB       LYS  37  -5.783  -0.817   4.118
  239   1HG   LYS  37          2HG       LYS  37  -5.479  -3.114   4.672
  240   2HG   LYS  37          1HG       LYS  37  -3.787  -3.085   4.172
  241   1HD   LYS  37          2HD       LYS  37  -3.761  -1.122   6.046
  242   2HD   LYS  37          1HD       LYS  37  -5.024  -2.162   6.704
  243   1HE   LYS  37          2HE       LYS  37  -3.521  -4.087   6.685
  244   2HE   LYS  37          1HE       LYS  37  -2.256  -3.124   5.893
  245   1HZ   LYS  37          1HZ       LYS  37  -3.515  -2.446   8.498
  246   2HZ   LYS  37          2HZ       LYS  37  -2.237  -1.615   7.745
  247   3HZ   LYS  37          3HZ       LYS  37  -2.000  -3.191   8.332
  248    HA   PRO  38           HA       PRO  38  -7.477  -4.859   2.689
  249   1HB   PRO  38          2HB       PRO  38 -10.031  -3.940   2.298
  250   2HB   PRO  38          1HB       PRO  38  -9.228  -3.926   3.883
  251   1HG   PRO  38          2HG       PRO  38  -9.571  -1.709   1.916
  252   2HG   PRO  38          1HG       PRO  38  -9.730  -1.683   3.680
  253   1HD   PRO  38          2HD       PRO  38  -7.528  -0.765   2.424
  254   2HD   PRO  38          1HD       PRO  38  -7.459  -1.546   4.020
  255    H    VAL  39           H        VAL  39  -8.036  -2.294   0.330
  256    HA   VAL  39           HA       VAL  39  -9.244  -3.815  -1.750
  257    HB   VAL  39           HB       VAL  39  -7.646  -1.293  -1.454
  258   1HG1  VAL  39          1HG1      VAL  39  -7.569  -2.809  -3.864
  259   2HG1  VAL  39          2HG1      VAL  39  -7.019  -1.155  -3.605
  260   3HG1  VAL  39          3HG1      VAL  39  -8.673  -1.465  -4.131
  261   1HG2  VAL  39          1HG2      VAL  39  -9.979  -0.803  -2.858
  262   2HG2  VAL  39          2HG2      VAL  39  -9.784  -0.651  -1.111
  263   3HG2  VAL  39          3HG2      VAL  39 -10.428  -2.141  -1.800
  264    H    LEU  40           H        LEU  40  -5.909  -3.599  -0.659
  265    HA   LEU  40           HA       LEU  40  -4.933  -5.022  -3.082
  266   1HB   LEU  40          2HB       LEU  40  -3.419  -4.049  -0.649
  267   2HB   LEU  40          1HB       LEU  40  -2.767  -4.398  -2.247
  268    HG   LEU  40           HG       LEU  40  -4.830  -2.260  -1.717
  269   1HD1  LEU  40          1HD1      LEU  40  -2.660  -0.843  -2.334
  270   2HD1  LEU  40          2HD1      LEU  40  -1.839  -2.239  -1.634
  271   3HD1  LEU  40          3HD1      LEU  40  -2.991  -1.318  -0.667
  272   1HD2  LEU  40          1HD2      LEU  40  -4.435  -1.604  -3.975
  273   2HD2  LEU  40          2HD2      LEU  40  -4.602  -3.361  -4.016
  274   3HD2  LEU  40          3HD2      LEU  40  -3.000  -2.624  -4.095
  275    H    LEU  41           H        LEU  41  -5.568  -5.541   0.342
  276    HA   LEU  41           HA       LEU  41  -4.112  -8.024   0.603
  277   1HB   LEU  41          2HB       LEU  41  -6.475  -6.791   2.056
  278   2HB   LEU  41          1HB       LEU  41  -5.617  -8.227   2.618
  279    HG   LEU  41           HG       LEU  41  -4.183  -5.641   2.026
  280   1HD1  LEU  41          1HD1      LEU  41  -4.240  -5.576   4.671
  281   2HD1  LEU  41          2HD1      LEU  41  -5.729  -6.498   4.447
  282   3HD1  LEU  41          3HD1      LEU  41  -5.569  -4.892   3.734
  283   1HD2  LEU  41          1HD2      LEU  41  -3.129  -7.320   4.130
  284   2HD2  LEU  41          2HD2      LEU  41  -2.362  -6.839   2.616
  285   3HD2  LEU  41          3HD2      LEU  41  -3.387  -8.275   2.670
  286    H    ASN  42           H        ASN  42  -7.059  -7.079  -0.898
  287    HA   ASN  42           HA       ASN  42  -8.339  -9.691  -0.726
  288   1HB   ASN  42          2HB       ASN  42  -8.916  -6.986  -1.560
  289   2HB   ASN  42          1HB       ASN  42  -9.420  -8.112  -2.821
  290   1HD2  ASN  42          1HD2      ASN  42 -10.459  -6.677   0.053
  291   2HD2  ASN  42          2HD2      ASN  42 -11.675  -7.786   0.466
  292    H    SER  43           H        SER  43  -5.772  -8.443  -2.500
  293    HA   SER  43           HA       SER  43  -6.277  -9.867  -5.025
  294   1HB   SER  43          2HB       SER  43  -3.615  -8.776  -4.251
  295   2HB   SER  43          1HB       SER  43  -4.507  -8.592  -5.760
  296    HG   SER  43           HG       SER  43  -6.014  -7.305  -4.383
  297    H    LYS  44           H        LYS  44  -5.734 -11.116  -2.142
  298    HA   LYS  44           HA       LYS  44  -4.723 -13.105  -1.367
  299   1HB   LYS  44          2HB       LYS  44  -5.076 -13.285  -4.292
  300   2HB   LYS  44          1HB       LYS  44  -3.873 -14.399  -3.640
  301   1HG   LYS  44          2HG       LYS  44  -6.674 -14.094  -2.527
  302   2HG   LYS  44          1HG       LYS  44  -6.199 -15.348  -3.674
  303   1HD   LYS  44          2HD       LYS  44  -4.721 -16.364  -2.128
  304   2HD   LYS  44          1HD       LYS  44  -4.710 -14.946  -1.079
  305   1HE   LYS  44          2HE       LYS  44  -7.110 -15.335  -0.546
  306   2HE   LYS  44          1HE       LYS  44  -7.072 -16.801  -1.545
  307   1HZ   LYS  44          1HZ       LYS  44  -6.458 -17.697   0.442
  308   2HZ   LYS  44          2HZ       LYS  44  -5.751 -16.260   1.011
  309   3HZ   LYS  44          3HZ       LYS  44  -4.924 -17.231  -0.110
  310    H    LEU  45           H        LEU  45  -3.083 -10.575  -2.307
  311    HA   LEU  45           HA       LEU  45  -0.410 -11.835  -2.681
  312   1HB   LEU  45          2HB       LEU  45  -1.660  -9.123  -2.985
  313   2HB   LEU  45          1HB       LEU  45   0.088  -9.234  -2.782
  314    HG   LEU  45           HG       LEU  45  -1.499 -10.744  -4.877
  315   1HD1  LEU  45          1HD1      LEU  45   0.447  -8.588  -5.560
  316   2HD1  LEU  45          2HD1      LEU  45  -1.123  -8.088  -4.933
  317   3HD1  LEU  45          3HD1      LEU  45  -1.029  -9.073  -6.392
  318   1HD2  LEU  45          1HD2      LEU  45   1.417 -10.314  -5.137
  319   2HD2  LEU  45          2HD2      LEU  45   0.461 -11.758  -5.468
  320   3HD2  LEU  45          3HD2      LEU  45   0.946 -11.380  -3.814
  321    HA   PRO  46           HA       PRO  46   0.627 -11.199   1.527
  322   1HB   PRO  46          2HB       PRO  46   3.349 -11.044   1.306
  323   2HB   PRO  46          1HB       PRO  46   2.451 -12.562   1.129
  324   1HG   PRO  46          2HG       PRO  46   3.643 -10.823  -0.943
  325   2HG   PRO  46          1HG       PRO  46   3.467 -12.581  -0.904
  326   1HD   PRO  46          2HD       PRO  46   1.852 -10.860  -2.337
  327   2HD   PRO  46          1HD       PRO  46   1.414 -12.513  -1.869
  328    H    VAL  47           H        VAL  47   2.104  -9.584   2.861
  329    HA   VAL  47           HA       VAL  47   1.351  -6.886   2.130
  330    HB   VAL  47           HB       VAL  47   2.645  -8.392   4.346
  331   1HG1  VAL  47          1HG1      VAL  47   4.371  -6.795   4.274
  332   2HG1  VAL  47          2HG1      VAL  47   3.225  -6.096   5.419
  333   3HG1  VAL  47          3HG1      VAL  47   3.285  -5.508   3.758
  334   1HG2  VAL  47          1HG2      VAL  47   0.248  -7.790   4.312
  335   2HG2  VAL  47          2HG2      VAL  47   0.683  -6.082   4.247
  336   3HG2  VAL  47          3HG2      VAL  47   1.078  -7.040   5.674
  337    H    ASP  48           H        ASP  48   3.832  -8.886   1.083
  338    HA   ASP  48           HA       ASP  48   5.980  -6.909   0.977
  339   1HB   ASP  48          2HB       ASP  48   5.653  -9.532  -0.510
  340   2HB   ASP  48          1HB       ASP  48   7.165  -8.714  -0.115
  341    H    ILE  49           H        ILE  49   3.464  -8.174  -1.140
  342    HA   ILE  49           HA       ILE  49   4.442  -6.698  -3.483
  343    HB   ILE  49           HB       ILE  49   1.702  -7.910  -3.111
  344   1HG1  ILE  49          2HG1      ILE  49   3.236  -9.591  -2.247
  345   2HG1  ILE  49          1HG1      ILE  49   2.715 -10.080  -3.855
  346   1HG2  ILE  49          1HG2      ILE  49   1.919  -6.887  -5.213
  347   2HG2  ILE  49          2HG2      ILE  49   2.313  -8.574  -5.549
  348   3HG2  ILE  49          3HG2      ILE  49   3.604  -7.382  -5.383
  349   1HD1  ILE  49          1HD1      ILE  49   5.109 -10.390  -3.693
  350   2HD1  ILE  49          2HD1      ILE  49   5.323  -8.728  -3.141
  351   3HD1  ILE  49          3HD1      ILE  49   4.789  -9.048  -4.793
  352    H    LEU  50           H        LEU  50   1.874  -6.485  -1.077
  353    HA   LEU  50           HA       LEU  50   0.661  -4.083  -2.168
  354   1HB   LEU  50          2HB       LEU  50   0.574  -5.156   0.657
  355   2HB   LEU  50          1HB       LEU  50  -0.657  -4.203  -0.172
  356    HG   LEU  50           HG       LEU  50   0.177  -7.040  -0.842
  357   1HD1  LEU  50          1HD1      LEU  50  -2.220  -7.505  -0.275
  358   2HD1  LEU  50          2HD1      LEU  50  -2.365  -5.837   0.278
  359   3HD1  LEU  50          3HD1      LEU  50  -1.266  -6.945   1.099
  360   1HD2  LEU  50          1HD2      LEU  50  -0.637  -6.677  -2.907
  361   2HD2  LEU  50          2HD2      LEU  50  -0.946  -4.990  -2.494
  362   3HD2  LEU  50          3HD2      LEU  50  -2.186  -6.211  -2.202
  363    H    GLY  51           H        GLY  51   3.247  -4.858   0.071
  364   1HA   GLY  51          2HA       GLY  51   3.487  -2.238   1.264
  365   2HA   GLY  51          1HA       GLY  51   4.763  -3.459   1.220
  366    H    ARG  52           H        ARG  52   4.362  -3.655  -1.734
  367    HA   ARG  52           HA       ARG  52   6.054  -1.327  -2.483
  368   1HB   ARG  52          2HB       ARG  52   5.938  -4.157  -3.054
  369   2HB   ARG  52          1HB       ARG  52   5.875  -3.232  -4.554
  370   1HG   ARG  52          2HG       ARG  52   7.947  -2.200  -4.156
  371   2HG   ARG  52          1HG       ARG  52   7.891  -2.543  -2.427
  372   1HD   ARG  52          2HD       ARG  52   7.932  -4.845  -4.365
  373   2HD   ARG  52          1HD       ARG  52   9.447  -4.011  -3.965
  374    HE   ARG  52           HE       ARG  52   7.637  -5.225  -1.910
  375   1HH1  ARG  52          1HH2      ARG  52  10.243  -6.521  -2.867
  376   2HH1  ARG  52          2HH2      ARG  52  11.322  -6.060  -1.593
  377   1HH2  ARG  52          2HH1      ARG  52   9.216  -3.604  -0.343
  378   2HH2  ARG  52          1HH1      ARG  52  10.740  -4.406  -0.162
  379    H    VAL  53           H        VAL  53   3.116  -3.115  -3.451
  380    HA   VAL  53           HA       VAL  53   2.523  -1.635  -5.802
  381    HB   VAL  53           HB       VAL  53   0.963  -3.146  -3.726
  382   1HG1  VAL  53          1HG1      VAL  53  -0.356  -2.107  -6.229
  383   2HG1  VAL  53          2HG1      VAL  53  -0.389  -1.153  -4.747
  384   3HG1  VAL  53          3HG1      VAL  53  -1.105  -2.758  -4.773
  385   1HG2  VAL  53          1HG2      VAL  53   0.995  -3.708  -6.665
  386   2HG2  VAL  53          2HG2      VAL  53   0.995  -4.833  -5.303
  387   3HG2  VAL  53          3HG2      VAL  53   2.480  -3.987  -5.748
  388    H    TRP  54           H        TRP  54   1.593  -0.982  -2.400
  389    HA   TRP  54           HA       TRP  54   0.103   1.396  -2.983
  390   1HB   TRP  54          2HB       TRP  54  -0.177   0.455  -0.826
  391   2HB   TRP  54          1HB       TRP  54   1.564   0.309  -0.570
  392    HD1  TRP  54           HD1      TRP  54   2.941   2.618  -0.238
  393    HE1  TRP  54           HE1      TRP  54   2.211   4.874   0.745
  394    HE3  TRP  54           HE3      TRP  54  -2.126   2.056  -0.428
  395    HZ2  TRP  54           HZ2      TRP  54  -0.216   6.257   1.398
  396    HZ3  TRP  54           HZ3      TRP  54  -3.623   3.859   0.378
  397    HH2  TRP  54           HH2      TRP  54  -2.673   5.947   1.292
  398    H    GLU  55           H        GLU  55   3.490   0.998  -1.845
  399    HA   GLU  55           HA       GLU  55   4.239   3.717  -1.934
  400   1HB   GLU  55          2HB       GLU  55   5.859   1.248  -2.626
  401   2HB   GLU  55          1HB       GLU  55   6.515   2.803  -2.109
  402   1HG   GLU  55          2HG       GLU  55   5.209   2.575   0.018
  403   2HG   GLU  55          1HG       GLU  55   4.758   0.950  -0.492
  404    H    LEU  56           H        LEU  56   4.480   1.251  -4.492
  405    HA   LEU  56           HA       LEU  56   5.498   2.988  -6.531
  406   1HB   LEU  56          2HB       LEU  56   3.711   0.537  -6.754
  407   2HB   LEU  56          1HB       LEU  56   4.787   1.157  -8.006
  408    HG   LEU  56           HG       LEU  56   5.959   0.515  -5.325
  409   1HD1  LEU  56          1HD1      LEU  56   6.083  -1.801  -5.731
  410   2HD1  LEU  56          2HD1      LEU  56   5.651  -1.619  -7.431
  411   3HD1  LEU  56          3HD1      LEU  56   4.425  -1.406  -6.181
  412   1HD2  LEU  56          1HD2      LEU  56   6.860   0.369  -8.208
  413   2HD2  LEU  56          2HD2      LEU  56   7.845  -0.196  -6.858
  414   3HD2  LEU  56          3HD2      LEU  56   7.409   1.510  -6.980
  415    H    SER  57           H        SER  57   2.365   2.527  -5.118
  416    HA   SER  57           HA       SER  57   0.908   3.921  -7.285
  417   1HB   SER  57          2HB       SER  57  -0.084   2.008  -6.111
  418   2HB   SER  57          1HB       SER  57   0.129   2.822  -4.563
  419    HG   SER  57           HG       SER  57  -1.320   3.991  -6.691
  420    H    ASP  58           H        ASP  58   2.224   4.502  -4.077
  421    HA   ASP  58           HA       ASP  58   0.895   7.043  -3.614
  422   1HB   ASP  58          2HB       ASP  58   2.467   5.164  -2.231
  423   2HB   ASP  58          1HB       ASP  58   3.431   6.642  -2.247
  424    H    ILE  59           H        ILE  59   1.431   8.015  -5.793
  425    HA   ILE  59           HA       ILE  59   4.082   8.532  -6.693
  426    HB   ILE  59           HB       ILE  59   1.549  10.183  -6.976
  427   1HG1  ILE  59          2HG1      ILE  59   1.352   7.750  -7.621
  428   2HG1  ILE  59          1HG1      ILE  59   1.104   8.866  -8.960
  429   1HG2  ILE  59          1HG2      ILE  59   2.667  10.808  -9.173
  430   2HG2  ILE  59          2HG2      ILE  59   4.138  10.073  -8.536
  431   3HG2  ILE  59          3HG2      ILE  59   3.427  11.467  -7.723
  432   1HD1  ILE  59          1HD1      ILE  59   3.525   8.564  -9.571
  433   2HD1  ILE  59          2HD1      ILE  59   2.562   7.092  -9.724
  434   3HD1  ILE  59          3HD1      ILE  59   3.627   7.311  -8.333
  435    H    ASP  60           H        ASP  60   1.993  10.288  -4.423
  436    HA   ASP  60           HA       ASP  60   4.158  12.296  -3.978
  437   1HB   ASP  60          2HB       ASP  60   2.298  13.527  -2.849
  438   2HB   ASP  60          1HB       ASP  60   1.916  13.116  -4.521
  439    H    HIS  61           H        HIS  61   2.572   9.573  -2.513
  440    HA   HIS  61           HA       HIS  61   3.078   8.437  -0.497
  441   1HB   HIS  61          2HB       HIS  61   5.166  10.580  -0.044
  442   2HB   HIS  61          1HB       HIS  61   5.194   8.902   0.489
  443    HD1  HIS  61           HD1      HIS  61   5.489   7.064  -1.437
  444    HD2  HIS  61           HD2      HIS  61   6.236  10.998  -2.596
  445    HE1  HIS  61           HE1      HIS  61   6.746   6.939  -3.633
  446    H    ASP  62           H        ASP  62   1.014  10.420  -0.545
  447    HA   ASP  62           HA       ASP  62   1.321  12.002   1.944
  448   1HB   ASP  62          2HB       ASP  62  -0.679  13.081   1.182
  449   2HB   ASP  62          1HB       ASP  62   0.276  12.779  -0.270
  450    H    GLY  63           H        GLY  63   0.774   8.863   1.448
  451   1HA   GLY  63          2HA       GLY  63  -0.106   7.256   2.948
  452   2HA   GLY  63          1HA       GLY  63  -0.795   8.569   3.900
  453    H    MET  64           H        MET  64  -1.376   8.456   0.467
  454    HA   MET  64           HA       MET  64  -3.988   7.122   0.796
  455   1HB   MET  64          2HB       MET  64  -3.795   9.980  -0.193
  456   2HB   MET  64          1HB       MET  64  -5.263   9.053   0.110
  457   1HG   MET  64          2HG       MET  64  -4.676   8.935   2.509
  458   2HG   MET  64          1HG       MET  64  -3.250   9.921   2.196
  459   1HE   MET  64          1HE       MET  64  -6.765   9.597   2.974
  460   2HE   MET  64          2HE       MET  64  -7.195   9.969   1.307
  461   3HE   MET  64          3HE       MET  64  -7.591  11.112   2.587
  462    H    LEU  65           H        LEU  65  -5.036   6.764  -1.331
  463    HA   LEU  65           HA       LEU  65  -3.092   6.941  -3.612
  464   1HB   LEU  65          2HB       LEU  65  -5.041   4.834  -2.679
  465   2HB   LEU  65          1HB       LEU  65  -4.514   4.876  -4.361
  466    HG   LEU  65           HG       LEU  65  -2.784   4.540  -1.898
  467   1HD1  LEU  65          1HD1      LEU  65  -4.066   2.730  -3.652
  468   2HD1  LEU  65          2HD1      LEU  65  -2.860   2.357  -2.422
  469   3HD1  LEU  65          3HD1      LEU  65  -2.354   2.697  -4.074
  470   1HD2  LEU  65          1HD2      LEU  65  -2.106   5.325  -4.717
  471   2HD2  LEU  65          2HD2      LEU  65  -0.988   4.300  -3.817
  472   3HD2  LEU  65          3HD2      LEU  65  -1.406   5.899  -3.203
  473    H    ASP  66           H        ASP  66  -3.925   8.815  -4.630
  474    HA   ASP  66           HA       ASP  66  -6.745   9.397  -4.819
  475   1HB   ASP  66          2HB       ASP  66  -5.986  11.215  -6.214
  476   2HB   ASP  66          1HB       ASP  66  -4.777  10.988  -4.953
  477    H    ARG  67           H        ARG  67  -8.002   9.404  -6.818
  478    HA   ARG  67           HA       ARG  67  -8.446   7.074  -8.133
  479   1HB   ARG  67          2HB       ARG  67  -9.316   8.451  -9.979
  480   2HB   ARG  67          1HB       ARG  67  -9.680   9.196  -8.423
  481   1HG   ARG  67          2HG       ARG  67  -7.605  10.596  -8.692
  482   2HG   ARG  67          1HG       ARG  67  -7.448   9.951 -10.326
  483   1HD   ARG  67          2HD       ARG  67  -8.665  12.193 -10.161
  484   2HD   ARG  67          1HD       ARG  67  -9.578  10.910 -10.982
  485    HE   ARG  67           HE       ARG  67  -9.943  11.283  -8.048
  486   1HH1  ARG  67          1HH2      ARG  67 -11.186  12.812 -10.680
  487   2HH1  ARG  67          2HH2      ARG  67 -12.816  12.260 -10.492
  488   1HH2  ARG  67          2HH1      ARG  67 -12.028   9.923  -8.057
  489   2HH2  ARG  67          1HH1      ARG  67 -13.292  10.627  -9.009
  490    H    ASP  68           H        ASP  68  -5.973   9.423  -9.174
  491    HA   ASP  68           HA       ASP  68  -5.081   7.779 -11.405
  492   1HB   ASP  68          2HB       ASP  68  -4.949  10.295 -11.176
  493   2HB   ASP  68          1HB       ASP  68  -3.685  10.056  -9.969
  494    H    GLU  69           H        GLU  69  -4.005   8.298  -8.062
  495    HA   GLU  69           HA       GLU  69  -1.596   6.672  -8.380
  496   1HB   GLU  69          2HB       GLU  69  -3.160   7.864  -6.083
  497   2HB   GLU  69          1HB       GLU  69  -1.738   6.855  -5.805
  498   1HG   GLU  69          2HG       GLU  69  -0.372   8.344  -7.177
  499   2HG   GLU  69          1HG       GLU  69  -1.787   9.326  -7.552
  500    H    PHE  70           H        PHE  70  -4.840   6.217  -7.005
  501    HA   PHE  70           HA       PHE  70  -4.528   3.547  -6.064
  502   1HB   PHE  70          2HB       PHE  70  -6.405   5.311  -5.782
  503   2HB   PHE  70          1HB       PHE  70  -7.007   4.732  -7.334
  504    HD1  PHE  70           HD1      PHE  70  -6.659   4.018  -3.780
  505    HD2  PHE  70           HD2      PHE  70  -7.709   2.345  -7.593
  506    HE1  PHE  70           HE1      PHE  70  -7.775   2.125  -2.640
  507    HE2  PHE  70           HE2      PHE  70  -8.825   0.450  -6.452
  508    HZ   PHE  70           HZ       PHE  70  -8.861   0.344  -3.973
  509    H    ALA  71           H        ALA  71  -4.743   4.899  -9.261
  510    HA   ALA  71           HA       ALA  71  -5.677   2.499 -10.624
  511   1HB   ALA  71          1HB       ALA  71  -3.987   4.707 -11.799
  512   2HB   ALA  71          2HB       ALA  71  -5.657   5.017 -11.315
  513   3HB   ALA  71          3HB       ALA  71  -5.308   3.815 -12.559
  514    H    VAL  72           H        VAL  72  -2.514   4.069 -10.258
  515    HA   VAL  72           HA       VAL  72  -0.920   2.165 -11.620
  516    HB   VAL  72           HB       VAL  72  -0.442   4.031  -9.278
  517   1HG1  VAL  72          1HG1      VAL  72   1.328   2.042 -10.540
  518   2HG1  VAL  72          2HG1      VAL  72   1.473   2.852  -8.981
  519   3HG1  VAL  72          3HG1      VAL  72   2.009   3.667 -10.449
  520   1HG2  VAL  72          1HG2      VAL  72   0.550   5.477 -10.997
  521   2HG2  VAL  72          2HG2      VAL  72  -1.099   5.038 -11.465
  522   3HG2  VAL  72          3HG2      VAL  72   0.278   4.234 -12.221
  523    H    ALA  73           H        ALA  73  -2.386   2.072  -8.436
  524    HA   ALA  73           HA       ALA  73  -0.696  -0.159  -7.499
  525   1HB   ALA  73          1HB       ALA  73  -2.343   1.899  -6.422
  526   2HB   ALA  73          2HB       ALA  73  -1.337   0.750  -5.539
  527   3HB   ALA  73          3HB       ALA  73  -3.020   0.359  -5.892
  528    H    MET  74           H        MET  74  -3.523   0.126  -9.405
  529    HA   MET  74           HA       MET  74  -4.763  -2.374  -8.448
  530   1HB   MET  74          2HB       MET  74  -5.299  -0.570 -10.831
  531   2HB   MET  74          1HB       MET  74  -6.362  -1.863 -10.276
  532   1HG   MET  74          2HG       MET  74  -5.595   0.002  -8.145
  533   2HG   MET  74          1HG       MET  74  -6.501   0.768  -9.451
  534   1HE   MET  74          1HE       MET  74  -7.495  -1.465  -6.025
  535   2HE   MET  74          2HE       MET  74  -5.999  -1.628  -6.939
  536   3HE   MET  74          3HE       MET  74  -7.246  -2.866  -7.075
  537    H    PHE  75           H        PHE  75  -2.945  -1.289 -11.323
  538    HA   PHE  75           HA       PHE  75  -3.038  -3.953 -12.520
  539   1HB   PHE  75          2HB       PHE  75  -1.962  -2.905 -14.314
  540   2HB   PHE  75          1HB       PHE  75  -2.783  -1.539 -13.566
  541    HD1  PHE  75           HD1      PHE  75   0.469  -3.275 -13.937
  542    HD2  PHE  75           HD2      PHE  75  -1.563   0.208 -12.466
  543    HE1  PHE  75           HE1      PHE  75   2.651  -2.146 -13.600
  544    HE2  PHE  75           HE2      PHE  75   0.612   1.335 -12.132
  545    HZ   PHE  75           HZ       PHE  75   2.725   0.163 -12.700
  546    H    LEU  76           H        LEU  76  -0.987  -2.165 -10.340
  547    HA   LEU  76           HA       LEU  76   1.365  -3.837 -10.524
  548   1HB   LEU  76          2HB       LEU  76   0.196  -1.819  -8.631
  549   2HB   LEU  76          1HB       LEU  76   1.597  -2.764  -8.122
  550    HG   LEU  76           HG       LEU  76   1.422  -1.060 -10.622
  551   1HD1  LEU  76          1HD1      LEU  76   3.357  -0.659  -8.364
  552   2HD1  LEU  76          2HD1      LEU  76   1.710  -0.049  -8.201
  553   3HD1  LEU  76          3HD1      LEU  76   2.735   0.518  -9.521
  554   1HD2  LEU  76          1HD2      LEU  76   3.462  -3.000  -9.558
  555   2HD2  LEU  76          2HD2      LEU  76   3.985  -1.618 -10.522
  556   3HD2  LEU  76          3HD2      LEU  76   2.875  -2.803 -11.210
  557    H    VAL  77           H        VAL  77  -1.734  -4.093  -8.996
  558    HA   VAL  77           HA       VAL  77  -0.887  -6.288  -7.201
  559    HB   VAL  77           HB       VAL  77  -3.465  -4.768  -7.739
  560   1HG1  VAL  77          1HG1      VAL  77  -2.892  -7.162  -5.989
  561   2HG1  VAL  77          2HG1      VAL  77  -4.274  -6.873  -7.046
  562   3HG1  VAL  77          3HG1      VAL  77  -4.127  -5.991  -5.525
  563   1HG2  VAL  77          1HG2      VAL  77  -3.052  -3.828  -5.534
  564   2HG2  VAL  77          2HG2      VAL  77  -1.604  -3.613  -6.519
  565   3HG2  VAL  77          3HG2      VAL  77  -1.663  -4.888  -5.301
  566    H    TYR  78           H        TYR  78  -3.528  -5.829  -9.561
  567    HA   TYR  78           HA       TYR  78  -4.282  -8.456  -9.938
  568   1HB   TYR  78          2HB       TYR  78  -4.274  -5.950 -11.499
  569   2HB   TYR  78          1HB       TYR  78  -4.526  -7.418 -12.445
  570    HD1  TYR  78           HD1      TYR  78  -6.335  -4.931 -11.061
  571    HD2  TYR  78           HD2      TYR  78  -5.992  -9.204 -10.769
  572    HE1  TYR  78           HE1      TYR  78  -8.670  -5.059 -10.237
  573    HE2  TYR  78           HE2      TYR  78  -8.331  -9.332  -9.945
  574    HH   TYR  78           HH       TYR  78 -10.421  -7.923 -10.110
  575    H    CYS  79           H        CYS  79  -1.349  -6.940 -11.167
  576    HA   CYS  79           HA       CYS  79  -0.767  -9.105 -13.054
  577   1HB   CYS  79          2HB       CYS  79   0.449  -6.568 -12.072
  578   2HB   CYS  79          1HB       CYS  79   1.554  -7.759 -12.753
  579    HG   CYS  79           HG       CYS  79  -0.755  -7.458 -14.634
  580    H    ALA  80           H        ALA  80  -0.370  -8.578  -9.668
  581    HA   ALA  80           HA       ALA  80   1.957 -10.340  -9.380
  582   1HB   ALA  80          1HB       ALA  80   0.239  -8.570  -7.745
  583   2HB   ALA  80          2HB       ALA  80   1.984  -8.814  -7.675
  584   3HB   ALA  80          3HB       ALA  80   0.900  -9.961  -6.887
  585    H    LEU  81           H        LEU  81  -1.431 -10.675  -9.661
  586    HA   LEU  81           HA       LEU  81  -1.561 -13.206  -8.145
  587   1HB   LEU  81          2HB       LEU  81  -3.538 -11.579  -9.765
  588   2HB   LEU  81          1HB       LEU  81  -3.960 -13.077  -8.932
  589    HG   LEU  81           HG       LEU  81  -2.952 -11.963  -6.835
  590   1HD1  LEU  81          1HD1      LEU  81  -3.174  -9.658  -8.750
  591   2HD1  LEU  81          2HD1      LEU  81  -1.817 -10.109  -7.718
  592   3HD1  LEU  81          3HD1      LEU  81  -3.273  -9.414  -7.005
  593   1HD2  LEU  81          1HD2      LEU  81  -5.469 -10.785  -8.052
  594   2HD2  LEU  81          2HD2      LEU  81  -5.083 -10.864  -6.333
  595   3HD2  LEU  81          3HD2      LEU  81  -5.386 -12.347  -7.239
  596    H    GLU  82           H        GLU  82  -1.816 -12.026 -11.474
  597    HA   GLU  82           HA       GLU  82  -2.245 -14.603 -12.687
  598   1HB   GLU  82          2HB       GLU  82  -2.861 -12.543 -13.793
  599   2HB   GLU  82          1HB       GLU  82  -1.213 -11.931 -13.671
  600   1HG   GLU  82          2HG       GLU  82  -0.680 -12.908 -15.621
  601   2HG   GLU  82          1HG       GLU  82  -1.130 -14.484 -14.967
  602    H    LYS  83           H        LYS  83   0.656 -12.512 -12.572
  603    HA   LYS  83           HA       LYS  83   2.472 -14.620 -11.944
  604   1HB   LYS  83          2HB       LYS  83   1.386 -14.833 -14.475
  605   2HB   LYS  83          1HB       LYS  83   2.957 -14.093 -14.771
  606   1HG   LYS  83          2HG       LYS  83   3.920 -16.107 -14.504
  607   2HG   LYS  83          1HG       LYS  83   3.364 -16.118 -12.830
  608   1HD   LYS  83          2HD       LYS  83   1.554 -17.457 -13.294
  609   2HD   LYS  83          1HD       LYS  83   1.356 -16.805 -14.921
  610   1HE   LYS  83          2HE       LYS  83   3.902 -18.192 -14.682
  611   2HE   LYS  83          1HE       LYS  83   2.547 -19.260 -14.262
  612   1HZ   LYS  83          1HZ       LYS  83   1.471 -18.811 -16.271
  613   2HZ   LYS  83          2HZ       LYS  83   3.096 -19.019 -16.723
  614   3HZ   LYS  83          3HZ       LYS  83   2.436 -17.457 -16.604
  615    H    GLU  84           H        GLU  84   1.920 -11.462 -13.354
  616    HA   GLU  84           HA       GLU  84   4.741 -10.725 -13.506
  617   1HB   GLU  84          2HB       GLU  84   3.168  -9.743 -15.014
  618   2HB   GLU  84          1HB       GLU  84   2.098  -9.269 -13.695
  619   1HG   GLU  84          2HG       GLU  84   3.467  -7.504 -13.038
  620   2HG   GLU  84          1HG       GLU  84   4.915  -8.241 -13.725
  621    HA   PRO  85           HA       PRO  85   4.808  -9.821  -9.101
  622   1HB   PRO  85          2HB       PRO  85   7.512  -9.412  -8.985
  623   2HB   PRO  85          1HB       PRO  85   6.780 -11.029  -8.984
  624   1HG   PRO  85          2HG       PRO  85   8.057  -9.530 -11.215
  625   2HG   PRO  85          1HG       PRO  85   8.127 -11.256 -10.828
  626   1HD   PRO  85          2HD       PRO  85   6.542 -10.212 -12.789
  627   2HD   PRO  85          1HD       PRO  85   6.168 -11.714 -11.916
  628    H    VAL  86           H        VAL  86   6.351  -7.883  -8.005
  629    HA   VAL  86           HA       VAL  86   5.726  -5.441  -9.634
  630    HB   VAL  86           HB       VAL  86   5.817  -5.991  -6.650
  631   1HG1  VAL  86          1HG1      VAL  86   6.664  -3.695  -7.380
  632   2HG1  VAL  86          2HG1      VAL  86   5.291  -3.692  -6.274
  633   3HG1  VAL  86          3HG1      VAL  86   5.039  -3.396  -7.994
  634   1HG2  VAL  86          1HG2      VAL  86   3.707  -5.820  -8.724
  635   2HG2  VAL  86          2HG2      VAL  86   3.357  -4.971  -7.218
  636   3HG2  VAL  86          3HG2      VAL  86   3.714  -6.698  -7.195
  637    HA   PRO  87           HA       PRO  87  10.051  -4.681  -9.458
  638   1HB   PRO  87          2HB       PRO  87  10.070  -2.011 -10.047
  639   2HB   PRO  87          1HB       PRO  87   9.738  -3.264 -11.260
  640   1HG   PRO  87          2HG       PRO  87   7.872  -1.440  -9.868
  641   2HG   PRO  87          1HG       PRO  87   7.785  -2.125 -11.497
  642   1HD   PRO  87          2HD       PRO  87   6.352  -3.015  -9.287
  643   2HD   PRO  87          1HD       PRO  87   6.613  -3.930 -10.786
  644    H    MET  88           H        MET  88  11.287  -2.333  -8.590
  645    HA   MET  88           HA       MET  88  10.577  -2.372  -5.684
  646   1HB   MET  88          2HB       MET  88  12.777  -3.211  -6.181
  647   2HB   MET  88          1HB       MET  88  13.124  -1.837  -7.233
  648   1HG   MET  88          2HG       MET  88  13.116  -0.315  -5.355
  649   2HG   MET  88          1HG       MET  88  12.547  -1.582  -4.269
  650   1HE   MET  88          1HE       MET  88  14.599  -1.045  -2.581
  651   2HE   MET  88          2HE       MET  88  15.616  -2.482  -2.627
  652   3HE   MET  88          3HE       MET  88  13.867  -2.643  -2.780
  653    H    SER  89           H        SER  89  10.160  -0.388  -8.358
  654    HA   SER  89           HA       SER  89   9.503   1.897  -6.700
  655   1HB   SER  89          2HB       SER  89  11.885   2.107  -6.585
  656   2HB   SER  89          1HB       SER  89  12.038   1.818  -8.315
  657    HG   SER  89           HG       SER  89  10.705   4.024  -7.117
  658    H    LEU  90           H        LEU  90   8.530   0.265  -8.923
  659    HA   LEU  90           HA       LEU  90   7.370   0.435 -10.960
  660   1HB   LEU  90          2HB       LEU  90   5.623   1.818 -10.525
  661   2HB   LEU  90          1HB       LEU  90   6.428   1.995  -8.969
  662    HG   LEU  90           HG       LEU  90   7.719   3.893 -10.041
  663   1HD1  LEU  90          1HD1      LEU  90   5.518   4.380 -11.906
  664   2HD1  LEU  90          2HD1      LEU  90   6.427   2.905 -12.277
  665   3HD1  LEU  90          3HD1      LEU  90   7.260   4.462 -12.185
  666   1HD2  LEU  90          1HD2      LEU  90   6.264   5.060  -8.760
  667   2HD2  LEU  90          2HD2      LEU  90   5.076   3.767  -8.913
  668   3HD2  LEU  90          3HD2      LEU  90   5.125   5.063 -10.106
  669    HA   PRO  91           HA       PRO  91  10.343   2.282 -13.684
  670   1HB   PRO  91          2HB       PRO  91   9.160   1.416 -16.005
  671   2HB   PRO  91          1HB       PRO  91  10.171   0.379 -14.978
  672   1HG   PRO  91          2HG       PRO  91   7.197   0.572 -15.122
  673   2HG   PRO  91          1HG       PRO  91   8.229  -0.863 -14.991
  674   1HD   PRO  91          2HD       PRO  91   6.934   0.172 -12.863
  675   2HD   PRO  91          1HD       PRO  91   8.524  -0.612 -12.715
  676    HA   PRO  92           HA       PRO  92   8.493   6.037 -14.973
  677   1HB   PRO  92          2HB       PRO  92   9.781   6.537 -17.330
  678   2HB   PRO  92          1HB       PRO  92  10.565   6.694 -15.746
  679   1HG   PRO  92          2HG       PRO  92  10.705   4.466 -17.718
  680   2HG   PRO  92          1HG       PRO  92  11.992   5.179 -16.730
  681   1HD   PRO  92          2HD       PRO  92  10.794   2.838 -16.097
  682   2HD   PRO  92          1HD       PRO  92  11.422   3.960 -14.867
  683    H    ALA  93           H        ALA  93   7.939   3.213 -16.694
  684    HA   ALA  93           HA       ALA  93   6.522   4.303 -18.986
  685   1HB   ALA  93          1HB       ALA  93   6.066   2.002 -19.437
  686   2HB   ALA  93          2HB       ALA  93   6.234   1.561 -17.736
  687   3HB   ALA  93          3HB       ALA  93   7.657   2.012 -18.677
  688    H    LEU  94           H        LEU  94   5.831   4.193 -15.692
  689    HA   LEU  94           HA       LEU  94   2.964   4.598 -16.299
  690   1HB   LEU  94          2HB       LEU  94   2.258   2.840 -14.980
  691   2HB   LEU  94          1HB       LEU  94   3.799   2.194 -15.526
  692    HG   LEU  94           HG       LEU  94   4.441   3.676 -13.240
  693   1HD1  LEU  94          1HD1      LEU  94   1.721   2.451 -13.115
  694   2HD1  LEU  94          2HD1      LEU  94   2.352   3.860 -12.262
  695   3HD1  LEU  94          3HD1      LEU  94   2.768   2.239 -11.711
  696   1HD2  LEU  94          1HD2      LEU  94   5.566   1.652 -13.677
  697   2HD2  LEU  94          2HD2      LEU  94   4.059   0.757 -13.880
  698   3HD2  LEU  94          3HD2      LEU  94   4.573   1.266 -12.271
  699    H    VAL  95           H        VAL  95   4.875   6.599 -15.690
  700    HA   VAL  95           HA       VAL  95   4.072   7.378 -12.902
  701    HB   VAL  95           HB       VAL  95   6.531   8.111 -14.524
  702   1HG1  VAL  95          1HG1      VAL  95   7.177   8.670 -11.977
  703   2HG1  VAL  95          2HG1      VAL  95   5.438   8.943 -11.878
  704   3HG1  VAL  95          3HG1      VAL  95   6.410   9.859 -13.030
  705   1HG2  VAL  95          1HG2      VAL  95   6.509   6.409 -12.045
  706   2HG2  VAL  95          2HG2      VAL  95   7.714   6.483 -13.330
  707   3HG2  VAL  95          3HG2      VAL  95   6.172   5.676 -13.614
  708    HA   PRO  96           HA       PRO  96   2.005  10.704 -15.015
  709   1HB   PRO  96          2HB       PRO  96   1.378  12.154 -12.772
  710   2HB   PRO  96          1HB       PRO  96   0.486  10.701 -13.266
  711   1HG   PRO  96          2HG       PRO  96   2.626  11.000 -11.210
  712   2HG   PRO  96          1HG       PRO  96   1.129  10.055 -11.148
  713   1HD   PRO  96          2HD       PRO  96   3.541   8.934 -11.650
  714   2HD   PRO  96          1HD       PRO  96   2.027   8.301 -12.340
  715    HA   PRO  97           HA       PRO  97   4.926  13.976 -15.246
  716   1HB   PRO  97          2HB       PRO  97   3.421  16.265 -15.131
  717   2HB   PRO  97          1HB       PRO  97   3.448  15.193 -16.545
  718   1HG   PRO  97          2HG       PRO  97   1.435  15.383 -14.355
  719   2HG   PRO  97          1HG       PRO  97   1.188  15.171 -16.094
  720   1HD   PRO  97          2HD       PRO  97   1.021  13.120 -14.334
  721   2HD   PRO  97          1HD       PRO  97   1.579  12.904 -16.010
  722    H    SER  98           H        SER  98   5.635  16.120 -14.093
  723    HA   SER  98           HA       SER  98   6.158  17.285 -12.106
  724   1HB   SER  98          2HB       SER  98   3.546  16.577 -11.809
  725   2HB   SER  98          1HB       SER  98   4.268  15.704 -10.459
  726    HG   SER  98           HG       SER  98   5.400  17.955 -10.272
  727    H    LYS  99           H        LYS  99   5.420  13.848 -11.505
  728    HA   LYS  99           HA       LYS  99   7.729  13.642  -9.679
  729   1HB   LYS  99          2HB       LYS  99   5.230  12.394 -10.030
  730   2HB   LYS  99          1HB       LYS  99   6.416  11.167 -10.477
  731   1HG   LYS  99          2HG       LYS  99   6.646  12.797  -7.940
  732   2HG   LYS  99          1HG       LYS  99   5.791  11.255  -8.002
  733   1HD   LYS  99          2HD       LYS  99   8.072  10.507  -9.210
  734   2HD   LYS  99          1HD       LYS  99   8.710  11.813  -8.209
  735   1HE   LYS  99          2HE       LYS  99   7.201  10.592  -6.345
  736   2HE   LYS  99          1HE       LYS  99   7.555   9.191  -7.377
  737   1HZ   LYS  99          1HZ       LYS  99   9.296   9.675  -5.672
  738   2HZ   LYS  99          2HZ       LYS  99   9.614  11.134  -6.483
  739   3HZ   LYS  99          3HZ       LYS  99   9.869   9.649  -7.269
  740    H    ARG 100           H        ARG 100   7.603  14.000 -12.856
  741    HA   ARG 100           HA       ARG 100   9.460  11.727 -13.503
  742   1HB   ARG 100          2HB       ARG 100   8.818  12.413 -15.871
  743   2HB   ARG 100          1HB       ARG 100   7.489  11.800 -14.884
  744   1HG   ARG 100          2HG       ARG 100   6.619  13.968 -14.502
  745   2HG   ARG 100          1HG       ARG 100   8.112  14.750 -15.019
  746   1HD   ARG 100          2HD       ARG 100   6.349  14.916 -16.771
  747   2HD   ARG 100          1HD       ARG 100   7.722  13.944 -17.338
  748    HE   ARG 100           HE       ARG 100   6.210  11.995 -16.280
  749   1HH1  ARG 100          1HH2      ARG 100   5.556  14.583 -18.447
  750   2HH1  ARG 100          2HH2      ARG 100   4.069  13.907 -19.023
  751   1HH2  ARG 100          2HH1      ARG 100   4.174  11.176 -16.890
  752   2HH2  ARG 100          1HH1      ARG 100   3.286  11.979 -18.142
  753    H    SER 107           1H       SER 107   4.512   7.450   8.113
  754    HA   SER 107           HA       SER 107   3.953   4.619   8.472
  755   1HB   SER 107          2HB       SER 107   1.596   5.501   9.296
  756   2HB   SER 107          1HB       SER 107   2.896   5.245  10.456
  757    HG   SER 107           HG       SER 107   1.654   7.535   9.714
  758    H    THR 108           H        THR 108   4.619   5.795   6.135
  759    HA   THR 108           HA       THR 108   2.266   6.958   4.797
  760    HB   THR 108           HB       THR 108   3.821   7.200   2.952
  761    HG1  THR 108           HG1      THR 108   5.787   5.766   4.328
  762   1HG2  THR 108          1HG2      THR 108   4.316   8.170   5.542
  763   2HG2  THR 108          2HG2      THR 108   4.948   8.822   4.030
  764   3HG2  THR 108          3HG2      THR 108   5.885   7.636   4.938
  765    H    ASN 109           H        ASN 109   3.867   3.844   5.071
  766    HA   ASN 109           HA       ASN 109   2.083   2.707   2.961
  767   1HB   ASN 109          2HB       ASN 109   4.617   2.476   2.939
  768   2HB   ASN 109          1HB       ASN 109   4.452   1.457   4.372
  769   1HD2  ASN 109          1HD2      ASN 109   5.384   0.619   1.679
  770   2HD2  ASN 109          2HD2      ASN 109   4.307  -0.582   1.158
  771    HA   PRO 110           HA       PRO 110  -0.216   0.950   6.338
  772   1HB   PRO 110          2HB       PRO 110  -2.004  -0.438   4.806
  773   2HB   PRO 110          1HB       PRO 110  -2.106   1.314   5.064
  774   1HG   PRO 110          2HG       PRO 110  -1.125  -0.195   2.709
  775   2HG   PRO 110          1HG       PRO 110  -1.983   1.351   2.786
  776   1HD   PRO 110          2HD       PRO 110   0.734   1.073   2.373
  777   2HD   PRO 110          1HD       PRO 110  -0.056   2.543   2.980
  778    H    PHE 111           H        PHE 111   1.206  -0.906   3.682
  779    HA   PHE 111           HA       PHE 111   0.899  -3.474   5.100
  780   1HB   PHE 111          2HB       PHE 111   2.438  -2.709   2.597
  781   2HB   PHE 111          1HB       PHE 111   2.019  -4.347   3.092
  782    HD1  PHE 111           HD1      PHE 111   0.983  -1.538   1.169
  783    HD2  PHE 111           HD2      PHE 111  -0.522  -4.790   3.538
  784    HE1  PHE 111           HE1      PHE 111  -1.218  -1.329   0.056
  785    HE2  PHE 111           HE2      PHE 111  -2.723  -4.579   2.422
  786    HZ   PHE 111           HZ       PHE 111  -3.071  -2.847   0.686
  787    H    LEU 112           HN       LEU 112   2.947  -0.861   5.437
  788    HA   LEU 112           HA       LEU 112   5.237  -2.595   6.310
  789   1HB   LEU 112          2HB       LEU 112   5.078  -0.435   4.515
  790   2HB   LEU 112          1HB       LEU 112   5.819   0.233   5.970
  791    HG   LEU 112           HG       LEU 112   7.165  -2.113   5.796
  792   1HD1  LEU 112          1HD1      LEU 112   7.483  -2.853   3.626
  793   2HD1  LEU 112          2HD1      LEU 112   7.104  -1.281   2.924
  794   3HD1  LEU 112          3HD1      LEU 112   5.806  -2.317   3.516
  795   1HD2  LEU 112          1HD2      LEU 112   8.689  -0.441   5.912
  796   2HD2  LEU 112          2HD2      LEU 112   7.631   0.681   5.056
  797   3HD2  LEU 112          3HD2      LEU 112   8.653  -0.433   4.149
  Start of MODEL   15
    1    HA   PRO   6           HA       PRO   6   0.715   4.621 -24.175
    2   1HB   PRO   6          2HB       PRO   6  -0.304   2.125 -23.705
    3   2HB   PRO   6          1HB       PRO   6  -0.174   2.824 -25.332
    4   1HG   PRO   6          2HG       PRO   6   1.560   0.821 -23.988
    5   2HG   PRO   6          1HG       PRO   6   1.066   0.933 -25.685
    6   1HD   PRO   6          2HD       PRO   6   3.523   1.704 -24.743
    7   2HD   PRO   6          1HD       PRO   6   2.772   2.347 -26.218
    8    H    TRP   7           H        TRP   7  -0.574   4.264 -22.105
    9    HA   TRP   7           HA       TRP   7   1.235   4.193 -19.800
   10   1HB   TRP   7          2HB       TRP   7  -0.630   5.803 -20.063
   11   2HB   TRP   7          1HB       TRP   7  -1.780   4.469 -20.056
   12    HD1  TRP   7           HD1      TRP   7   0.910   3.676 -17.748
   13    HE1  TRP   7           HE1      TRP   7   0.238   4.149 -15.298
   14    HE3  TRP   7           HE3      TRP   7  -3.288   6.458 -18.534
   15    HZ2  TRP   7           HZ2      TRP   7  -1.826   5.531 -13.874
   16    HZ3  TRP   7           HZ3      TRP   7  -4.590   7.340 -16.621
   17    HH2  TRP   7           HH2      TRP   7  -3.867   6.880 -14.293
   18    H    ALA   8           H        ALA   8   1.751   2.290 -18.799
   19    HA   ALA   8           HA       ALA   8   0.950  -0.283 -19.311
   20   1HB   ALA   8          1HB       ALA   8   1.167   0.531 -16.442
   21   2HB   ALA   8          2HB       ALA   8   2.517   0.915 -17.510
   22   3HB   ALA   8          3HB       ALA   8   2.006  -0.760 -17.305
   23    H    VAL   9           H        VAL   9  -0.891   2.141 -17.559
   24    HA   VAL   9           HA       VAL   9  -2.972   0.181 -16.776
   25    HB   VAL   9           HB       VAL   9  -2.360   3.093 -16.266
   26   1HG1  VAL   9          1HG1      VAL   9  -4.845   2.759 -16.682
   27   2HG1  VAL   9          2HG1      VAL   9  -4.432   3.358 -15.076
   28   3HG1  VAL   9          3HG1      VAL   9  -4.849   1.658 -15.303
   29   1HG2  VAL   9          1HG2      VAL   9  -2.720   0.627 -14.535
   30   2HG2  VAL   9          2HG2      VAL   9  -2.471   2.251 -13.896
   31   3HG2  VAL   9          3HG2      VAL   9  -1.211   1.482 -14.861
   32    H    LYS  10           H        LYS  10  -4.764  -0.127 -18.070
   33    HA   LYS  10           HA       LYS  10  -5.066   1.462 -20.526
   34   1HB   LYS  10          2HB       LYS  10  -6.746  -0.776 -19.342
   35   2HB   LYS  10          1HB       LYS  10  -6.755  -0.243 -21.021
   36   1HG   LYS  10          2HG       LYS  10  -4.185  -0.752 -20.919
   37   2HG   LYS  10          1HG       LYS  10  -4.626  -1.750 -19.533
   38   1HD   LYS  10          2HD       LYS  10  -6.330  -2.896 -20.968
   39   2HD   LYS  10          1HD       LYS  10  -5.724  -1.982 -22.349
   40   1HE   LYS  10          2HE       LYS  10  -4.431  -3.904 -22.558
   41   2HE   LYS  10          1HE       LYS  10  -3.381  -2.971 -21.473
   42   1HZ   LYS  10          1HZ       LYS  10  -3.958  -5.271 -20.681
   43   2HZ   LYS  10          2HZ       LYS  10  -5.558  -4.730 -20.492
   44   3HZ   LYS  10          3HZ       LYS  10  -4.305  -4.022 -19.588
   45    HA   PRO  11           HA       PRO  11  -8.239   4.171 -19.162
   46   1HB   PRO  11          2HB       PRO  11 -10.047   4.047 -21.223
   47   2HB   PRO  11          1HB       PRO  11  -8.498   4.910 -21.346
   48   1HG   PRO  11          2HG       PRO  11  -9.239   2.188 -22.318
   49   2HG   PRO  11          1HG       PRO  11  -8.277   3.444 -23.115
   50   1HD   PRO  11          2HD       PRO  11  -7.139   1.327 -21.902
   51   2HD   PRO  11          1HD       PRO  11  -6.369   2.928 -21.924
   52    H    GLU  12           H        GLU  12  -9.155   0.975 -20.257
   53    HA   GLU  12           HA       GLU  12 -11.756   0.998 -18.866
   54   1HB   GLU  12          2HB       GLU  12 -10.343  -1.433 -19.954
   55   2HB   GLU  12          1HB       GLU  12 -12.068  -1.074 -19.942
   56   1HG   GLU  12          2HG       GLU  12  -9.942   0.186 -21.687
   57   2HG   GLU  12          1HG       GLU  12 -11.307  -0.800 -22.207
   58    H    ASP  13           H        ASP  13  -8.455   0.025 -18.289
   59    HA   ASP  13           HA       ASP  13  -9.046  -1.733 -16.029
   60   1HB   ASP  13          2HB       ASP  13  -6.709  -0.627 -17.491
   61   2HB   ASP  13          1HB       ASP  13  -6.423  -1.011 -15.794
   62    H    LYS  14           H        LYS  14  -7.961   1.607 -16.514
   63    HA   LYS  14           HA       LYS  14  -7.723   2.247 -13.715
   64   1HB   LYS  14          2HB       LYS  14  -6.752   3.419 -15.791
   65   2HB   LYS  14          1HB       LYS  14  -8.352   4.136 -15.988
   66   1HG   LYS  14          2HG       LYS  14  -7.570   4.417 -13.247
   67   2HG   LYS  14          1HG       LYS  14  -6.252   5.001 -14.266
   68   1HD   LYS  14          2HD       LYS  14  -8.176   6.203 -15.591
   69   2HD   LYS  14          1HD       LYS  14  -9.087   5.982 -14.097
   70   1HE   LYS  14          2HE       LYS  14  -6.828   6.956 -13.024
   71   2HE   LYS  14          1HE       LYS  14  -6.716   7.719 -14.622
   72   1HZ   LYS  14          1HZ       LYS  14  -8.121   8.857 -12.788
   73   2HZ   LYS  14          2HZ       LYS  14  -9.287   7.686 -13.184
   74   3HZ   LYS  14          3HZ       LYS  14  -8.734   8.773 -14.367
   75    H    ALA  15           H        ALA  15 -10.355   2.042 -15.967
   76    HA   ALA  15           HA       ALA  15 -12.265   3.738 -14.645
   77   1HB   ALA  15          1HB       ALA  15 -12.705   3.052 -16.878
   78   2HB   ALA  15          2HB       ALA  15 -13.851   2.114 -15.920
   79   3HB   ALA  15          3HB       ALA  15 -12.370   1.360 -16.510
   80    H    LYS  16           H        LYS  16 -11.477   0.279 -14.399
   81    HA   LYS  16           HA       LYS  16 -13.437  -0.275 -12.318
   82   1HB   LYS  16          2HB       LYS  16 -10.892  -1.793 -12.945
   83   2HB   LYS  16          1HB       LYS  16 -12.436  -2.445 -12.388
   84   1HG   LYS  16          2HG       LYS  16 -12.963  -1.007 -14.768
   85   2HG   LYS  16          1HG       LYS  16 -11.546  -2.007 -15.084
   86   1HD   LYS  16          2HD       LYS  16 -14.257  -2.920 -14.092
   87   2HD   LYS  16          1HD       LYS  16 -13.465  -3.362 -15.605
   88   1HE   LYS  16          2HE       LYS  16 -11.676  -4.000 -13.457
   89   2HE   LYS  16          1HE       LYS  16 -13.266  -4.695 -13.086
   90   1HZ   LYS  16          1HZ       LYS  16 -13.357  -5.749 -15.177
   91   2HZ   LYS  16          2HZ       LYS  16 -11.796  -6.070 -14.585
   92   3HZ   LYS  16          3HZ       LYS  16 -12.030  -4.878 -15.773
   93    H    TYR  17           H        TYR  17 -10.012   0.516 -12.543
   94    HA   TYR  17           HA       TYR  17  -9.329   0.302  -9.772
   95   1HB   TYR  17          2HB       TYR  17  -8.363   2.210 -11.940
   96   2HB   TYR  17          1HB       TYR  17  -7.502   1.848 -10.447
   97    HD1  TYR  17           HD1      TYR  17  -9.081  -1.144 -11.381
   98    HD2  TYR  17           HD2      TYR  17  -5.800   1.402 -12.497
   99    HE1  TYR  17           HE1      TYR  17  -7.972  -3.055 -12.493
  100    HE2  TYR  17           HE2      TYR  17  -4.675  -0.517 -13.592
  101    HH   TYR  17           HH       TYR  17  -5.289  -2.685 -14.571
  102    H    ASP  18           H        ASP  18 -11.215   2.506 -11.672
  103    HA   ASP  18           HA       ASP  18 -11.193   4.655  -9.617
  104   1HB   ASP  18          2HB       ASP  18 -11.705   4.336 -12.428
  105   2HB   ASP  18          1HB       ASP  18 -13.138   5.030 -11.674
  106    H    ALA  19           H        ALA  19 -12.918   1.791 -10.303
  107    HA   ALA  19           HA       ALA  19 -15.446   2.723  -9.046
  108   1HB   ALA  19          1HB       ALA  19 -16.320   0.943 -10.185
  109   2HB   ALA  19          2HB       ALA  19 -15.059  -0.142  -9.601
  110   3HB   ALA  19          3HB       ALA  19 -14.764   0.875 -11.012
  111    H    ILE  20           H        ILE  20 -12.606   0.770  -8.515
  112    HA   ILE  20           HA       ILE  20 -13.414  -0.283  -5.915
  113    HB   ILE  20           HB       ILE  20 -10.900  -0.107  -7.601
  114   1HG1  ILE  20          2HG1      ILE  20 -12.340  -2.590  -6.680
  115   2HG1  ILE  20          1HG1      ILE  20 -12.887  -1.697  -8.100
  116   1HG2  ILE  20          1HG2      ILE  20  -9.661  -1.268  -5.995
  117   2HG2  ILE  20          2HG2      ILE  20 -11.097  -1.733  -5.085
  118   3HG2  ILE  20          3HG2      ILE  20 -10.529  -0.066  -5.048
  119   1HD1  ILE  20          1HD1      ILE  20 -10.697  -1.943  -9.155
  120   2HD1  ILE  20          2HD1      ILE  20 -11.287  -3.535  -8.672
  121   3HD1  ILE  20          3HD1      ILE  20 -10.058  -2.721  -7.704
  122    H    PHE  21           H        PHE  21 -11.696   2.450  -7.264
  123    HA   PHE  21           HA       PHE  21 -10.568   3.384  -4.758
  124   1HB   PHE  21          2HB       PHE  21  -9.340   4.145  -6.551
  125   2HB   PHE  21          1HB       PHE  21 -10.742   4.173  -7.614
  126    HD1  PHE  21           HD1      PHE  21  -8.580   6.120  -5.471
  127    HD2  PHE  21           HD2      PHE  21 -12.438   6.045  -7.359
  128    HE1  PHE  21           HE1      PHE  21  -8.780   8.574  -5.163
  129    HE2  PHE  21           HE2      PHE  21 -12.637   8.496  -7.052
  130    HZ   PHE  21           HZ       PHE  21 -10.810   9.761  -5.953
  131    H    ASP  22           H        ASP  22 -13.387   4.140  -6.747
  132    HA   ASP  22           HA       ASP  22 -14.345   6.209  -4.881
  133   1HB   ASP  22          2HB       ASP  22 -14.693   6.585  -7.217
  134   2HB   ASP  22          1HB       ASP  22 -15.318   4.952  -7.459
  135    H    SER  23           H        SER  23 -14.287   2.909  -4.785
  136    HA   SER  23           HA       SER  23 -17.055   2.490  -3.818
  137   1HB   SER  23          2HB       SER  23 -14.752   0.921  -4.753
  138   2HB   SER  23          1HB       SER  23 -15.565   0.196  -3.368
  139    HG   SER  23           HG       SER  23 -17.391   0.023  -4.517
  140    H    LEU  24           H        LEU  24 -14.051   3.482  -2.620
  141    HA   LEU  24           HA       LEU  24 -14.600   2.528   0.160
  142   1HB   LEU  24          2HB       LEU  24 -12.131   3.995  -0.711
  143   2HB   LEU  24          1HB       LEU  24 -12.292   2.707   0.479
  144    HG   LEU  24           HG       LEU  24 -12.741   2.206  -2.464
  145   1HD1  LEU  24          1HD1      LEU  24 -10.185   1.271  -1.509
  146   2HD1  LEU  24          2HD1      LEU  24 -10.306   3.016  -1.286
  147   3HD1  LEU  24          3HD1      LEU  24 -10.536   2.312  -2.888
  148   1HD2  LEU  24          1HD2      LEU  24 -13.302   0.640  -0.356
  149   2HD2  LEU  24          2HD2      LEU  24 -11.591   0.247  -0.530
  150   3HD2  LEU  24          3HD2      LEU  24 -12.700  -0.027  -1.874
  151    H    SER  25           H        SER  25 -14.791   5.216  -1.906
  152    HA   SER  25           HA       SER  25 -15.765   7.355  -1.413
  153   1HB   SER  25          2HB       SER  25 -16.360   6.130   0.826
  154   2HB   SER  25          1HB       SER  25 -14.988   7.029   1.462
  155    HG   SER  25           HG       SER  25 -16.683   8.374   1.719
  156    HA   PRO  26           HA       PRO  26 -11.470   8.724  -1.653
  157   1HB   PRO  26          2HB       PRO  26 -11.929  10.421  -3.740
  158   2HB   PRO  26          1HB       PRO  26 -11.659   8.680  -3.953
  159   1HG   PRO  26          2HG       PRO  26 -14.195  10.220  -4.002
  160   2HG   PRO  26          1HG       PRO  26 -13.707   8.815  -4.961
  161   1HD   PRO  26          2HD       PRO  26 -15.390   8.704  -2.780
  162   2HD   PRO  26          1HD       PRO  26 -14.432   7.336  -3.381
  163    H    VAL  27           H        VAL  27 -10.553  10.737  -1.058
  164    HA   VAL  27           HA       VAL  27 -12.496  12.778  -0.032
  165    HB   VAL  27           HB       VAL  27  -9.701  12.068   0.923
  166   1HG1  VAL  27          1HG1      VAL  27 -11.905  13.635   2.289
  167   2HG1  VAL  27          2HG1      VAL  27 -10.568  14.381   1.415
  168   3HG1  VAL  27          3HG1      VAL  27 -10.249  13.416   2.856
  169   1HG2  VAL  27          1HG2      VAL  27 -10.619  10.306   1.986
  170   2HG2  VAL  27          2HG2      VAL  27 -12.178  10.667   1.243
  171   3HG2  VAL  27          3HG2      VAL  27 -11.752  11.387   2.798
  172    H    ASN  28           H        ASN  28 -12.461  14.388  -1.590
  173    HA   ASN  28           HA       ASN  28 -11.592  16.074  -2.995
  174   1HB   ASN  28          2HB       ASN  28 -10.491  16.901  -1.053
  175   2HB   ASN  28          1HB       ASN  28  -9.367  15.548  -1.013
  176   1HD2  ASN  28          1HD2      ASN  28  -7.327  16.031  -1.836
  177   2HD2  ASN  28          2HD2      ASN  28  -6.996  17.250  -2.970
  178    H    GLY  29           H        GLY  29 -10.986  12.989  -3.321
  179   1HA   GLY  29          2HA       GLY  29 -10.308  12.059  -5.469
  180   2HA   GLY  29          1HA       GLY  29  -9.152  13.382  -5.632
  181    H    PHE  30           H        PHE  30  -9.551  11.521  -2.652
  182    HA   PHE  30           HA       PHE  30  -7.016  10.062  -3.235
  183   1HB   PHE  30          2HB       PHE  30  -7.564  11.972  -0.953
  184   2HB   PHE  30          1HB       PHE  30  -6.203  10.841  -0.958
  185    HD1  PHE  30           HD1      PHE  30  -7.518  13.966  -2.249
  186    HD2  PHE  30           HD2      PHE  30  -4.514  10.951  -2.807
  187    HE1  PHE  30           HE1      PHE  30  -6.231  15.522  -3.678
  188    HE2  PHE  30           HE2      PHE  30  -3.216  12.512  -4.241
  189    HZ   PHE  30           HZ       PHE  30  -4.075  14.798  -4.676
  190    H    LEU  31           H        LEU  31  -6.728   8.189  -2.026
  191    HA   LEU  31           HA       LEU  31  -9.055   7.335  -0.324
  192   1HB   LEU  31          2HB       LEU  31  -7.297   5.946  -2.337
  193   2HB   LEU  31          1HB       LEU  31  -8.022   5.007  -1.033
  194    HG   LEU  31           HG       LEU  31  -9.428   6.572  -3.198
  195   1HD1  LEU  31          1HD1      LEU  31  -9.018   3.738  -2.383
  196   2HD1  LEU  31          2HD1      LEU  31  -9.134   4.435  -4.003
  197   3HD1  LEU  31          3HD1      LEU  31 -10.596   4.161  -3.053
  198   1HD2  LEU  31          1HD2      LEU  31 -10.663   7.122  -1.214
  199   2HD2  LEU  31          2HD2      LEU  31 -10.489   5.489  -0.573
  200   3HD2  LEU  31          3HD2      LEU  31 -11.530   5.784  -1.968
  201    H    SER  32           H        SER  32  -8.479   6.590   1.736
  202    HA   SER  32           HA       SER  32  -5.677   7.024   2.524
  203   1HB   SER  32          2HB       SER  32  -6.699   6.432   4.794
  204   2HB   SER  32          1HB       SER  32  -7.386   7.844   3.996
  205    HG   SER  32           HG       SER  32  -9.214   6.825   3.879
  206    H    GLY  33           H        GLY  33  -4.238   5.431   3.089
  207   1HA   GLY  33          2HA       GLY  33  -4.235   2.917   1.958
  208   2HA   GLY  33          1HA       GLY  33  -3.439   3.236   3.501
  209    H    ASP  34           H        ASP  34  -6.080   3.968   4.737
  210    HA   ASP  34           HA       ASP  34  -6.775   1.449   5.872
  211   1HB   ASP  34          2HB       ASP  34  -7.178   3.631   6.920
  212   2HB   ASP  34          1HB       ASP  34  -8.290   4.069   5.622
  213    H    LYS  35           H        LYS  35  -7.921   3.142   3.005
  214    HA   LYS  35           HA       LYS  35 -10.141   1.215   2.622
  215   1HB   LYS  35          2HB       LYS  35  -9.149   3.736   1.265
  216   2HB   LYS  35          1HB       LYS  35 -10.471   2.774   0.606
  217   1HG   LYS  35          2HG       LYS  35 -11.800   3.100   2.593
  218   2HG   LYS  35          1HG       LYS  35 -10.441   3.846   3.438
  219   1HD   LYS  35          2HD       LYS  35 -10.450   5.622   1.605
  220   2HD   LYS  35          1HD       LYS  35 -12.003   4.959   1.098
  221   1HE   LYS  35          2HE       LYS  35 -11.317   6.230   3.766
  222   2HE   LYS  35          1HE       LYS  35 -12.565   6.729   2.605
  223   1HZ   LYS  35          1HZ       LYS  35 -13.397   4.321   2.913
  224   2HZ   LYS  35          2HZ       LYS  35 -13.769   5.471   4.105
  225   3HZ   LYS  35          3HZ       LYS  35 -12.510   4.358   4.358
  226    H    VAL  36           H        VAL  36  -6.990   2.150   1.351
  227    HA   VAL  36           HA       VAL  36  -7.107   0.328  -0.940
  228    HB   VAL  36           HB       VAL  36  -4.852   1.816   0.430
  229   1HG1  VAL  36          1HG1      VAL  36  -5.042   0.470  -2.275
  230   2HG1  VAL  36          2HG1      VAL  36  -3.982   0.021  -0.940
  231   3HG1  VAL  36          3HG1      VAL  36  -3.732   1.542  -1.788
  232   1HG2  VAL  36          1HG2      VAL  36  -6.888   2.526  -1.651
  233   2HG2  VAL  36          2HG2      VAL  36  -5.272   3.224  -1.774
  234   3HG2  VAL  36          3HG2      VAL  36  -6.248   3.509  -0.333
  235    H    LYS  37           H        LYS  37  -5.455   0.338   2.234
  236    HA   LYS  37           HA       LYS  37  -3.852  -1.876   2.144
  237   1HB   LYS  37          2HB       LYS  37  -4.101  -0.575   4.142
  238   2HB   LYS  37          1HB       LYS  37  -5.808  -0.992   4.277
  239   1HG   LYS  37          2HG       LYS  37  -5.316  -3.258   4.833
  240   2HG   LYS  37          1HG       LYS  37  -3.632  -3.088   4.337
  241   1HD   LYS  37          2HD       LYS  37  -3.248  -1.492   6.183
  242   2HD   LYS  37          1HD       LYS  37  -4.930  -1.671   6.684
  243   1HE   LYS  37          2HE       LYS  37  -4.538  -3.687   7.686
  244   2HE   LYS  37          1HE       LYS  37  -3.461  -4.226   6.382
  245   1HZ   LYS  37          1HZ       LYS  37  -1.879  -2.458   7.244
  246   2HZ   LYS  37          2HZ       LYS  37  -2.051  -3.854   8.198
  247   3HZ   LYS  37          3HZ       LYS  37  -2.839  -2.417   8.642
  248    HA   PRO  38           HA       PRO  38  -7.509  -4.927   2.845
  249   1HB   PRO  38          2HB       PRO  38 -10.028  -3.970   2.318
  250   2HB   PRO  38          1HB       PRO  38  -9.299  -3.934   3.937
  251   1HG   PRO  38          2HG       PRO  38  -9.481  -1.760   1.898
  252   2HG   PRO  38          1HG       PRO  38  -9.756  -1.688   3.647
  253   1HD   PRO  38          2HD       PRO  38  -7.461  -0.836   2.548
  254   2HD   PRO  38          1HD       PRO  38  -7.500  -1.633   4.137
  255    H    VAL  39           H        VAL  39  -7.956  -2.398   0.402
  256    HA   VAL  39           HA       VAL  39  -9.057  -3.970  -1.702
  257    HB   VAL  39           HB       VAL  39  -7.498  -1.438  -1.365
  258   1HG1  VAL  39          1HG1      VAL  39  -8.160  -2.541  -4.108
  259   2HG1  VAL  39          2HG1      VAL  39  -6.540  -2.571  -3.411
  260   3HG1  VAL  39          3HG1      VAL  39  -7.329  -1.032  -3.733
  261   1HG2  VAL  39          1HG2      VAL  39  -9.704  -1.100  -3.055
  262   2HG2  VAL  39          2HG2      VAL  39  -9.639  -0.742  -1.329
  263   3HG2  VAL  39          3HG2      VAL  39 -10.222  -2.311  -1.883
  264    H    LEU  40           H        LEU  40  -5.701  -3.427  -0.669
  265    HA   LEU  40           HA       LEU  40  -4.581  -4.998  -2.882
  266   1HB   LEU  40          2HB       LEU  40  -3.297  -4.005  -0.323
  267   2HB   LEU  40          1HB       LEU  40  -2.491  -4.375  -1.845
  268    HG   LEU  40           HG       LEU  40  -4.554  -2.189  -1.483
  269   1HD1  LEU  40          1HD1      LEU  40  -2.723  -1.287  -0.384
  270   2HD1  LEU  40          2HD1      LEU  40  -2.325  -0.847  -2.047
  271   3HD1  LEU  40          3HD1      LEU  40  -1.566  -2.254  -1.301
  272   1HD2  LEU  40          1HD2      LEU  40  -3.816  -1.517  -3.742
  273   2HD2  LEU  40          2HD2      LEU  40  -4.437  -3.170  -3.756
  274   3HD2  LEU  40          3HD2      LEU  40  -2.697  -2.879  -3.784
  275    H    LEU  41           H        LEU  41  -5.488  -5.464   0.481
  276    HA   LEU  41           HA       LEU  41  -4.079  -7.968   0.853
  277   1HB   LEU  41          2HB       LEU  41  -6.346  -6.519   2.235
  278   2HB   LEU  41          1HB       LEU  41  -5.715  -8.058   2.821
  279    HG   LEU  41           HG       LEU  41  -3.844  -5.772   2.258
  280   1HD1  LEU  41          1HD1      LEU  41  -5.681  -4.979   3.778
  281   2HD1  LEU  41          2HD1      LEU  41  -4.095  -5.006   4.548
  282   3HD1  LEU  41          3HD1      LEU  41  -5.263  -6.282   4.889
  283   1HD2  LEU  41          1HD2      LEU  41  -2.322  -7.106   3.301
  284   2HD2  LEU  41          2HD2      LEU  41  -3.476  -8.398   2.967
  285   3HD2  LEU  41          3HD2      LEU  41  -3.474  -7.603   4.541
  286    H    ASN  42           H        ASN  42  -6.888  -7.040  -0.844
  287    HA   ASN  42           HA       ASN  42  -8.216  -9.649  -0.539
  288   1HB   ASN  42          2HB       ASN  42  -8.783  -6.964  -1.711
  289   2HB   ASN  42          1HB       ASN  42  -9.668  -8.336  -2.381
  290   1HD2  ASN  42          1HD2      ASN  42 -11.242  -6.538  -1.045
  291   2HD2  ASN  42          2HD2      ASN  42 -11.689  -7.127   0.482
  292    H    SER  43           H        SER  43  -5.726  -8.405  -2.403
  293    HA   SER  43           HA       SER  43  -6.373  -9.742  -4.940
  294   1HB   SER  43          2HB       SER  43  -4.289  -8.751  -5.629
  295   2HB   SER  43          1HB       SER  43  -5.086  -7.575  -4.587
  296    HG   SER  43           HG       SER  43  -2.905  -7.858  -4.004
  297    H    LYS  44           H        LYS  44  -5.628 -11.018  -2.056
  298    HA   LYS  44           HA       LYS  44  -4.753 -13.126  -1.433
  299   1HB   LYS  44          2HB       LYS  44  -5.801 -13.554  -3.787
  300   2HB   LYS  44          1HB       LYS  44  -4.130 -13.560  -4.350
  301   1HG   LYS  44          2HG       LYS  44  -3.661 -15.553  -3.346
  302   2HG   LYS  44          1HG       LYS  44  -4.638 -15.177  -1.926
  303   1HD   LYS  44          2HD       LYS  44  -6.077 -15.624  -4.502
  304   2HD   LYS  44          1HD       LYS  44  -5.395 -17.037  -3.695
  305   1HE   LYS  44          2HE       LYS  44  -6.981 -15.070  -2.064
  306   2HE   LYS  44          1HE       LYS  44  -7.837 -16.255  -3.071
  307   1HZ   LYS  44          1HZ       LYS  44  -7.270 -17.082  -0.805
  308   2HZ   LYS  44          2HZ       LYS  44  -5.626 -16.953  -1.214
  309   3HZ   LYS  44          3HZ       LYS  44  -6.633 -18.028  -2.060
  310    H    LEU  45           H        LEU  45  -3.045 -10.588  -2.530
  311    HA   LEU  45           HA       LEU  45  -0.408 -11.928  -2.771
  312   1HB   LEU  45          2HB       LEU  45  -1.559  -9.182  -3.172
  313   2HB   LEU  45          1HB       LEU  45   0.187  -9.371  -2.989
  314    HG   LEU  45           HG       LEU  45  -1.491 -10.907  -4.984
  315   1HD1  LEU  45          1HD1      LEU  45  -1.214  -8.335  -5.282
  316   2HD1  LEU  45          2HD1      LEU  45  -0.821  -9.378  -6.648
  317   3HD1  LEU  45          3HD1      LEU  45   0.469  -8.715  -5.646
  318   1HD2  LEU  45          1HD2      LEU  45   0.434 -11.984  -5.591
  319   2HD2  LEU  45          2HD2      LEU  45   0.937 -11.584  -3.946
  320   3HD2  LEU  45          3HD2      LEU  45   1.438 -10.564  -5.295
  321    HA   PRO  46           HA       PRO  46   0.677 -11.184   1.393
  322   1HB   PRO  46          2HB       PRO  46   3.392 -10.943   1.141
  323   2HB   PRO  46          1HB       PRO  46   2.540 -12.491   0.990
  324   1HG   PRO  46          2HG       PRO  46   3.635 -10.727  -1.117
  325   2HG   PRO  46          1HG       PRO  46   3.547 -12.490  -1.052
  326   1HD   PRO  46          2HD       PRO  46   1.834 -10.898  -2.502
  327   2HD   PRO  46          1HD       PRO  46   1.461 -12.544  -1.956
  328    H    VAL  47           H        VAL  47   1.830  -9.494   2.767
  329    HA   VAL  47           HA       VAL  47   1.101  -6.834   2.021
  330    HB   VAL  47           HB       VAL  47   2.681  -8.218   4.187
  331   1HG1  VAL  47          1HG1      VAL  47   1.961  -5.307   4.371
  332   2HG1  VAL  47          2HG1      VAL  47   3.504  -5.798   3.674
  333   3HG1  VAL  47          3HG1      VAL  47   3.113  -6.225   5.335
  334   1HG2  VAL  47          1HG2      VAL  47   0.658  -7.017   5.438
  335   2HG2  VAL  47          2HG2      VAL  47   0.442  -8.564   4.620
  336   3HG2  VAL  47          3HG2      VAL  47  -0.050  -7.070   3.823
  337    H    ASP  48           H        ASP  48   3.737  -8.768   1.111
  338    HA   ASP  48           HA       ASP  48   5.773  -6.706   1.000
  339   1HB   ASP  48          2HB       ASP  48   6.332  -9.072   1.220
  340   2HB   ASP  48          1HB       ASP  48   5.457  -9.446  -0.266
  341    H    ILE  49           H        ILE  49   3.292  -7.991  -1.136
  342    HA   ILE  49           HA       ILE  49   4.300  -6.526  -3.477
  343    HB   ILE  49           HB       ILE  49   1.571  -7.772  -3.137
  344   1HG1  ILE  49          2HG1      ILE  49   3.103  -9.434  -2.268
  345   2HG1  ILE  49          1HG1      ILE  49   2.626  -9.922  -3.892
  346   1HG2  ILE  49          1HG2      ILE  49   1.703  -6.829  -5.249
  347   2HG2  ILE  49          2HG2      ILE  49   2.321  -8.447  -5.583
  348   3HG2  ILE  49          3HG2      ILE  49   3.441  -7.099  -5.376
  349   1HD1  ILE  49          1HD1      ILE  49   4.982 -10.210  -3.817
  350   2HD1  ILE  49          2HD1      ILE  49   5.221  -8.652  -3.021
  351   3HD1  ILE  49          3HD1      ILE  49   4.720  -8.713  -4.713
  352    H    LEU  50           H        LEU  50   1.762  -6.303  -1.067
  353    HA   LEU  50           HA       LEU  50   0.450  -3.987  -2.229
  354   1HB   LEU  50          2HB       LEU  50   0.392  -4.945   0.637
  355   2HB   LEU  50          1HB       LEU  50  -0.890  -4.144  -0.269
  356    HG   LEU  50           HG       LEU  50   0.142  -6.960  -0.647
  357   1HD1  LEU  50          1HD1      LEU  50  -2.359  -7.404  -0.345
  358   2HD1  LEU  50          2HD1      LEU  50  -2.478  -5.732   0.204
  359   3HD1  LEU  50          3HD1      LEU  50  -1.474  -6.882   1.088
  360   1HD2  LEU  50          1HD2      LEU  50  -0.413  -6.789  -2.824
  361   2HD2  LEU  50          2HD2      LEU  50  -0.980  -5.137  -2.593
  362   3HD2  LEU  50          3HD2      LEU  50  -2.077  -6.491  -2.324
  363    H    GLY  51           H        GLY  51   3.129  -4.567  -0.047
  364   1HA   GLY  51          2HA       GLY  51   3.168  -1.849   1.025
  365   2HA   GLY  51          1HA       GLY  51   4.463  -3.044   1.195
  366    H    ARG  52           H        ARG  52   4.333  -3.517  -1.737
  367    HA   ARG  52           HA       ARG  52   6.043  -1.248  -2.583
  368   1HB   ARG  52          2HB       ARG  52   6.200  -4.050  -2.701
  369   2HB   ARG  52          1HB       ARG  52   5.853  -3.548  -4.354
  370   1HG   ARG  52          2HG       ARG  52   7.715  -1.846  -4.112
  371   2HG   ARG  52          1HG       ARG  52   8.141  -2.646  -2.600
  372   1HD   ARG  52          2HD       ARG  52   7.823  -4.337  -5.062
  373   2HD   ARG  52          1HD       ARG  52   9.316  -3.397  -4.854
  374    HE   ARG  52           HE       ARG  52   8.557  -4.789  -2.419
  375   1HH1  ARG  52          1HH2      ARG  52  11.379  -4.472  -3.071
  376   2HH1  ARG  52          2HH2      ARG  52  11.843  -6.032  -3.660
  377   1HH2  ARG  52          2HH1      ARG  52   8.584  -7.080  -4.220
  378   2HH2  ARG  52          1HH1      ARG  52  10.260  -7.509  -4.310
  379    H    VAL  53           H        VAL  53   3.053  -2.986  -3.331
  380    HA   VAL  53           HA       VAL  53   2.638  -1.751  -5.928
  381    HB   VAL  53           HB       VAL  53   0.931  -3.173  -3.876
  382   1HG1  VAL  53          1HG1      VAL  53   0.018  -1.335  -5.898
  383   2HG1  VAL  53          2HG1      VAL  53  -0.941  -2.295  -4.772
  384   3HG1  VAL  53          3HG1      VAL  53  -0.477  -2.971  -6.333
  385   1HG2  VAL  53          1HG2      VAL  53   2.641  -4.264  -5.528
  386   2HG2  VAL  53          2HG2      VAL  53   1.416  -3.936  -6.759
  387   3HG2  VAL  53          3HG2      VAL  53   1.033  -4.976  -5.386
  388    H    TRP  54           H        TRP  54   1.330  -1.106  -2.651
  389    HA   TRP  54           HA       TRP  54  -0.052   1.315  -3.311
  390   1HB   TRP  54          2HB       TRP  54  -0.508   0.393  -1.183
  391   2HB   TRP  54          1HB       TRP  54   1.200   0.100  -0.845
  392    HD1  TRP  54           HD1      TRP  54   2.730   2.350  -0.438
  393    HE1  TRP  54           HE1      TRP  54   2.108   4.577   0.653
  394    HE3  TRP  54           HE3      TRP  54  -2.352   2.035  -0.655
  395    HZ2  TRP  54           HZ2      TRP  54  -0.237   6.028   1.399
  396    HZ3  TRP  54           HZ3      TRP  54  -3.760   3.864   0.278
  397    HH2  TRP  54           HH2      TRP  54  -2.702   5.842   1.299
  398    H    GLU  55           H        GLU  55   3.184   0.751  -1.905
  399    HA   GLU  55           HA       GLU  55   4.252   3.295  -1.777
  400   1HB   GLU  55          2HB       GLU  55   5.071   0.562  -2.071
  401   2HB   GLU  55          1HB       GLU  55   6.191   1.622  -2.912
  402   1HG   GLU  55          2HG       GLU  55   6.664   1.131  -0.447
  403   2HG   GLU  55          1HG       GLU  55   6.695   2.823  -0.956
  404    H    LEU  56           H        LEU  56   4.816   1.169  -4.549
  405    HA   LEU  56           HA       LEU  56   5.735   3.161  -6.345
  406   1HB   LEU  56          2HB       LEU  56   4.305   0.509  -6.734
  407   2HB   LEU  56          1HB       LEU  56   5.150   1.370  -8.021
  408    HG   LEU  56           HG       LEU  56   6.554   0.782  -5.428
  409   1HD1  LEU  56          1HD1      LEU  56   5.714  -1.152  -7.488
  410   2HD1  LEU  56          2HD1      LEU  56   6.243  -1.429  -5.828
  411   3HD1  LEU  56          3HD1      LEU  56   7.435  -1.197  -7.106
  412   1HD2  LEU  56          1HD2      LEU  56   7.961   2.110  -6.671
  413   2HD2  LEU  56          2HD2      LEU  56   7.243   1.612  -8.202
  414   3HD2  LEU  56          3HD2      LEU  56   8.398   0.557  -7.385
  415    H    SER  57           H        SER  57   2.588   2.454  -5.152
  416    HA   SER  57           HA       SER  57   1.196   3.889  -7.339
  417   1HB   SER  57          2HB       SER  57  -0.003   2.022  -6.568
  418   2HB   SER  57          1HB       SER  57   0.458   2.296  -4.892
  419    HG   SER  57           HG       SER  57  -1.063   4.210  -6.285
  420    H    ASP  58           H        ASP  58   2.648   4.438  -4.247
  421    HA   ASP  58           HA       ASP  58   1.101   6.924  -3.726
  422   1HB   ASP  58          2HB       ASP  58   1.526   5.470  -1.847
  423   2HB   ASP  58          1HB       ASP  58   3.235   5.345  -2.263
  424    H    ILE  59           H        ILE  59   1.992   8.026  -5.677
  425    HA   ILE  59           HA       ILE  59   4.894   8.517  -5.768
  426    HB   ILE  59           HB       ILE  59   2.472   9.288  -7.397
  427   1HG1  ILE  59          2HG1      ILE  59   4.917   7.817  -8.348
  428   2HG1  ILE  59          1HG1      ILE  59   3.723   6.961  -7.373
  429   1HG2  ILE  59          1HG2      ILE  59   3.968  11.192  -7.533
  430   2HG2  ILE  59          2HG2      ILE  59   4.135  10.263  -9.022
  431   3HG2  ILE  59          3HG2      ILE  59   5.361  10.135  -7.761
  432   1HD1  ILE  59          1HD1      ILE  59   3.575   7.804 -10.170
  433   2HD1  ILE  59          2HD1      ILE  59   2.172   8.326  -9.233
  434   3HD1  ILE  59          3HD1      ILE  59   2.599   6.615  -9.305
  435    H    ASP  60           H        ASP  60   2.060  10.100  -4.481
  436    HA   ASP  60           HA       ASP  60   3.473  12.709  -4.292
  437   1HB   ASP  60          2HB       ASP  60   1.269  13.471  -3.461
  438   2HB   ASP  60          1HB       ASP  60   1.101  12.593  -4.981
  439    H    HIS  61           H        HIS  61   2.715   9.896  -2.390
  440    HA   HIS  61           HA       HIS  61   3.471   9.298  -0.227
  441   1HB   HIS  61          2HB       HIS  61   4.749  12.036  -0.106
  442   2HB   HIS  61          1HB       HIS  61   5.289  10.542   0.655
  443    HD1  HIS  61           HD1      HIS  61   6.350   8.710  -0.925
  444    HD2  HIS  61           HD2      HIS  61   5.599  12.370  -2.773
  445    HE1  HIS  61           HE1      HIS  61   7.629   8.684  -3.110
  446    H    ASP  62           H        ASP  62   0.896  10.524  -0.606
  447    HA   ASP  62           HA       ASP  62   0.608  12.311   1.768
  448   1HB   ASP  62          2HB       ASP  62  -1.523  12.874   0.752
  449   2HB   ASP  62          1HB       ASP  62  -0.305  12.891  -0.525
  450    H    GLY  63           H        GLY  63   0.872   9.162   1.474
  451   1HA   GLY  63          2HA       GLY  63   0.038   7.322   2.670
  452   2HA   GLY  63          1HA       GLY  63  -0.724   8.491   3.750
  453    H    MET  64           H        MET  64  -1.342   8.380   0.291
  454    HA   MET  64           HA       MET  64  -3.917   6.983   0.663
  455   1HB   MET  64          2HB       MET  64  -3.732   9.868  -0.241
  456   2HB   MET  64          1HB       MET  64  -5.207   8.910  -0.133
  457   1HG   MET  64          2HG       MET  64  -4.762   8.617   2.311
  458   2HG   MET  64          1HG       MET  64  -3.419   9.744   2.155
  459   1HE   MET  64          1HE       MET  64  -7.800  10.303   2.444
  460   2HE   MET  64          2HE       MET  64  -6.873   8.864   2.025
  461   3HE   MET  64          3HE       MET  64  -7.429   9.948   0.751
  462    H    LEU  65           H        LEU  65  -4.998   6.599  -1.439
  463    HA   LEU  65           HA       LEU  65  -3.098   6.785  -3.757
  464   1HB   LEU  65          2HB       LEU  65  -5.115   4.714  -2.866
  465   2HB   LEU  65          1HB       LEU  65  -4.518   4.752  -4.522
  466    HG   LEU  65           HG       LEU  65  -2.979   4.217  -1.984
  467   1HD1  LEU  65          1HD1      LEU  65  -2.441   2.180  -3.025
  468   2HD1  LEU  65          2HD1      LEU  65  -2.789   2.805  -4.637
  469   3HD1  LEU  65          3HD1      LEU  65  -4.112   2.446  -3.525
  470   1HD2  LEU  65          1HD2      LEU  65  -1.953   5.199  -4.655
  471   2HD2  LEU  65          2HD2      LEU  65  -0.940   4.254  -3.562
  472   3HD2  LEU  65          3HD2      LEU  65  -1.572   5.819  -3.049
  473    H    ASP  66           H        ASP  66  -3.901   8.663  -4.765
  474    HA   ASP  66           HA       ASP  66  -6.708   9.314  -4.908
  475   1HB   ASP  66          2HB       ASP  66  -5.917  11.088  -6.365
  476   2HB   ASP  66          1HB       ASP  66  -4.737  10.876  -5.071
  477    H    ARG  67           H        ARG  67  -7.968   9.390  -6.914
  478    HA   ARG  67           HA       ARG  67  -8.562   7.098  -8.214
  479   1HB   ARG  67          2HB       ARG  67  -8.868   8.756 -10.294
  480   2HB   ARG  67          1HB       ARG  67  -9.883   8.878  -8.858
  481   1HG   ARG  67          2HG       ARG  67  -8.904  10.830  -8.169
  482   2HG   ARG  67          1HG       ARG  67  -7.311  10.358  -8.759
  483   1HD   ARG  67          2HD       ARG  67  -7.847  10.972 -11.006
  484   2HD   ARG  67          1HD       ARG  67  -9.579  11.093 -10.633
  485    HE   ARG  67           HE       ARG  67  -9.163  13.242  -9.754
  486   1HH1  ARG  67          1HH2      ARG  67  -6.327  12.368 -11.139
  487   2HH1  ARG  67          2HH2      ARG  67  -5.280  13.188 -10.029
  488   1HH2  ARG  67          2HH1      ARG  67  -7.801  13.863  -7.742
  489   2HH2  ARG  67          1HH1      ARG  67  -6.117  14.035  -8.104
  490    H    ASP  68           H        ASP  68  -5.936   9.248  -9.319
  491    HA   ASP  68           HA       ASP  68  -5.166   7.451 -11.485
  492   1HB   ASP  68          2HB       ASP  68  -4.286  10.027 -10.261
  493   2HB   ASP  68          1HB       ASP  68  -3.098   9.151 -11.226
  494    H    GLU  69           H        GLU  69  -3.890   8.216  -8.253
  495    HA   GLU  69           HA       GLU  69  -1.566   6.516  -8.427
  496   1HB   GLU  69          2HB       GLU  69  -3.192   7.855  -6.281
  497   2HB   GLU  69          1HB       GLU  69  -1.925   6.716  -5.820
  498   1HG   GLU  69          2HG       GLU  69  -0.302   7.996  -7.181
  499   2HG   GLU  69          1HG       GLU  69  -1.569   9.156  -7.578
  500    H    PHE  70           H        PHE  70  -4.796   6.067  -6.967
  501    HA   PHE  70           HA       PHE  70  -4.441   3.396  -6.067
  502   1HB   PHE  70          2HB       PHE  70  -6.328   5.043  -5.622
  503   2HB   PHE  70          1HB       PHE  70  -6.942   4.665  -7.231
  504    HD1  PHE  70           HD1      PHE  70  -7.027   3.756  -3.807
  505    HD2  PHE  70           HD2      PHE  70  -7.235   2.102  -7.765
  506    HE1  PHE  70           HE1      PHE  70  -8.138   1.733  -2.902
  507    HE2  PHE  70           HE2      PHE  70  -8.347   0.079  -6.861
  508    HZ   PHE  70           HZ       PHE  70  -8.793  -0.104  -4.428
  509    H    ALA  71           H        ALA  71  -4.669   4.736  -9.238
  510    HA   ALA  71           HA       ALA  71  -5.660   2.353 -10.600
  511   1HB   ALA  71          1HB       ALA  71  -5.322   3.676 -12.530
  512   2HB   ALA  71          2HB       ALA  71  -3.962   4.539 -11.805
  513   3HB   ALA  71          3HB       ALA  71  -5.612   4.883 -11.277
  514    H    VAL  72           H        VAL  72  -2.465   3.919 -10.398
  515    HA   VAL  72           HA       VAL  72  -0.943   1.952 -11.728
  516    HB   VAL  72           HB       VAL  72  -0.357   3.841  -9.432
  517   1HG1  VAL  72          1HG1      VAL  72   1.318   1.781 -10.709
  518   2HG1  VAL  72          2HG1      VAL  72   1.537   2.617  -9.172
  519   3HG1  VAL  72          3HG1      VAL  72   2.047   3.387 -10.675
  520   1HG2  VAL  72          1HG2      VAL  72   0.303   3.986 -12.398
  521   2HG2  VAL  72          2HG2      VAL  72   0.616   5.239 -11.188
  522   3HG2  VAL  72          3HG2      VAL  72  -1.048   4.824 -11.623
  523    H    ALA  73           H        ALA  73  -2.288   1.995  -8.487
  524    HA   ALA  73           HA       ALA  73  -0.709  -0.350  -7.606
  525   1HB   ALA  73          1HB       ALA  73  -1.176   0.569  -5.602
  526   2HB   ALA  73          2HB       ALA  73  -2.910   0.451  -5.907
  527   3HB   ALA  73          3HB       ALA  73  -2.010   1.868  -6.454
  528    H    MET  74           H        MET  74  -3.479   0.079  -9.472
  529    HA   MET  74           HA       MET  74  -4.983  -2.187  -8.317
  530   1HB   MET  74          2HB       MET  74  -5.300  -0.100 -10.431
  531   2HB   MET  74          1HB       MET  74  -6.221  -1.588 -10.637
  532   1HG   MET  74          2HG       MET  74  -6.224  -0.061  -8.035
  533   2HG   MET  74          1HG       MET  74  -7.371   0.295  -9.327
  534   1HE   MET  74          1HE       MET  74  -7.757  -1.808  -5.970
  535   2HE   MET  74          2HE       MET  74  -6.174  -1.411  -6.637
  536   3HE   MET  74          3HE       MET  74  -6.713  -3.090  -6.601
  537    H    PHE  75           H        PHE  75  -3.329  -1.466 -11.403
  538    HA   PHE  75           HA       PHE  75  -3.567  -4.225 -12.319
  539   1HB   PHE  75          2HB       PHE  75  -2.574  -3.379 -14.265
  540   2HB   PHE  75          1HB       PHE  75  -3.288  -1.917 -13.587
  541    HD1  PHE  75           HD1      PHE  75  -0.158  -3.782 -14.141
  542    HD2  PHE  75           HD2      PHE  75  -1.918  -0.192 -12.579
  543    HE1  PHE  75           HE1      PHE  75   2.086  -2.734 -14.022
  544    HE2  PHE  75           HE2      PHE  75   0.318   0.854 -12.465
  545    HZ   PHE  75           HZ       PHE  75   2.323  -0.415 -13.181
  546    H    LEU  76           H        LEU  76  -1.332  -2.294 -10.479
  547    HA   LEU  76           HA       LEU  76   0.991  -3.976 -10.570
  548   1HB   LEU  76          2HB       LEU  76  -0.169  -1.785  -8.940
  549   2HB   LEU  76          1HB       LEU  76   1.026  -2.786  -8.117
  550    HG   LEU  76           HG       LEU  76   1.419  -1.377 -10.772
  551   1HD1  LEU  76          1HD1      LEU  76   1.534  -0.316  -8.226
  552   2HD1  LEU  76          2HD1      LEU  76   2.397   0.318  -9.626
  553   3HD1  LEU  76          3HD1      LEU  76   3.208  -0.787  -8.517
  554   1HD2  LEU  76          1HD2      LEU  76   3.831  -2.326  -9.538
  555   2HD2  LEU  76          2HD2      LEU  76   3.154  -2.774 -11.105
  556   3HD2  LEU  76          3HD2      LEU  76   2.694  -3.669  -9.656
  557    H    VAL  77           H        VAL  77  -2.024  -4.027  -8.808
  558    HA   VAL  77           HA       VAL  77  -1.183  -6.281  -7.079
  559    HB   VAL  77           HB       VAL  77  -3.596  -4.469  -7.388
  560   1HG1  VAL  77          1HG1      VAL  77  -3.399  -7.138  -6.047
  561   2HG1  VAL  77          2HG1      VAL  77  -4.792  -6.354  -6.793
  562   3HG1  VAL  77          3HG1      VAL  77  -4.257  -5.858  -5.188
  563   1HG2  VAL  77          1HG2      VAL  77  -2.262  -3.336  -5.934
  564   2HG2  VAL  77          2HG2      VAL  77  -1.277  -4.754  -5.584
  565   3HG2  VAL  77          3HG2      VAL  77  -2.813  -4.519  -4.750
  566    H    TYR  78           H        TYR  78  -2.955  -5.677 -10.026
  567    HA   TYR  78           HA       TYR  78  -4.233  -8.342  -9.991
  568   1HB   TYR  78          2HB       TYR  78  -4.409  -5.788 -11.452
  569   2HB   TYR  78          1HB       TYR  78  -4.626  -7.210 -12.476
  570    HD1  TYR  78           HD1      TYR  78  -6.461  -4.895 -10.810
  571    HD2  TYR  78           HD2      TYR  78  -5.982  -9.163 -10.938
  572    HE1  TYR  78           HE1      TYR  78  -8.763  -5.175  -9.933
  573    HE2  TYR  78           HE2      TYR  78  -8.287  -9.446 -10.063
  574    HH   TYR  78           HH       TYR  78  -9.957  -7.237  -8.530
  575    H    CYS  79           H        CYS  79  -1.372  -6.786 -11.197
  576    HA   CYS  79           HA       CYS  79  -0.825  -8.817 -13.254
  577   1HB   CYS  79          2HB       CYS  79  -0.195  -6.258 -13.099
  578   2HB   CYS  79          1HB       CYS  79   1.161  -6.849 -12.139
  579    HG   CYS  79           HG       CYS  79   1.259  -8.538 -14.499
  580    H    ALA  80           H        ALA  80  -0.285  -8.376  -9.857
  581    HA   ALA  80           HA       ALA  80   2.065 -10.132  -9.696
  582   1HB   ALA  80          1HB       ALA  80   0.314  -8.511  -7.921
  583   2HB   ALA  80          2HB       ALA  80   2.071  -8.675  -7.912
  584   3HB   ALA  80          3HB       ALA  80   1.067  -9.919  -7.169
  585    H    LEU  81           H        LEU  81  -1.319 -10.471  -9.934
  586    HA   LEU  81           HA       LEU  81  -1.449 -13.093  -8.582
  587   1HB   LEU  81          2HB       LEU  81  -3.567 -11.742 -10.257
  588   2HB   LEU  81          1HB       LEU  81  -3.793 -12.806  -8.868
  589    HG   LEU  81           HG       LEU  81  -2.829  -9.952  -8.901
  590   1HD1  LEU  81          1HD1      LEU  81  -5.149 -11.465  -7.719
  591   2HD1  LEU  81          2HD1      LEU  81  -5.175 -10.020  -8.729
  592   3HD1  LEU  81          3HD1      LEU  81  -4.650  -9.914  -7.048
  593   1HD2  LEU  81          1HD2      LEU  81  -2.653 -12.004  -6.677
  594   2HD2  LEU  81          2HD2      LEU  81  -2.460 -10.268  -6.433
  595   3HD2  LEU  81          3HD2      LEU  81  -1.311 -11.151  -7.439
  596    H    GLU  82           H        GLU  82  -1.669 -11.708 -11.831
  597    HA   GLU  82           HA       GLU  82  -2.255 -14.167 -13.197
  598   1HB   GLU  82          2HB       GLU  82  -2.774 -12.103 -14.257
  599   2HB   GLU  82          1HB       GLU  82  -1.162 -11.456 -13.956
  600   1HG   GLU  82          2HG       GLU  82  -1.271 -12.075 -16.287
  601   2HG   GLU  82          1HG       GLU  82  -0.246 -13.256 -15.469
  602    H    LYS  83           H        LYS  83   0.785 -12.311 -12.839
  603    HA   LYS  83           HA       LYS  83   2.413 -14.636 -12.489
  604   1HB   LYS  83          2HB       LYS  83   1.415 -14.716 -14.932
  605   2HB   LYS  83          1HB       LYS  83   2.718 -13.583 -15.272
  606   1HG   LYS  83          2HG       LYS  83   3.466 -15.886 -15.677
  607   2HG   LYS  83          1HG       LYS  83   4.349 -15.182 -14.322
  608   1HD   LYS  83          2HD       LYS  83   2.036 -16.332 -13.199
  609   2HD   LYS  83          1HD       LYS  83   2.643 -17.517 -14.359
  610   1HE   LYS  83          2HE       LYS  83   4.970 -16.664 -13.136
  611   2HE   LYS  83          1HE       LYS  83   3.806 -16.669 -11.795
  612   1HZ   LYS  83          1HZ       LYS  83   3.899 -18.887 -13.745
  613   2HZ   LYS  83          2HZ       LYS  83   3.246 -18.879 -12.177
  614   3HZ   LYS  83          3HZ       LYS  83   4.930 -18.876 -12.398
  615    H    GLU  84           H        GLU  84   2.183 -11.272 -13.494
  616    HA   GLU  84           HA       GLU  84   5.111 -10.904 -13.242
  617   1HB   GLU  84          2HB       GLU  84   2.842  -9.616 -14.517
  618   2HB   GLU  84          1HB       GLU  84   3.844  -8.443 -13.661
  619   1HG   GLU  84          2HG       GLU  84   4.801 -10.461 -15.715
  620   2HG   GLU  84          1HG       GLU  84   4.690  -8.713 -15.937
  621    HA   PRO  85           HA       PRO  85   4.500  -9.708  -8.976
  622   1HB   PRO  85          2HB       PRO  85   7.158  -9.310  -8.444
  623   2HB   PRO  85          1HB       PRO  85   6.414 -10.919  -8.492
  624   1HG   PRO  85          2HG       PRO  85   8.046  -9.529 -10.555
  625   2HG   PRO  85          1HG       PRO  85   8.038 -11.235 -10.081
  626   1HD   PRO  85          2HD       PRO  85   6.798 -10.289 -12.316
  627   2HD   PRO  85          1HD       PRO  85   6.266 -11.739 -11.435
  628    H    VAL  86           H        VAL  86   6.311  -7.767  -7.888
  629    HA   VAL  86           HA       VAL  86   5.653  -5.368  -9.566
  630    HB   VAL  86           HB       VAL  86   5.648  -5.926  -6.593
  631   1HG1  VAL  86          1HG1      VAL  86   5.319  -3.197  -7.862
  632   2HG1  VAL  86          2HG1      VAL  86   6.835  -3.746  -7.148
  633   3HG1  VAL  86          3HG1      VAL  86   5.395  -3.581  -6.145
  634   1HG2  VAL  86          1HG2      VAL  86   3.372  -5.616  -6.735
  635   2HG2  VAL  86          2HG2      VAL  86   3.659  -6.159  -8.388
  636   3HG2  VAL  86          3HG2      VAL  86   3.509  -4.436  -8.039
  637    HA   PRO  87           HA       PRO  87   9.997  -4.651  -9.413
  638   1HB   PRO  87          2HB       PRO  87  10.016  -2.058 -10.269
  639   2HB   PRO  87          1HB       PRO  87   9.708  -3.429 -11.351
  640   1HG   PRO  87          2HG       PRO  87   7.830  -1.453 -10.234
  641   2HG   PRO  87          1HG       PRO  87   7.741  -2.381 -11.737
  642   1HD   PRO  87          2HD       PRO  87   6.355  -2.908  -9.358
  643   2HD   PRO  87          1HD       PRO  87   6.491  -3.986 -10.760
  644    H    MET  88           H        MET  88  11.171  -2.174  -8.804
  645    HA   MET  88           HA       MET  88  10.304  -1.768  -5.958
  646   1HB   MET  88          2HB       MET  88  12.369  -3.151  -6.390
  647   2HB   MET  88          1HB       MET  88  13.101  -1.713  -7.102
  648   1HG   MET  88          2HG       MET  88  13.612  -0.904  -5.065
  649   2HG   MET  88          1HG       MET  88  11.930  -1.044  -4.551
  650   1HE   MET  88          1HE       MET  88  12.823  -2.963  -1.574
  651   2HE   MET  88          2HE       MET  88  11.831  -1.762  -2.397
  652   3HE   MET  88          3HE       MET  88  13.544  -1.447  -2.129
  653    H    SER  89           H        SER  89  10.183  -0.175  -8.776
  654    HA   SER  89           HA       SER  89  10.387   2.425  -7.470
  655   1HB   SER  89          2HB       SER  89  12.735   1.745  -7.945
  656   2HB   SER  89          1HB       SER  89  12.320   1.673  -9.654
  657    HG   SER  89           HG       SER  89  12.920   3.710  -9.548
  658    H    LEU  90           H        LEU  90   8.647   0.725  -9.223
  659    HA   LEU  90           HA       LEU  90   7.037   1.124 -10.929
  660   1HB   LEU  90          2HB       LEU  90   7.550   3.440  -9.374
  661   2HB   LEU  90          1HB       LEU  90   7.398   3.981 -11.046
  662    HG   LEU  90           HG       LEU  90   5.418   2.217  -9.594
  663   1HD1  LEU  90          1HD1      LEU  90   5.356   5.150 -10.358
  664   2HD1  LEU  90          2HD1      LEU  90   5.322   4.484  -8.726
  665   3HD1  LEU  90          3HD1      LEU  90   3.946   4.247  -9.804
  666   1HD2  LEU  90          1HD2      LEU  90   5.239   1.662 -11.864
  667   2HD2  LEU  90          2HD2      LEU  90   5.618   3.299 -12.395
  668   3HD2  LEU  90          3HD2      LEU  90   4.042   2.942 -11.686
  669    HA   PRO  91           HA       PRO  91   9.887   1.502 -14.393
  670   1HB   PRO  91          2HB       PRO  91   8.198   0.334 -16.213
  671   2HB   PRO  91          1HB       PRO  91   9.207  -0.600 -15.088
  672   1HG   PRO  91          2HG       PRO  91   6.316   0.093 -14.908
  673   2HG   PRO  91          1HG       PRO  91   7.140  -1.418 -14.496
  674   1HD   PRO  91          2HD       PRO  91   6.369   0.387 -12.620
  675   2HD   PRO  91          1HD       PRO  91   7.789  -0.661 -12.425
  676    HA   PRO  92           HA       PRO  92   8.253   5.172 -16.175
  677   1HB   PRO  92          2HB       PRO  92   9.431   5.112 -18.636
  678   2HB   PRO  92          1HB       PRO  92  10.328   5.473 -17.148
  679   1HG   PRO  92          2HG       PRO  92  10.142   2.926 -18.680
  680   2HG   PRO  92          1HG       PRO  92  11.550   3.671 -17.906
  681   1HD   PRO  92          2HD       PRO  92  10.185   1.610 -16.801
  682   2HD   PRO  92          1HD       PRO  92  11.004   2.854 -15.829
  683    H    ALA  93           H        ALA  93   7.355   2.148 -17.261
  684    HA   ALA  93           HA       ALA  93   5.866   2.972 -19.646
  685   1HB   ALA  93          1HB       ALA  93   6.764   0.562 -18.315
  686   2HB   ALA  93          2HB       ALA  93   6.234   0.767 -19.986
  687   3HB   ALA  93          3HB       ALA  93   5.053   0.429 -18.721
  688    H    LEU  94           H        LEU  94   5.362   3.427 -16.389
  689    HA   LEU  94           HA       LEU  94   2.469   3.741 -16.862
  690   1HB   LEU  94          2HB       LEU  94   1.783   2.093 -15.413
  691   2HB   LEU  94          1HB       LEU  94   3.296   1.382 -15.956
  692    HG   LEU  94           HG       LEU  94   4.021   3.029 -13.801
  693   1HD1  LEU  94          1HD1      LEU  94   1.264   2.099 -13.575
  694   2HD1  LEU  94          2HD1      LEU  94   2.152   3.213 -12.536
  695   3HD1  LEU  94          3HD1      LEU  94   2.277   1.474 -12.274
  696   1HD2  LEU  94          1HD2      LEU  94   3.849   0.160 -14.485
  697   2HD2  LEU  94          2HD2      LEU  94   3.936   0.515 -12.758
  698   3HD2  LEU  94          3HD2      LEU  94   5.200   1.091 -13.844
  699    H    VAL  95           H        VAL  95   4.548   5.702 -16.387
  700    HA   VAL  95           HA       VAL  95   3.689   6.709 -13.694
  701    HB   VAL  95           HB       VAL  95   6.300   6.972 -15.212
  702   1HG1  VAL  95          1HG1      VAL  95   7.042   8.249 -13.170
  703   2HG1  VAL  95          2HG1      VAL  95   5.355   8.302 -12.656
  704   3HG1  VAL  95          3HG1      VAL  95   5.848   9.101 -14.150
  705   1HG2  VAL  95          1HG2      VAL  95   5.737   5.851 -12.453
  706   2HG2  VAL  95          2HG2      VAL  95   7.232   5.718 -13.382
  707   3HG2  VAL  95          3HG2      VAL  95   5.788   4.851 -13.906
  708    HA   PRO  96           HA       PRO  96   2.000  10.026 -16.103
  709   1HB   PRO  96          2HB       PRO  96   1.332  11.647 -14.003
  710   2HB   PRO  96          1HB       PRO  96   0.394  10.207 -14.445
  711   1HG   PRO  96          2HG       PRO  96   2.390  10.571 -12.271
  712   2HG   PRO  96          1HG       PRO  96   0.880   9.646 -12.276
  713   1HD   PRO  96          2HD       PRO  96   3.355   8.518 -12.547
  714   2HD   PRO  96          1HD       PRO  96   1.863   7.799 -13.194
  715    HA   PRO  97           HA       PRO  97   5.110  13.132 -16.320
  716   1HB   PRO  97          2HB       PRO  97   3.678  15.439 -16.683
  717   2HB   PRO  97          1HB       PRO  97   3.841  14.199 -17.943
  718   1HG   PRO  97          2HG       PRO  97   1.572  14.722 -16.089
  719   2HG   PRO  97          1HG       PRO  97   1.549  14.254 -17.796
  720   1HD   PRO  97          2HD       PRO  97   1.100  12.505 -15.754
  721   2HD   PRO  97          1HD       PRO  97   1.783  12.026 -17.324
  722    H    SER  98           H        SER  98   5.334  15.670 -15.422
  723    HA   SER  98           HA       SER  98   5.502  17.053 -13.512
  724   1HB   SER  98          2HB       SER  98   3.087  15.959 -13.227
  725   2HB   SER  98          1HB       SER  98   3.885  15.121 -11.900
  726    HG   SER  98           HG       SER  98   3.964  16.931 -10.825
  727    H    LYS  99           H        LYS  99   5.669  13.555 -12.886
  728    HA   LYS  99           HA       LYS  99   7.755  13.958 -10.840
  729   1HB   LYS  99          2HB       LYS  99   5.775  12.047 -11.474
  730   2HB   LYS  99          1HB       LYS  99   7.313  11.239 -11.775
  731   1HG   LYS  99          2HG       LYS  99   7.662  12.660  -9.366
  732   2HG   LYS  99          1HG       LYS  99   6.074  11.903  -9.245
  733   1HD   LYS  99          2HD       LYS  99   8.708  10.528  -9.842
  734   2HD   LYS  99          1HD       LYS  99   7.704  10.326  -8.407
  735   1HE   LYS  99          2HE       LYS  99   6.275   8.887  -9.462
  736   2HE   LYS  99          1HE       LYS  99   6.326   9.799 -10.983
  737   1HZ   LYS  99          1HZ       LYS  99   7.501   7.740 -11.281
  738   2HZ   LYS  99          2HZ       LYS  99   8.455   8.029  -9.906
  739   3HZ   LYS  99          3HZ       LYS  99   8.627   9.008 -11.284
  740    H    ARG 100           H        ARG 100   7.723  14.200 -14.100
  741    HA   ARG 100           HA       ARG 100   9.872  12.437 -14.911
  742   1HB   ARG 100          2HB       ARG 100   8.076  14.420 -15.988
  743   2HB   ARG 100          1HB       ARG 100   9.713  14.726 -16.577
  744   1HG   ARG 100          2HG       ARG 100   9.504  13.011 -18.012
  745   2HG   ARG 100          1HG       ARG 100   9.295  11.915 -16.646
  746   1HD   ARG 100          2HD       ARG 100   6.840  13.362 -17.036
  747   2HD   ARG 100          1HD       ARG 100   7.338  12.631 -18.575
  748    HE   ARG 100           HE       ARG 100   7.332  11.015 -16.058
  749   1HH1  ARG 100          1HH2      ARG 100   4.955  11.572 -18.146
  750   2HH1  ARG 100          2HH2      ARG 100   4.924  10.016 -18.908
  751   1HH2  ARG 100          2HH1      ARG 100   7.950   9.000 -17.556
  752   2HH2  ARG 100          1HH1      ARG 100   6.618   8.561 -18.573
  753    H    SER 107           1H       SER 107   1.007   7.740   8.373
  754    HA   SER 107           HA       SER 107   2.955   5.513   8.183
  755   1HB   SER 107          2HB       SER 107   0.774   4.136   8.223
  756   2HB   SER 107          1HB       SER 107   1.345   4.765   9.765
  757    HG   SER 107           HG       SER 107  -0.329   6.387   8.235
  758    H    THR 108           H        THR 108   3.515   6.019   6.042
  759    HA   THR 108           HA       THR 108   1.438   6.781   4.092
  760    HB   THR 108           HB       THR 108   3.361   7.066   2.630
  761    HG1  THR 108           HG1      THR 108   4.583   5.310   3.015
  762   1HG2  THR 108          1HG2      THR 108   3.631   8.960   3.825
  763   2HG2  THR 108          2HG2      THR 108   4.924   8.118   4.679
  764   3HG2  THR 108          3HG2      THR 108   3.291   8.133   5.345
  765    H    ASN 109           H        ASN 109   3.271   3.927   5.029
  766    HA   ASN 109           HA       ASN 109   2.009   2.406   2.775
  767   1HB   ASN 109          2HB       ASN 109   4.340   2.265   2.541
  768   2HB   ASN 109          1HB       ASN 109   4.608   2.243   4.283
  769   1HD2  ASN 109          1HD2      ASN 109   4.484   0.243   1.539
  770   2HD2  ASN 109          2HD2      ASN 109   4.312  -1.245   2.340
  771    HA   PRO 110           HA       PRO 110  -0.131   0.563   6.263
  772   1HB   PRO 110          2HB       PRO 110  -2.136  -0.550   4.779
  773   2HB   PRO 110          1HB       PRO 110  -2.106   1.166   5.228
  774   1HG   PRO 110          2HG       PRO 110  -1.548  -0.110   2.633
  775   2HG   PRO 110          1HG       PRO 110  -2.153   1.512   2.993
  776   1HD   PRO 110          2HD       PRO 110   0.477   0.823   2.271
  777   2HD   PRO 110          1HD       PRO 110  -0.078   2.390   2.896
  778    H    PHE 111           H        PHE 111   2.062  -0.783   4.451
  779    HA   PHE 111           HA       PHE 111   1.238  -3.598   5.084
  780   1HB   PHE 111          2HB       PHE 111   2.722  -2.538   2.657
  781   2HB   PHE 111          1HB       PHE 111   2.372  -4.241   2.960
  782    HD1  PHE 111           HD1      PHE 111   1.174  -1.231   1.463
  783    HD2  PHE 111           HD2      PHE 111  -0.138  -4.850   3.374
  784    HE1  PHE 111           HE1      PHE 111  -1.060  -0.971   0.425
  785    HE2  PHE 111           HE2      PHE 111  -2.370  -4.588   2.332
  786    HZ   PHE 111           HZ       PHE 111  -2.829  -2.652   0.856
  787    H    LEU 112           HN       LEU 112   3.132  -1.347   6.239
  788    HA   LEU 112           HA       LEU 112   5.686  -2.895   6.200
  789   1HB   LEU 112          2HB       LEU 112   4.896  -0.122   6.223
  790   2HB   LEU 112          1HB       LEU 112   5.899  -0.453   7.635
  791    HG   LEU 112           HG       LEU 112   7.210   0.212   5.589
  792   1HD1  LEU 112          1HD1      LEU 112   8.082  -2.564   6.004
  793   2HD1  LEU 112          2HD1      LEU 112   7.751  -1.698   7.505
  794   3HD1  LEU 112          3HD1      LEU 112   8.926  -1.057   6.358
  795   1HD2  LEU 112          1HD2      LEU 112   5.514  -1.311   4.182
  796   2HD2  LEU 112          2HD2      LEU 112   6.752  -2.529   4.488
  797   3HD2  LEU 112          3HD2      LEU 112   7.170  -1.038   3.645
  Start of MODEL   16
    1    HA   PRO   6           HA       PRO   6   2.092   6.397 -23.274
    2   1HB   PRO   6          2HB       PRO   6  -0.473   5.489 -23.008
    3   2HB   PRO   6          1HB       PRO   6   0.197   6.046 -24.554
    4   1HG   PRO   6          2HG       PRO   6  -0.203   3.274 -23.554
    5   2HG   PRO   6          1HG       PRO   6  -0.417   3.928 -25.185
    6   1HD   PRO   6          2HD       PRO   6   1.764   2.476 -24.409
    7   2HD   PRO   6          1HD       PRO   6   1.795   3.683 -25.714
    8    H    TRP   7           H        TRP   7   0.169   6.402 -21.320
    9    HA   TRP   7           HA       TRP   7   1.459   5.864 -18.913
   10   1HB   TRP   7          2HB       TRP   7  -0.616   7.171 -19.216
   11   2HB   TRP   7          1HB       TRP   7  -1.500   5.692 -19.589
   12    HD1  TRP   7           HD1      TRP   7   1.107   5.451 -16.904
   13    HE1  TRP   7           HE1      TRP   7  -0.034   5.206 -14.603
   14    HE3  TRP   7           HE3      TRP   7  -3.729   6.428 -18.214
   15    HZ2  TRP   7           HZ2      TRP   7  -2.653   5.402 -13.472
   16    HZ3  TRP   7           HZ3      TRP   7  -5.525   6.392 -16.509
   17    HH2  TRP   7           HH2      TRP   7  -4.995   5.880 -14.141
   18    H    ALA   8           H        ALA   8   2.076   3.972 -17.962
   19    HA   ALA   8           HA       ALA   8   1.913   1.401 -18.930
   20   1HB   ALA   8          1HB       ALA   8   1.761   2.481 -16.110
   21   2HB   ALA   8          2HB       ALA   8   3.202   1.959 -16.983
   22   3HB   ALA   8          3HB       ALA   8   2.011   0.770 -16.453
   23    H    VAL   9           H        VAL   9  -0.677   3.227 -17.422
   24    HA   VAL   9           HA       VAL   9  -2.428   0.799 -17.431
   25    HB   VAL   9           HB       VAL   9  -2.528   3.505 -16.081
   26   1HG1  VAL   9          1HG1      VAL   9  -4.592   1.294 -15.910
   27   2HG1  VAL   9          2HG1      VAL   9  -4.797   2.761 -16.866
   28   3HG1  VAL   9          3HG1      VAL   9  -4.655   2.865 -15.112
   29   1HG2  VAL   9          1HG2      VAL   9  -1.961   0.680 -15.274
   30   2HG2  VAL   9          2HG2      VAL   9  -2.771   1.726 -14.107
   31   3HG2  VAL   9          3HG2      VAL   9  -1.187   2.173 -14.741
   32    H    LYS  10           H        LYS  10  -4.594   1.047 -18.352
   33    HA   LYS  10           HA       LYS  10  -4.662   3.022 -20.604
   34   1HB   LYS  10          2HB       LYS  10  -6.314   0.508 -20.232
   35   2HB   LYS  10          1HB       LYS  10  -5.953   1.349 -21.737
   36   1HG   LYS  10          2HG       LYS  10  -3.478   0.832 -21.215
   37   2HG   LYS  10          1HG       LYS  10  -4.110  -0.335 -20.053
   38   1HD   LYS  10          2HD       LYS  10  -5.623  -0.975 -22.203
   39   2HD   LYS  10          1HD       LYS  10  -4.170  -0.400 -23.022
   40   1HE   LYS  10          2HE       LYS  10  -2.877  -2.138 -22.240
   41   2HE   LYS  10          1HE       LYS  10  -3.762  -2.238 -20.705
   42   1HZ   LYS  10          1HZ       LYS  10  -4.138  -3.901 -22.803
   43   2HZ   LYS  10          2HZ       LYS  10  -5.379  -2.765 -23.034
   44   3HZ   LYS  10          3HZ       LYS  10  -5.272  -3.625 -21.573
   45    HA   PRO  11           HA       PRO  11  -8.227   5.000 -18.954
   46   1HB   PRO  11          2HB       PRO  11 -10.035   4.989 -21.020
   47   2HB   PRO  11          1HB       PRO  11  -8.618   6.060 -20.972
   48   1HG   PRO  11          2HG       PRO  11  -8.988   3.469 -22.407
   49   2HG   PRO  11          1HG       PRO  11  -8.226   4.967 -22.969
   50   1HD   PRO  11          2HD       PRO  11  -6.777   2.869 -22.137
   51   2HD   PRO  11          1HD       PRO  11  -6.250   4.541 -21.848
   52    H    GLU  12           H        GLU  12  -8.821   1.945 -20.612
   53    HA   GLU  12           HA       GLU  12 -11.403   1.407 -19.414
   54   1HB   GLU  12          2HB       GLU  12  -9.419  -0.687 -20.297
   55   2HB   GLU  12          1HB       GLU  12 -11.171  -0.687 -20.484
   56   1HG   GLU  12          2HG       GLU  12 -10.578   1.532 -21.901
   57   2HG   GLU  12          1HG       GLU  12  -9.090   0.619 -22.151
   58    H    ASP  13           H        ASP  13  -8.059   0.833 -18.475
   59    HA   ASP  13           HA       ASP  13  -8.704  -0.910 -16.218
   60   1HB   ASP  13          2HB       ASP  13  -6.333   0.456 -17.425
   61   2HB   ASP  13          1HB       ASP  13  -6.204  -0.042 -15.738
   62    H    LYS  14           H        LYS  14  -7.905   2.491 -16.735
   63    HA   LYS  14           HA       LYS  14  -7.925   3.304 -13.990
   64   1HB   LYS  14          2HB       LYS  14  -6.903   4.648 -15.705
   65   2HB   LYS  14          1HB       LYS  14  -8.391   4.683 -16.644
   66   1HG   LYS  14          2HG       LYS  14  -8.636   6.722 -15.641
   67   2HG   LYS  14          1HG       LYS  14  -9.290   5.751 -14.324
   68   1HD   LYS  14          2HD       LYS  14  -6.790   5.567 -13.566
   69   2HD   LYS  14          1HD       LYS  14  -6.568   6.995 -14.580
   70   1HE   LYS  14          2HE       LYS  14  -8.534   6.731 -12.273
   71   2HE   LYS  14          1HE       LYS  14  -7.069   7.734 -12.302
   72   1HZ   LYS  14          1HZ       LYS  14  -8.074   8.658 -14.464
   73   2HZ   LYS  14          2HZ       LYS  14  -8.706   9.205 -12.985
   74   3HZ   LYS  14          3HZ       LYS  14  -9.541   8.033 -13.887
   75    H    ALA  15           H        ALA  15 -10.406   2.374 -16.166
   76    HA   ALA  15           HA       ALA  15 -12.589   3.895 -14.917
   77   1HB   ALA  15          1HB       ALA  15 -12.278   2.881 -17.340
   78   2HB   ALA  15          2HB       ALA  15 -13.879   2.886 -16.600
   79   3HB   ALA  15          3HB       ALA  15 -12.907   1.414 -16.592
   80    H    LYS  16           H        LYS  16 -11.003   0.828 -14.576
   81    HA   LYS  16           HA       LYS  16 -13.037  -0.241 -12.693
   82   1HB   LYS  16          2HB       LYS  16 -10.400  -1.579 -13.075
   83   2HB   LYS  16          1HB       LYS  16 -12.019  -2.277 -13.110
   84   1HG   LYS  16          2HG       LYS  16 -12.374  -1.319 -15.361
   85   2HG   LYS  16          1HG       LYS  16 -10.749  -0.642 -15.320
   86   1HD   LYS  16          2HD       LYS  16 -10.648  -2.714 -16.561
   87   2HD   LYS  16          1HD       LYS  16  -9.848  -2.965 -15.010
   88   1HE   LYS  16          2HE       LYS  16 -12.277  -3.731 -14.248
   89   2HE   LYS  16          1HE       LYS  16 -12.467  -4.050 -15.983
   90   1HZ   LYS  16          1HZ       LYS  16 -10.638  -5.275 -14.064
   91   2HZ   LYS  16          2HZ       LYS  16 -10.033  -4.992 -15.626
   92   3HZ   LYS  16          3HZ       LYS  16 -11.411  -5.960 -15.408
   93    H    TYR  17           H        TYR  17  -9.753   0.989 -12.885
   94    HA   TYR  17           HA       TYR  17  -9.026   0.660 -10.120
   95   1HB   TYR  17          2HB       TYR  17  -8.197   2.665 -12.250
   96   2HB   TYR  17          1HB       TYR  17  -7.335   2.388 -10.745
   97    HD1  TYR  17           HD1      TYR  17  -8.709  -0.695 -11.868
   98    HD2  TYR  17           HD2      TYR  17  -5.478   2.046 -12.589
   99    HE1  TYR  17           HE1      TYR  17  -7.414  -2.502 -12.952
  100    HE2  TYR  17           HE2      TYR  17  -4.177   0.231 -13.666
  101    HH   TYR  17           HH       TYR  17  -5.433  -2.489 -14.804
  102    H    ASP  18           H        ASP  18 -10.896   2.939 -11.979
  103    HA   ASP  18           HA       ASP  18 -11.016   4.930  -9.783
  104   1HB   ASP  18          2HB       ASP  18 -10.876   5.780 -12.017
  105   2HB   ASP  18          1HB       ASP  18 -12.134   4.680 -12.587
  106    H    ALA  19           H        ALA  19 -12.689   2.108 -10.757
  107    HA   ALA  19           HA       ALA  19 -15.259   2.960  -9.515
  108   1HB   ALA  19          1HB       ALA  19 -14.922   0.147 -10.264
  109   2HB   ALA  19          2HB       ALA  19 -14.485   1.232 -11.584
  110   3HB   ALA  19          3HB       ALA  19 -16.094   1.321 -10.866
  111    H    ILE  20           H        ILE  20 -12.381   1.108  -9.006
  112    HA   ILE  20           HA       ILE  20 -13.278  -0.211  -6.550
  113    HB   ILE  20           HB       ILE  20 -10.687   0.135  -8.090
  114   1HG1  ILE  20          2HG1      ILE  20 -12.221  -2.416  -7.615
  115   2HG1  ILE  20          1HG1      ILE  20 -12.682  -1.316  -8.915
  116   1HG2  ILE  20          1HG2      ILE  20  -9.519  -0.990  -6.504
  117   2HG2  ILE  20          2HG2      ILE  20 -10.909  -1.958  -6.016
  118   3HG2  ILE  20          3HG2      ILE  20 -10.737  -0.303  -5.435
  119   1HD1  ILE  20          1HD1      ILE  20 -10.864  -3.271  -9.264
  120   2HD1  ILE  20          2HD1      ILE  20  -9.791  -1.989  -8.702
  121   3HD1  ILE  20          3HD1      ILE  20 -10.785  -1.740 -10.139
  122    H    PHE  21           H        PHE  21 -11.375   2.564  -7.604
  123    HA   PHE  21           HA       PHE  21 -10.381   3.350  -5.005
  124   1HB   PHE  21          2HB       PHE  21  -9.151   4.255  -6.744
  125   2HB   PHE  21          1HB       PHE  21 -10.556   4.378  -7.797
  126    HD1  PHE  21           HD1      PHE  21  -8.357   6.145  -5.570
  127    HD2  PHE  21           HD2      PHE  21 -12.297   6.191  -7.280
  128    HE1  PHE  21           HE1      PHE  21  -8.564   8.555  -5.031
  129    HE2  PHE  21           HE2      PHE  21 -12.506   8.601  -6.740
  130    HZ   PHE  21           HZ       PHE  21 -10.645   9.782  -5.615
  131    H    ASP  22           H        ASP  22 -13.171   4.209  -6.995
  132    HA   ASP  22           HA       ASP  22 -14.201   6.126  -5.015
  133   1HB   ASP  22          2HB       ASP  22 -14.412   6.623  -7.365
  134   2HB   ASP  22          1HB       ASP  22 -15.148   5.048  -7.686
  135    H    SER  23           H        SER  23 -14.205   2.799  -5.263
  136    HA   SER  23           HA       SER  23 -16.991   2.349  -4.380
  137   1HB   SER  23          2HB       SER  23 -16.077   0.679  -5.807
  138   2HB   SER  23          1HB       SER  23 -14.543   0.664  -4.944
  139    HG   SER  23           HG       SER  23 -15.692  -0.202  -3.144
  140    H    LEU  24           H        LEU  24 -14.002   3.182  -3.024
  141    HA   LEU  24           HA       LEU  24 -14.594   2.007  -0.346
  142   1HB   LEU  24          2HB       LEU  24 -12.200   3.677  -1.082
  143   2HB   LEU  24          1HB       LEU  24 -12.298   2.334   0.052
  144    HG   LEU  24           HG       LEU  24 -12.762   1.848  -2.875
  145   1HD1  LEU  24          1HD1      LEU  24 -10.348   2.889  -1.732
  146   2HD1  LEU  24          2HD1      LEU  24 -10.646   2.394  -3.398
  147   3HD1  LEU  24          3HD1      LEU  24 -10.073   1.218  -2.217
  148   1HD2  LEU  24          1HD2      LEU  24 -11.521   0.218  -0.637
  149   2HD2  LEU  24          2HD2      LEU  24 -11.879  -0.362  -2.264
  150   3HD2  LEU  24          3HD2      LEU  24 -13.196   0.076  -1.175
  151    H    SER  25           H        SER  25 -14.960   4.804  -2.189
  152    HA   SER  25           HA       SER  25 -16.075   6.835  -1.559
  153   1HB   SER  25          2HB       SER  25 -15.223   6.366   1.291
  154   2HB   SER  25          1HB       SER  25 -16.644   7.213   0.690
  155    HG   SER  25           HG       SER  25 -17.593   5.366   1.025
  156    HA   PRO  26           HA       PRO  26 -11.851   8.425  -1.799
  157   1HB   PRO  26          2HB       PRO  26 -12.425  10.278  -3.717
  158   2HB   PRO  26          1HB       PRO  26 -12.110   8.572  -4.091
  159   1HG   PRO  26          2HG       PRO  26 -14.691  10.026  -3.922
  160   2HG   PRO  26          1HG       PRO  26 -14.189   8.736  -5.026
  161   1HD   PRO  26          2HD       PRO  26 -15.801   8.360  -2.835
  162   2HD   PRO  26          1HD       PRO  26 -14.808   7.089  -3.573
  163    H    VAL  27           H        VAL  27 -10.988  10.348  -0.980
  164    HA   VAL  27           HA       VAL  27 -12.955  12.288   0.191
  165    HB   VAL  27           HB       VAL  27 -10.222  11.362   1.152
  166   1HG1  VAL  27          1HG1      VAL  27 -10.650  13.656   1.845
  167   2HG1  VAL  27          2HG1      VAL  27 -10.870  12.595   3.236
  168   3HG1  VAL  27          3HG1      VAL  27 -12.276  13.228   2.379
  169   1HG2  VAL  27          1HG2      VAL  27 -12.752  10.123   1.335
  170   2HG2  VAL  27          2HG2      VAL  27 -12.461  10.845   2.918
  171   3HG2  VAL  27          3HG2      VAL  27 -11.297   9.705   2.242
  172    H    ASN  28           H        ASN  28 -12.855  14.057  -1.181
  173    HA   ASN  28           HA       ASN  28 -11.922  15.862  -2.385
  174   1HB   ASN  28          2HB       ASN  28 -10.840  16.290  -0.235
  175   2HB   ASN  28          1HB       ASN  28  -9.598  15.090  -0.585
  176   1HD2  ASN  28          1HD2      ASN  28  -7.740  15.847  -1.625
  177   2HD2  ASN  28          2HD2      ASN  28  -7.610  17.357  -2.392
  178    H    GLY  29           H        GLY  29 -11.534  12.905  -3.182
  179   1HA   GLY  29          2HA       GLY  29 -10.736  12.045  -5.260
  180   2HA   GLY  29          1HA       GLY  29  -9.704  13.466  -5.424
  181    H    PHE  30           H        PHE  30  -9.914  11.287  -2.631
  182    HA   PHE  30           HA       PHE  30  -7.251  10.147  -3.280
  183   1HB   PHE  30          2HB       PHE  30  -7.920  11.929  -0.926
  184   2HB   PHE  30          1HB       PHE  30  -6.460  10.935  -0.999
  185    HD1  PHE  30           HD1      PHE  30  -8.163  13.897  -2.295
  186    HD2  PHE  30           HD2      PHE  30  -4.783  11.305  -2.743
  187    HE1  PHE  30           HE1      PHE  30  -7.063  15.597  -3.716
  188    HE2  PHE  30           HE2      PHE  30  -3.663  13.008  -4.171
  189    HZ   PHE  30           HZ       PHE  30  -4.806  15.158  -4.657
  190    H    LEU  31           H        LEU  31  -6.727   8.312  -1.997
  191    HA   LEU  31           HA       LEU  31  -8.976   7.227  -0.320
  192   1HB   LEU  31          2HB       LEU  31  -7.168   5.946  -2.376
  193   2HB   LEU  31          1HB       LEU  31  -7.945   4.974  -1.126
  194    HG   LEU  31           HG       LEU  31  -9.264   6.615  -3.286
  195   1HD1  LEU  31          1HD1      LEU  31  -8.949   4.491  -4.138
  196   2HD1  LEU  31          2HD1      LEU  31 -10.462   4.224  -3.273
  197   3HD1  LEU  31          3HD1      LEU  31  -8.929   3.747  -2.534
  198   1HD2  LEU  31          1HD2      LEU  31 -10.550   7.120  -1.324
  199   2HD2  LEU  31          2HD2      LEU  31 -10.420   5.462  -0.736
  200   3HD2  LEU  31          3HD2      LEU  31 -11.413   5.821  -2.150
  201    H    SER  32           H        SER  32  -8.309   6.504   1.692
  202    HA   SER  32           HA       SER  32  -5.467   6.962   2.376
  203   1HB   SER  32          2HB       SER  32  -6.291   7.301   4.498
  204   2HB   SER  32          1HB       SER  32  -7.794   7.553   3.616
  205    HG   SER  32           HG       SER  32  -8.474   5.593   4.191
  206    H    GLY  33           H        GLY  33  -4.114   5.373   3.187
  207   1HA   GLY  33          2HA       GLY  33  -4.095   2.815   2.141
  208   2HA   GLY  33          1HA       GLY  33  -3.390   3.172   3.720
  209    H    ASP  34           H        ASP  34  -6.038   4.015   4.779
  210    HA   ASP  34           HA       ASP  34  -6.895   1.556   5.942
  211   1HB   ASP  34          2HB       ASP  34  -7.186   3.923   6.777
  212   2HB   ASP  34          1HB       ASP  34  -8.460   4.126   5.574
  213    H    LYS  35           H        LYS  35  -7.812   3.163   2.940
  214    HA   LYS  35           HA       LYS  35 -10.096   1.283   2.581
  215   1HB   LYS  35          2HB       LYS  35  -9.154   3.687   0.978
  216   2HB   LYS  35          1HB       LYS  35 -10.698   2.856   0.798
  217   1HG   LYS  35          2HG       LYS  35 -11.198   3.416   3.203
  218   2HG   LYS  35          1HG       LYS  35  -9.739   4.406   3.217
  219   1HD   LYS  35          2HD       LYS  35 -10.621   5.961   1.702
  220   2HD   LYS  35          1HD       LYS  35 -11.819   4.822   1.085
  221   1HE   LYS  35          2HE       LYS  35 -13.213   6.055   2.459
  222   2HE   LYS  35          1HE       LYS  35 -12.594   4.928   3.683
  223   1HZ   LYS  35          1HZ       LYS  35 -10.743   6.483   4.066
  224   2HZ   LYS  35          2HZ       LYS  35 -12.251   7.170   4.443
  225   3HZ   LYS  35          3HZ       LYS  35 -11.461   7.588   2.998
  226    H    VAL  36           H        VAL  36  -6.905   2.146   1.410
  227    HA   VAL  36           HA       VAL  36  -7.067   0.419  -0.960
  228    HB   VAL  36           HB       VAL  36  -4.828   1.910   0.424
  229   1HG1  VAL  36          1HG1      VAL  36  -3.470   1.431  -1.472
  230   2HG1  VAL  36          2HG1      VAL  36  -4.835   0.784  -2.380
  231   3HG1  VAL  36          3HG1      VAL  36  -4.185  -0.108  -1.004
  232   1HG2  VAL  36          1HG2      VAL  36  -5.235   3.654  -1.099
  233   2HG2  VAL  36          2HG2      VAL  36  -6.866   3.110  -0.705
  234   3HG2  VAL  36          3HG2      VAL  36  -6.106   2.601  -2.214
  235    H    LYS  37           H        LYS  37  -5.261   0.358   2.145
  236    HA   LYS  37           HA       LYS  37  -3.761  -1.933   1.920
  237   1HB   LYS  37          2HB       LYS  37  -3.860  -0.523   3.911
  238   2HB   LYS  37          1HB       LYS  37  -5.507  -1.053   4.242
  239   1HG   LYS  37          2HG       LYS  37  -4.586  -3.431   4.339
  240   2HG   LYS  37          1HG       LYS  37  -2.977  -2.705   4.343
  241   1HD   LYS  37          2HD       LYS  37  -3.162  -2.409   6.565
  242   2HD   LYS  37          1HD       LYS  37  -4.486  -1.283   6.267
  243   1HE   LYS  37          2HE       LYS  37  -5.739  -2.788   7.454
  244   2HE   LYS  37          1HE       LYS  37  -5.729  -3.733   5.952
  245   1HZ   LYS  37          1HZ       LYS  37  -4.808  -4.796   8.115
  246   2HZ   LYS  37          2HZ       LYS  37  -3.425  -3.866   7.779
  247   3HZ   LYS  37          3HZ       LYS  37  -3.973  -5.018   6.657
  248    HA   PRO  38           HA       PRO  38  -7.516  -4.773   2.920
  249   1HB   PRO  38          2HB       PRO  38 -10.009  -3.703   2.513
  250   2HB   PRO  38          1HB       PRO  38  -9.190  -3.681   4.088
  251   1HG   PRO  38          2HG       PRO  38  -9.413  -1.527   2.039
  252   2HG   PRO  38          1HG       PRO  38  -9.543  -1.422   3.802
  253   1HD   PRO  38          2HD       PRO  38  -7.311  -0.697   2.484
  254   2HD   PRO  38          1HD       PRO  38  -7.266  -1.420   4.108
  255    H    VAL  39           H        VAL  39  -7.854  -2.285   0.461
  256    HA   VAL  39           HA       VAL  39  -9.168  -3.856  -1.561
  257    HB   VAL  39           HB       VAL  39  -7.617  -1.312  -1.302
  258   1HG1  VAL  39          1HG1      VAL  39  -6.699  -1.509  -3.358
  259   2HG1  VAL  39          2HG1      VAL  39  -8.340  -1.300  -3.969
  260   3HG1  VAL  39          3HG1      VAL  39  -7.683  -2.919  -3.756
  261   1HG2  VAL  39          1HG2      VAL  39  -9.687  -0.435  -1.435
  262   2HG2  VAL  39          2HG2      VAL  39 -10.307  -2.084  -1.368
  263   3HG2  VAL  39          3HG2      VAL  39 -10.026  -1.310  -2.928
  264    H    LEU  40           H        LEU  40  -5.757  -3.315  -0.712
  265    HA   LEU  40           HA       LEU  40  -4.750  -4.837  -3.008
  266   1HB   LEU  40          2HB       LEU  40  -3.385  -3.879  -0.472
  267   2HB   LEU  40          1HB       LEU  40  -2.600  -4.306  -1.992
  268    HG   LEU  40           HG       LEU  40  -4.604  -2.061  -1.662
  269   1HD1  LEU  40          1HD1      LEU  40  -2.389  -0.759  -2.256
  270   2HD1  LEU  40          2HD1      LEU  40  -1.606  -2.185  -1.578
  271   3HD1  LEU  40          3HD1      LEU  40  -2.711  -1.231  -0.587
  272   1HD2  LEU  40          1HD2      LEU  40  -2.941  -3.097  -3.965
  273   2HD2  LEU  40          2HD2      LEU  40  -3.608  -1.464  -3.954
  274   3HD2  LEU  40          3HD2      LEU  40  -4.688  -2.860  -3.905
  275    H    LEU  41           H        LEU  41  -5.629  -5.436   0.317
  276    HA   LEU  41           HA       LEU  41  -4.185  -7.937   0.597
  277   1HB   LEU  41          2HB       LEU  41  -6.459  -6.551   2.030
  278   2HB   LEU  41          1HB       LEU  41  -5.838  -8.116   2.553
  279    HG   LEU  41           HG       LEU  41  -3.986  -5.783   2.108
  280   1HD1  LEU  41          1HD1      LEU  41  -5.568  -6.488   4.595
  281   2HD1  LEU  41          2HD1      LEU  41  -5.613  -4.967   3.703
  282   3HD1  LEU  41          3HD1      LEU  41  -4.162  -5.424   4.599
  283   1HD2  LEU  41          1HD2      LEU  41  -3.740  -8.532   2.855
  284   2HD2  LEU  41          2HD2      LEU  41  -3.301  -7.552   4.254
  285   3HD2  LEU  41          3HD2      LEU  41  -2.458  -7.326   2.721
  286    H    ASN  42           H        ASN  42  -6.975  -6.969  -1.100
  287    HA   ASN  42           HA       ASN  42  -8.380  -9.528  -0.873
  288   1HB   ASN  42          2HB       ASN  42  -8.798  -6.829  -1.913
  289   2HB   ASN  42          1HB       ASN  42  -9.424  -8.062  -3.008
  290   1HD2  ASN  42          1HD2      ASN  42 -10.293  -6.208  -0.349
  291   2HD2  ASN  42          2HD2      ASN  42 -11.530  -7.193   0.268
  292    H    SER  43           H        SER  43  -5.767  -8.336  -2.683
  293    HA   SER  43           HA       SER  43  -6.257  -9.868  -5.137
  294   1HB   SER  43          2HB       SER  43  -4.584  -8.519  -5.878
  295   2HB   SER  43          1HB       SER  43  -4.714  -7.702  -4.324
  296    HG   SER  43           HG       SER  43  -2.660  -8.329  -4.317
  297    H    LYS  44           H        LYS  44  -5.698 -10.925  -2.127
  298    HA   LYS  44           HA       LYS  44  -4.846 -12.954  -1.274
  299   1HB   LYS  44          2HB       LYS  44  -5.656 -13.376  -3.880
  300   2HB   LYS  44          1HB       LYS  44  -3.986 -13.948  -3.908
  301   1HG   LYS  44          2HG       LYS  44  -4.554 -15.239  -1.767
  302   2HG   LYS  44          1HG       LYS  44  -6.243 -14.883  -2.129
  303   1HD   LYS  44          2HD       LYS  44  -4.958 -15.839  -4.517
  304   2HD   LYS  44          1HD       LYS  44  -4.648 -16.973  -3.201
  305   1HE   LYS  44          2HE       LYS  44  -7.093 -17.011  -2.691
  306   2HE   LYS  44          1HE       LYS  44  -7.373 -15.963  -4.096
  307   1HZ   LYS  44          1HZ       LYS  44  -5.783 -18.441  -4.337
  308   2HZ   LYS  44          2HZ       LYS  44  -6.575 -17.563  -5.557
  309   3HZ   LYS  44          3HZ       LYS  44  -7.474 -18.488  -4.451
  310    H    LEU  45           H        LEU  45  -3.083 -10.542  -2.447
  311    HA   LEU  45           HA       LEU  45  -0.455 -11.880  -2.672
  312   1HB   LEU  45          2HB       LEU  45  -1.623  -9.137  -2.983
  313   2HB   LEU  45          1HB       LEU  45   0.116  -9.285  -2.736
  314    HG   LEU  45           HG       LEU  45  -1.461 -10.713  -4.896
  315   1HD1  LEU  45          1HD1      LEU  45  -1.198  -8.854  -6.139
  316   2HD1  LEU  45          2HD1      LEU  45   0.541  -8.888  -5.848
  317   3HD1  LEU  45          3HD1      LEU  45  -0.522  -8.032  -4.733
  318   1HD2  LEU  45          1HD2      LEU  45   0.454 -11.837  -5.410
  319   2HD2  LEU  45          2HD2      LEU  45   0.937 -11.455  -3.760
  320   3HD2  LEU  45          3HD2      LEU  45   1.469 -10.433  -5.094
  321    HA   PRO  46           HA       PRO  46   0.546 -11.287   1.559
  322   1HB   PRO  46          2HB       PRO  46   3.274 -11.150   1.382
  323   2HB   PRO  46          1HB       PRO  46   2.368 -12.661   1.186
  324   1HG   PRO  46          2HG       PRO  46   3.593 -10.917  -0.864
  325   2HG   PRO  46          1HG       PRO  46   3.422 -12.676  -0.830
  326   1HD   PRO  46          2HD       PRO  46   1.824 -10.974  -2.290
  327   2HD   PRO  46          1HD       PRO  46   1.368 -12.617  -1.803
  328    H    VAL  47           H        VAL  47   1.880  -9.683   2.948
  329    HA   VAL  47           HA       VAL  47   1.201  -6.980   2.250
  330    HB   VAL  47           HB       VAL  47   2.692  -8.459   4.410
  331   1HG1  VAL  47          1HG1      VAL  47   3.808  -6.207   3.969
  332   2HG1  VAL  47          2HG1      VAL  47   3.180  -6.447   5.596
  333   3HG1  VAL  47          3HG1      VAL  47   2.280  -5.469   4.444
  334   1HG2  VAL  47          1HG2      VAL  47   0.535  -6.610   5.110
  335   2HG2  VAL  47          2HG2      VAL  47   0.718  -8.320   5.499
  336   3HG2  VAL  47          3HG2      VAL  47   0.032  -7.838   3.948
  337    H    ASP  48           H        ASP  48   3.739  -8.972   1.262
  338    HA   ASP  48           HA       ASP  48   5.848  -6.960   1.226
  339   1HB   ASP  48          2HB       ASP  48   5.480  -9.697  -0.022
  340   2HB   ASP  48          1HB       ASP  48   6.987  -8.783  -0.094
  341    H    ILE  49           H        ILE  49   3.414  -8.241  -0.986
  342    HA   ILE  49           HA       ILE  49   4.475  -6.780  -3.297
  343    HB   ILE  49           HB       ILE  49   1.699  -7.930  -2.996
  344   1HG1  ILE  49          2HG1      ILE  49   3.151  -9.654  -2.105
  345   2HG1  ILE  49          1HG1      ILE  49   2.696 -10.115  -3.741
  346   1HG2  ILE  49          1HG2      ILE  49   2.336  -8.601  -5.419
  347   2HG2  ILE  49          2HG2      ILE  49   3.665  -7.458  -5.231
  348   3HG2  ILE  49          3HG2      ILE  49   1.996  -6.902  -5.091
  349   1HD1  ILE  49          1HD1      ILE  49   5.321  -9.017  -2.767
  350   2HD1  ILE  49          2HD1      ILE  49   4.861  -8.903  -4.468
  351   3HD1  ILE  49          3HD1      ILE  49   5.014 -10.484  -3.700
  352    H    LEU  50           H        LEU  50   1.844  -6.509  -0.970
  353    HA   LEU  50           HA       LEU  50   0.642  -4.138  -2.101
  354   1HB   LEU  50          2HB       LEU  50   0.627  -5.117   0.764
  355   2HB   LEU  50          1HB       LEU  50  -0.623  -4.180  -0.054
  356    HG   LEU  50           HG       LEU  50   0.161  -7.051  -0.612
  357   1HD1  LEU  50          1HD1      LEU  50  -1.334  -6.590   1.339
  358   2HD1  LEU  50          2HD1      LEU  50  -2.106  -7.550   0.075
  359   3HD1  LEU  50          3HD1      LEU  50  -2.476  -5.831   0.228
  360   1HD2  LEU  50          1HD2      LEU  50  -0.939  -5.065  -2.381
  361   2HD2  LEU  50          2HD2      LEU  50  -2.157  -6.296  -2.056
  362   3HD2  LEU  50          3HD2      LEU  50  -0.589  -6.761  -2.714
  363    H    GLY  51           H        GLY  51   3.284  -4.793   0.117
  364   1HA   GLY  51          2HA       GLY  51   3.500  -2.104   1.168
  365   2HA   GLY  51          1HA       GLY  51   4.778  -3.323   1.205
  366    H    ARG  52           H        ARG  52   4.406  -3.718  -1.736
  367    HA   ARG  52           HA       ARG  52   6.132  -1.463  -2.620
  368   1HB   ARG  52          2HB       ARG  52   6.249  -4.231  -2.794
  369   2HB   ARG  52          1HB       ARG  52   5.730  -3.736  -4.405
  370   1HG   ARG  52          2HG       ARG  52   7.616  -2.143  -4.519
  371   2HG   ARG  52          1HG       ARG  52   8.151  -2.674  -2.922
  372   1HD   ARG  52          2HD       ARG  52   7.785  -4.611  -5.217
  373   2HD   ARG  52          1HD       ARG  52   9.327  -3.799  -4.899
  374    HE   ARG  52           HE       ARG  52   8.180  -5.933  -3.293
  375   1HH1  ARG  52          1HH2      ARG  52  11.105  -5.519  -3.496
  376   2HH1  ARG  52          2HH2      ARG  52  11.504  -4.847  -1.950
  377   1HH2  ARG  52          2HH1      ARG  52   8.232  -4.010  -1.167
  378   2HH2  ARG  52          1HH1      ARG  52   9.879  -3.993  -0.632
  379    H    VAL  53           H        VAL  53   3.092  -3.171  -3.421
  380    HA   VAL  53           HA       VAL  53   2.681  -1.811  -5.938
  381    HB   VAL  53           HB       VAL  53   0.950  -3.281  -3.950
  382   1HG1  VAL  53          1HG1      VAL  53  -0.928  -2.447  -4.873
  383   2HG1  VAL  53          2HG1      VAL  53  -0.381  -2.976  -6.464
  384   3HG1  VAL  53          3HG1      VAL  53   0.042  -1.370  -5.877
  385   1HG2  VAL  53          1HG2      VAL  53   1.227  -4.100  -6.796
  386   2HG2  VAL  53          2HG2      VAL  53   1.293  -5.083  -5.330
  387   3HG2  VAL  53          3HG2      VAL  53   2.710  -4.163  -5.839
  388    H    TRP  54           H        TRP  54   1.811  -1.068  -2.578
  389    HA   TRP  54           HA       TRP  54   0.150   1.218  -3.191
  390   1HB   TRP  54          2HB       TRP  54  -0.085   0.341  -1.011
  391   2HB   TRP  54          1HB       TRP  54   1.659   0.190  -0.786
  392    HD1  TRP  54           HD1      TRP  54   3.046   2.538  -0.563
  393    HE1  TRP  54           HE1      TRP  54   2.342   4.782   0.468
  394    HE3  TRP  54           HE3      TRP  54  -2.013   1.905  -0.462
  395    HZ2  TRP  54           HZ2      TRP  54  -0.057   6.129   1.272
  396    HZ3  TRP  54           HZ3      TRP  54  -3.486   3.691   0.450
  397    HH2  TRP  54           HH2      TRP  54  -2.514   5.784   1.312
  398    H    GLU  55           H        GLU  55   3.583   0.921  -2.167
  399    HA   GLU  55           HA       GLU  55   4.232   3.666  -2.200
  400   1HB   GLU  55          2HB       GLU  55   5.785   1.143  -2.758
  401   2HB   GLU  55          1HB       GLU  55   6.562   2.723  -2.661
  402   1HG   GLU  55          2HG       GLU  55   5.039   2.781  -0.408
  403   2HG   GLU  55          1HG       GLU  55   5.405   1.059  -0.508
  404    H    LEU  56           H        LEU  56   4.801   1.332  -4.864
  405    HA   LEU  56           HA       LEU  56   5.580   3.293  -6.794
  406   1HB   LEU  56          2HB       LEU  56   4.176   0.614  -7.115
  407   2HB   LEU  56          1HB       LEU  56   5.028   1.473  -8.400
  408    HG   LEU  56           HG       LEU  56   6.615   1.124  -5.940
  409   1HD1  LEU  56          1HD1      LEU  56   6.558  -1.355  -7.527
  410   2HD1  LEU  56          2HD1      LEU  56   5.084  -1.063  -6.605
  411   3HD1  LEU  56          3HD1      LEU  56   6.641  -1.142  -5.779
  412   1HD2  LEU  56          1HD2      LEU  56   7.629  -0.006  -8.433
  413   2HD2  LEU  56          2HD2      LEU  56   8.288   1.314  -7.465
  414   3HD2  LEU  56          3HD2      LEU  56   7.027   1.635  -8.658
  415    H    SER  57           H        SER  57   2.553   2.597  -5.340
  416    HA   SER  57           HA       SER  57   0.961   3.866  -7.507
  417   1HB   SER  57          2HB       SER  57   0.056   1.879  -6.445
  418   2HB   SER  57          1HB       SER  57   0.327   2.557  -4.842
  419    HG   SER  57           HG       SER  57  -1.778   2.958  -5.295
  420    H    ASP  58           H        ASP  58   2.233   4.408  -4.280
  421    HA   ASP  58           HA       ASP  58   0.802   6.944  -3.859
  422   1HB   ASP  58          2HB       ASP  58   1.742   5.006  -2.241
  423   2HB   ASP  58          1HB       ASP  58   3.141   6.082  -2.222
  424    H    ILE  59           H        ILE  59   1.562   8.413  -5.442
  425    HA   ILE  59           HA       ILE  59   4.493   8.762  -5.761
  426    HB   ILE  59           HB       ILE  59   1.994   9.694  -7.167
  427   1HG1  ILE  59          2HG1      ILE  59   4.169   8.512  -8.713
  428   2HG1  ILE  59          1HG1      ILE  59   3.659   7.464  -7.388
  429   1HG2  ILE  59          1HG2      ILE  59   3.310  11.634  -7.373
  430   2HG2  ILE  59          2HG2      ILE  59   3.744  10.713  -8.813
  431   3HG2  ILE  59          3HG2      ILE  59   4.817  10.719  -7.413
  432   1HD1  ILE  59          1HD1      ILE  59   2.306   8.005  -9.875
  433   2HD1  ILE  59          2HD1      ILE  59   1.288   8.504  -8.524
  434   3HD1  ILE  59          3HD1      ILE  59   1.883   6.845  -8.615
  435    H    ASP  60           H        ASP  60   1.769  10.286  -4.191
  436    HA   ASP  60           HA       ASP  60   3.270  12.827  -3.856
  437   1HB   ASP  60          2HB       ASP  60   1.140  13.634  -2.960
  438   2HB   ASP  60          1HB       ASP  60   0.856  12.780  -4.476
  439    H    HIS  61           H        HIS  61   2.745   9.862  -2.209
  440    HA   HIS  61           HA       HIS  61   3.444   9.117  -0.087
  441   1HB   HIS  61          2HB       HIS  61   4.984  11.674  -0.498
  442   2HB   HIS  61          1HB       HIS  61   5.145  10.753   0.994
  443    HD1  HIS  61           HD1      HIS  61   7.690  10.435   0.019
  444    HD2  HIS  61           HD2      HIS  61   4.648   8.391  -1.970
  445    HE1  HIS  61           HE1      HIS  61   8.819   8.632  -1.352
  446    H    ASP  62           H        ASP  62   0.921  10.365  -0.190
  447    HA   ASP  62           HA       ASP  62   0.850  12.035   2.293
  448   1HB   ASP  62          2HB       ASP  62  -1.281  12.803   1.423
  449   2HB   ASP  62          1HB       ASP  62  -0.119  12.854   0.098
  450    H    GLY  63           H        GLY  63   0.990   8.948   1.824
  451   1HA   GLY  63          2HA       GLY  63   0.119   7.053   2.896
  452   2HA   GLY  63          1HA       GLY  63  -0.598   8.166   4.063
  453    H    MET  64           H        MET  64  -1.276   8.341   0.619
  454    HA   MET  64           HA       MET  64  -3.903   6.984   0.961
  455   1HB   MET  64          2HB       MET  64  -3.627   9.849  -0.016
  456   2HB   MET  64          1HB       MET  64  -5.120   8.945   0.136
  457   1HG   MET  64          2HG       MET  64  -3.631   9.064   2.649
  458   2HG   MET  64          1HG       MET  64  -4.063  10.651   2.035
  459   1HE   MET  64          1HE       MET  64  -6.890   9.425   0.353
  460   2HE   MET  64          2HE       MET  64  -6.283  11.002   0.857
  461   3HE   MET  64          3HE       MET  64  -7.832  10.425   1.466
  462    H    LEU  65           H        LEU  65  -4.937   6.649  -1.201
  463    HA   LEU  65           HA       LEU  65  -2.907   6.685  -3.408
  464   1HB   LEU  65          2HB       LEU  65  -5.119   4.848  -2.546
  465   2HB   LEU  65          1HB       LEU  65  -4.677   4.894  -4.250
  466    HG   LEU  65           HG       LEU  65  -2.929   4.153  -1.897
  467   1HD1  LEU  65          1HD1      LEU  65  -4.443   2.474  -3.074
  468   2HD1  LEU  65          2HD1      LEU  65  -2.728   2.059  -3.039
  469   3HD1  LEU  65          3HD1      LEU  65  -3.448   2.717  -4.507
  470   1HD2  LEU  65          1HD2      LEU  65  -1.467   5.504  -3.186
  471   2HD2  LEU  65          2HD2      LEU  65  -2.183   4.973  -4.708
  472   3HD2  LEU  65          3HD2      LEU  65  -1.167   3.870  -3.779
  473    H    ASP  66           H        ASP  66  -3.363   8.514  -4.626
  474    HA   ASP  66           HA       ASP  66  -5.991   9.677  -4.880
  475   1HB   ASP  66          2HB       ASP  66  -3.771   9.969  -6.904
  476   2HB   ASP  66          1HB       ASP  66  -4.902  11.191  -6.333
  477    H    ARG  67           H        ARG  67  -7.452   9.508  -6.668
  478    HA   ARG  67           HA       ARG  67  -8.064   7.095  -7.821
  479   1HB   ARG  67          2HB       ARG  67  -9.002   8.505  -9.714
  480   2HB   ARG  67          1HB       ARG  67  -9.439   9.055  -8.095
  481   1HG   ARG  67          2HG       ARG  67  -7.414  10.597  -8.210
  482   2HG   ARG  67          1HG       ARG  67  -7.315  10.191  -9.924
  483   1HD   ARG  67          2HD       ARG  67 -10.031  10.943  -9.068
  484   2HD   ARG  67          1HD       ARG  67  -8.841  12.250  -8.907
  485    HE   ARG  67           HE       ARG  67  -8.191  11.708 -11.315
  486   1HH1  ARG  67          1HH2      ARG  67 -10.079   9.305 -11.440
  487   2HH1  ARG  67          2HH2      ARG  67 -11.404   9.971 -12.334
  488   1HH2  ARG  67          2HH1      ARG  67 -10.420  13.261 -11.858
  489   2HH2  ARG  67          1HH1      ARG  67 -11.597  12.208 -12.571
  490    H    ASP  68           H        ASP  68  -5.618   9.376  -9.012
  491    HA   ASP  68           HA       ASP  68  -4.957   7.776 -11.368
  492   1HB   ASP  68          2HB       ASP  68  -4.272  10.327 -10.119
  493   2HB   ASP  68          1HB       ASP  68  -2.844   9.516 -10.761
  494    H    GLU  69           H        GLU  69  -3.691   8.205  -8.104
  495    HA   GLU  69           HA       GLU  69  -1.335   6.534  -8.468
  496   1HB   GLU  69          2HB       GLU  69  -2.946   7.616  -6.152
  497   2HB   GLU  69          1HB       GLU  69  -1.529   6.605  -5.891
  498   1HG   GLU  69          2HG       GLU  69  -0.196   8.197  -7.271
  499   2HG   GLU  69          1HG       GLU  69  -1.619   9.233  -7.388
  500    H    PHE  70           H        PHE  70  -4.492   6.119  -6.874
  501    HA   PHE  70           HA       PHE  70  -4.328   3.434  -6.110
  502   1HB   PHE  70          2HB       PHE  70  -6.154   5.156  -5.725
  503   2HB   PHE  70          1HB       PHE  70  -6.697   4.853  -7.374
  504    HD1  PHE  70           HD1      PHE  70  -6.790   3.729  -3.954
  505    HD2  PHE  70           HD2      PHE  70  -7.360   2.475  -8.021
  506    HE1  PHE  70           HE1      PHE  70  -8.098   1.776  -3.166
  507    HE2  PHE  70           HE2      PHE  70  -8.670   0.523  -7.235
  508    HZ   PHE  70           HZ       PHE  70  -9.041   0.175  -4.809
  509    H    ALA  71           H        ALA  71  -4.624   4.849  -9.312
  510    HA   ALA  71           HA       ALA  71  -5.536   2.456 -10.669
  511   1HB   ALA  71          1HB       ALA  71  -5.051   5.147 -11.228
  512   2HB   ALA  71          2HB       ALA  71  -5.584   3.935 -12.392
  513   3HB   ALA  71          3HB       ALA  71  -3.866   4.290 -12.214
  514    H    VAL  72           H        VAL  72  -2.316   3.972 -10.480
  515    HA   VAL  72           HA       VAL  72  -0.815   1.982 -11.794
  516    HB   VAL  72           HB       VAL  72  -0.104   3.663  -9.369
  517   1HG1  VAL  72          1HG1      VAL  72   1.586   1.955  -9.862
  518   2HG1  VAL  72          2HG1      VAL  72   2.200   3.550 -10.301
  519   3HG1  VAL  72          3HG1      VAL  72   1.620   2.451 -11.554
  520   1HG2  VAL  72          1HG2      VAL  72   0.070   5.495 -10.738
  521   2HG2  VAL  72          2HG2      VAL  72  -1.077   4.604 -11.738
  522   3HG2  VAL  72          3HG2      VAL  72   0.646   4.538 -12.104
  523    H    ALA  73           H        ALA  73  -2.317   1.932  -8.635
  524    HA   ALA  73           HA       ALA  73  -0.699  -0.343  -7.666
  525   1HB   ALA  73          1HB       ALA  73  -1.332   0.603  -5.732
  526   2HB   ALA  73          2HB       ALA  73  -3.023   0.243  -6.100
  527   3HB   ALA  73          3HB       ALA  73  -2.303   1.766  -6.637
  528    H    MET  74           H        MET  74  -3.646   0.040  -9.479
  529    HA   MET  74           HA       MET  74  -4.819  -2.472  -8.494
  530   1HB   MET  74          2HB       MET  74  -5.507  -0.834 -10.953
  531   2HB   MET  74          1HB       MET  74  -6.543  -2.007 -10.153
  532   1HG   MET  74          2HG       MET  74  -5.974   0.806  -9.440
  533   2HG   MET  74          1HG       MET  74  -7.418  -0.151  -9.158
  534   1HE   MET  74          1HE       MET  74  -7.457  -1.896  -6.454
  535   2HE   MET  74          2HE       MET  74  -5.882  -2.657  -6.658
  536   3HE   MET  74          3HE       MET  74  -6.913  -2.393  -8.063
  537    H    PHE  75           H        PHE  75  -3.079  -1.432 -11.423
  538    HA   PHE  75           HA       PHE  75  -3.240  -4.093 -12.619
  539   1HB   PHE  75          2HB       PHE  75  -2.205  -3.047 -14.427
  540   2HB   PHE  75          1HB       PHE  75  -2.914  -1.646 -13.628
  541    HD1  PHE  75           HD1      PHE  75   0.172  -3.397 -14.479
  542    HD2  PHE  75           HD2      PHE  75  -1.518  -0.178 -12.194
  543    HE1  PHE  75           HE1      PHE  75   2.433  -2.433 -14.172
  544    HE2  PHE  75           HE2      PHE  75   0.740   0.788 -11.885
  545    HZ   PHE  75           HZ       PHE  75   2.722  -0.344 -12.871
  546    H    LEU  76           H        LEU  76  -1.147  -2.365 -10.440
  547    HA   LEU  76           HA       LEU  76   1.181  -4.079 -10.660
  548   1HB   LEU  76          2HB       LEU  76   0.165  -1.826  -9.064
  549   2HB   LEU  76          1HB       LEU  76   1.228  -2.907  -8.169
  550    HG   LEU  76           HG       LEU  76   1.860  -1.547 -10.800
  551   1HD1  LEU  76          1HD1      LEU  76   2.282  -0.879  -7.994
  552   2HD1  LEU  76          2HD1      LEU  76   2.529   0.118  -9.428
  553   3HD1  LEU  76          3HD1      LEU  76   3.804  -0.970  -8.879
  554   1HD2  LEU  76          1HD2      LEU  76   4.170  -2.690  -9.670
  555   2HD2  LEU  76          2HD2      LEU  76   3.324  -3.235 -11.117
  556   3HD2  LEU  76          3HD2      LEU  76   2.931  -3.939  -9.550
  557    H    VAL  77           H        VAL  77  -1.825  -4.152  -8.890
  558    HA   VAL  77           HA       VAL  77  -0.928  -6.366  -7.138
  559    HB   VAL  77           HB       VAL  77  -3.414  -4.656  -7.463
  560   1HG1  VAL  77          1HG1      VAL  77  -4.394  -6.696  -6.826
  561   2HG1  VAL  77          2HG1      VAL  77  -4.075  -5.929  -5.270
  562   3HG1  VAL  77          3HG1      VAL  77  -2.992  -7.183  -5.874
  563   1HG2  VAL  77          1HG2      VAL  77  -2.251  -3.388  -5.998
  564   2HG2  VAL  77          2HG2      VAL  77  -1.009  -4.627  -5.828
  565   3HG2  VAL  77          3HG2      VAL  77  -2.453  -4.684  -4.819
  566    H    TYR  78           H        TYR  78  -2.676  -5.880 -10.112
  567    HA   TYR  78           HA       TYR  78  -3.927  -8.561 -10.006
  568   1HB   TYR  78          2HB       TYR  78  -4.120  -6.057 -11.546
  569   2HB   TYR  78          1HB       TYR  78  -4.288  -7.506 -12.537
  570    HD1  TYR  78           HD1      TYR  78  -6.140  -5.186 -10.787
  571    HD2  TYR  78           HD2      TYR  78  -5.706  -9.446 -11.160
  572    HE1  TYR  78           HE1      TYR  78  -8.452  -5.494  -9.945
  573    HE2  TYR  78           HE2      TYR  78  -8.023  -9.752 -10.318
  574    HH   TYR  78           HH       TYR  78 -10.068  -8.547 -10.084
  575    H    CYS  79           H        CYS  79  -1.086  -6.996 -11.241
  576    HA   CYS  79           HA       CYS  79  -0.472  -9.083 -13.219
  577   1HB   CYS  79          2HB       CYS  79   0.839  -6.597 -12.118
  578   2HB   CYS  79          1HB       CYS  79   1.738  -7.693 -13.168
  579    HG   CYS  79           HG       CYS  79   0.130  -7.177 -15.099
  580    H    ALA  80           H        ALA  80  -0.018  -8.542  -9.836
  581    HA   ALA  80           HA       ALA  80   2.336 -10.309  -9.616
  582   1HB   ALA  80          1HB       ALA  80   2.358  -8.618  -8.012
  583   2HB   ALA  80          2HB       ALA  80   1.573  -9.904  -7.097
  584   3HB   ALA  80          3HB       ALA  80   0.602  -8.629  -7.835
  585    H    LEU  81           H        LEU  81  -1.017 -10.625  -9.903
  586    HA   LEU  81           HA       LEU  81  -1.249 -13.100  -8.298
  587   1HB   LEU  81          2HB       LEU  81  -3.300 -11.945 -10.178
  588   2HB   LEU  81          1HB       LEU  81  -3.563 -12.801  -8.660
  589    HG   LEU  81           HG       LEU  81  -2.716  -9.959  -9.113
  590   1HD1  LEU  81          1HD1      LEU  81  -5.097 -11.176  -8.423
  591   2HD1  LEU  81          2HD1      LEU  81  -4.701  -9.482  -8.129
  592   3HD1  LEU  81          3HD1      LEU  81  -4.453 -10.680  -6.858
  593   1HD2  LEU  81          1HD2      LEU  81  -1.856 -11.789  -6.938
  594   2HD2  LEU  81          2HD2      LEU  81  -2.454 -10.211  -6.422
  595   3HD2  LEU  81          3HD2      LEU  81  -1.089 -10.318  -7.537
  596    H    GLU  82           H        GLU  82  -1.381 -12.041 -11.679
  597    HA   GLU  82           HA       GLU  82  -1.870 -14.651 -12.793
  598   1HB   GLU  82          2HB       GLU  82  -2.426 -12.741 -14.085
  599   2HB   GLU  82          1HB       GLU  82  -0.858 -11.991 -13.793
  600   1HG   GLU  82          2HG       GLU  82  -1.151 -12.988 -16.108
  601   2HG   GLU  82          1HG       GLU  82   0.258 -13.569 -15.219
  602    H    LYS  83           H        LYS  83   1.091 -12.659 -12.593
  603    HA   LYS  83           HA       LYS  83   2.808 -14.845 -11.946
  604   1HB   LYS  83          2HB       LYS  83   1.830 -14.794 -14.599
  605   2HB   LYS  83          1HB       LYS  83   3.540 -14.376 -14.674
  606   1HG   LYS  83          2HG       LYS  83   2.926 -16.597 -12.840
  607   2HG   LYS  83          1HG       LYS  83   2.572 -16.941 -14.534
  608   1HD   LYS  83          2HD       LYS  83   4.798 -17.498 -14.560
  609   2HD   LYS  83          1HD       LYS  83   4.978 -15.765 -14.831
  610   1HE   LYS  83          2HE       LYS  83   4.967 -15.633 -12.197
  611   2HE   LYS  83          1HE       LYS  83   5.444 -17.339 -12.313
  612   1HZ   LYS  83          1HZ       LYS  83   7.286 -15.580 -12.415
  613   2HZ   LYS  83          2HZ       LYS  83   6.730 -15.278 -13.992
  614   3HZ   LYS  83          3HZ       LYS  83   7.309 -16.818 -13.572
  615    H    GLU  84           H        GLU  84   2.427 -11.691 -13.450
  616    HA   GLU  84           HA       GLU  84   5.259 -11.017 -13.422
  617   1HB   GLU  84          2HB       GLU  84   2.983 -10.087 -14.630
  618   2HB   GLU  84          1HB       GLU  84   3.243  -8.859 -13.389
  619   1HG   GLU  84          2HG       GLU  84   5.636  -8.693 -14.160
  620   2HG   GLU  84          1HG       GLU  84   5.221  -9.761 -15.502
  621    HA   PRO  85           HA       PRO  85   5.120 -10.243  -8.991
  622   1HB   PRO  85          2HB       PRO  85   7.825  -9.827  -8.765
  623   2HB   PRO  85          1HB       PRO  85   7.090 -11.443  -8.807
  624   1HG   PRO  85          2HG       PRO  85   8.399  -9.905 -11.004
  625   2HG   PRO  85          1HG       PRO  85   8.528 -11.625 -10.600
  626   1HD   PRO  85          2HD       PRO  85   6.968 -10.735 -12.615
  627   2HD   PRO  85          1HD       PRO  85   6.539 -12.159 -11.638
  628    H    VAL  86           H        VAL  86   6.424  -8.295  -7.741
  629    HA   VAL  86           HA       VAL  86   6.231  -5.868  -9.493
  630    HB   VAL  86           HB       VAL  86   5.217  -6.130  -6.655
  631   1HG1  VAL  86          1HG1      VAL  86   5.320  -4.002  -8.721
  632   2HG1  VAL  86          2HG1      VAL  86   5.292  -3.863  -6.962
  633   3HG1  VAL  86          3HG1      VAL  86   3.793  -4.149  -7.850
  634   1HG2  VAL  86          1HG2      VAL  86   3.684  -6.333  -9.266
  635   2HG2  VAL  86          2HG2      VAL  86   2.975  -6.345  -7.652
  636   3HG2  VAL  86          3HG2      VAL  86   4.011  -7.676  -8.171
  637    HA   PRO  87           HA       PRO  87  10.101  -5.150  -7.343
  638   1HB   PRO  87          2HB       PRO  87  10.982  -3.218  -9.056
  639   2HB   PRO  87          1HB       PRO  87  11.054  -4.945  -9.451
  640   1HG   PRO  87          2HG       PRO  87   9.228  -2.861 -10.454
  641   2HG   PRO  87          1HG       PRO  87   9.769  -4.356 -11.226
  642   1HD   PRO  87          2HD       PRO  87   7.288  -3.906  -9.970
  643   2HD   PRO  87          1HD       PRO  87   7.935  -5.465 -10.523
  644    H    MET  88           H        MET  88  11.183  -2.679  -6.995
  645    HA   MET  88           HA       MET  88   8.982  -1.127  -5.679
  646   1HB   MET  88          2HB       MET  88  11.952  -0.801  -5.305
  647   2HB   MET  88          1HB       MET  88  10.661  -0.366  -4.190
  648   1HG   MET  88          2HG       MET  88  10.199  -2.674  -3.689
  649   2HG   MET  88          1HG       MET  88  11.244  -3.227  -4.999
  650   1HE   MET  88          1HE       MET  88  13.308  -3.675  -5.029
  651   2HE   MET  88          2HE       MET  88  13.196  -4.714  -3.611
  652   3HE   MET  88          3HE       MET  88  14.538  -3.583  -3.761
  653    H    SER  89           H        SER  89  10.245  -1.045  -8.615
  654    HA   SER  89           HA       SER  89  11.089   1.791  -8.556
  655   1HB   SER  89          2HB       SER  89  11.434  -0.564 -10.350
  656   2HB   SER  89          1HB       SER  89  11.465   1.032 -11.097
  657    HG   SER  89           HG       SER  89  12.919   0.700  -8.749
  658    H    LEU  90           H        LEU  90   9.533   3.221  -8.808
  659    HA   LEU  90           HA       LEU  90   7.147   2.544 -10.458
  660   1HB   LEU  90          2HB       LEU  90   6.283   3.428  -8.534
  661   2HB   LEU  90          1HB       LEU  90   7.816   4.161  -8.084
  662    HG   LEU  90           HG       LEU  90   7.393   6.079  -9.454
  663   1HD1  LEU  90          1HD1      LEU  90   5.535   4.241 -10.777
  664   2HD1  LEU  90          2HD1      LEU  90   6.296   5.703 -11.406
  665   3HD1  LEU  90          3HD1      LEU  90   4.809   5.816 -10.463
  666   1HD2  LEU  90          1HD2      LEU  90   4.931   5.222  -7.917
  667   2HD2  LEU  90          2HD2      LEU  90   5.182   6.857  -8.527
  668   3HD2  LEU  90          3HD2      LEU  90   6.278   6.189  -7.318
  669    HA   PRO  91           HA       PRO  91   9.800   4.907 -13.376
  670   1HB   PRO  91          2HB       PRO  91   8.603   3.807 -15.594
  671   2HB   PRO  91          1HB       PRO  91   9.949   3.041 -14.724
  672   1HG   PRO  91          2HG       PRO  91   7.010   2.523 -14.483
  673   2HG   PRO  91          1HG       PRO  91   8.347   1.364 -14.601
  674   1HD   PRO  91          2HD       PRO  91   7.240   1.920 -12.238
  675   2HD   PRO  91          1HD       PRO  91   8.999   1.684 -12.393
  676    HA   PRO  92           HA       PRO  92   6.965   8.090 -14.376
  677   1HB   PRO  92          2HB       PRO  92   7.894   8.936 -16.809
  678   2HB   PRO  92          1HB       PRO  92   8.741   9.262 -15.284
  679   1HG   PRO  92          2HG       PRO  92   9.282   7.180 -17.344
  680   2HG   PRO  92          1HG       PRO  92  10.421   8.163 -16.409
  681   1HD   PRO  92          2HD       PRO  92   9.860   5.574 -15.809
  682   2HD   PRO  92          1HD       PRO  92  10.327   6.776 -14.585
  683    H    ALA  93           H        ALA  93   7.154   5.288 -16.302
  684    HA   ALA  93           HA       ALA  93   5.194   5.977 -18.324
  685   1HB   ALA  93          1HB       ALA  93   5.224   3.484 -18.635
  686   2HB   ALA  93          2HB       ALA  93   6.216   3.350 -17.183
  687   3HB   ALA  93          3HB       ALA  93   6.842   4.184 -18.606
  688    H    LEU  94           H        LEU  94   5.035   5.459 -14.995
  689    HA   LEU  94           HA       LEU  94   2.181   4.599 -15.136
  690   1HB   LEU  94          2HB       LEU  94   4.324   4.356 -13.008
  691   2HB   LEU  94          1HB       LEU  94   2.644   3.872 -12.766
  692    HG   LEU  94           HG       LEU  94   3.911   2.800 -15.210
  693   1HD1  LEU  94          1HD1      LEU  94   5.646   2.790 -13.226
  694   2HD1  LEU  94          2HD1      LEU  94   5.409   1.331 -14.188
  695   3HD1  LEU  94          3HD1      LEU  94   4.635   1.481 -12.611
  696   1HD2  LEU  94          1HD2      LEU  94   2.412   1.470 -12.940
  697   2HD2  LEU  94          2HD2      LEU  94   2.626   0.855 -14.580
  698   3HD2  LEU  94          3HD2      LEU  94   1.613   2.269 -14.291
  699    H    VAL  95           H        VAL  95   4.027   7.307 -14.825
  700    HA   VAL  95           HA       VAL  95   2.435   8.532 -12.631
  701    HB   VAL  95           HB       VAL  95   4.880   9.378 -14.211
  702   1HG1  VAL  95          1HG1      VAL  95   3.889  11.423 -13.584
  703   2HG1  VAL  95          2HG1      VAL  95   4.991  11.086 -12.249
  704   3HG1  VAL  95          3HG1      VAL  95   3.267  10.761 -12.073
  705   1HG2  VAL  95          1HG2      VAL  95   6.133   8.733 -12.328
  706   2HG2  VAL  95          2HG2      VAL  95   4.913   7.463 -12.434
  707   3HG2  VAL  95          3HG2      VAL  95   4.728   8.770 -11.264
  708    HA   PRO  96           HA       PRO  96  -0.104  10.368 -15.818
  709   1HB   PRO  96          2HB       PRO  96  -1.636  11.866 -14.103
  710   2HB   PRO  96          1HB       PRO  96  -1.894  10.127 -14.362
  711   1HG   PRO  96          2HG       PRO  96  -0.458  11.517 -12.145
  712   2HG   PRO  96          1HG       PRO  96  -1.563  10.134 -12.078
  713   1HD   PRO  96          2HD       PRO  96   1.121   9.847 -11.938
  714   2HD   PRO  96          1HD       PRO  96   0.070   8.622 -12.689
  715    HA   PRO  97           HA       PRO  97   1.778  14.302 -16.312
  716   1HB   PRO  97          2HB       PRO  97  -0.228  15.836 -17.381
  717   2HB   PRO  97          1HB       PRO  97   0.607  14.562 -18.294
  718   1HG   PRO  97          2HG       PRO  97  -2.048  14.497 -16.950
  719   2HG   PRO  97          1HG       PRO  97  -1.546  13.787 -18.491
  720   1HD   PRO  97          2HD       PRO  97  -1.816  12.345 -16.192
  721   2HD   PRO  97          1HD       PRO  97  -0.691  11.908 -17.498
  722    H    SER  98           H        SER  98  -0.625  13.844 -14.029
  723    HA   SER  98           HA       SER  98  -0.515  16.673 -13.097
  724   1HB   SER  98          2HB       SER  98  -2.545  16.202 -12.019
  725   2HB   SER  98          1HB       SER  98  -2.648  15.131 -13.413
  726    HG   SER  98           HG       SER  98  -2.850  14.405 -10.969
  727    H    LYS  99           H        LYS  99   0.650  13.497 -12.467
  728    HA   LYS  99           HA       LYS  99   1.568  14.263  -9.737
  729   1HB   LYS  99          2HB       LYS  99   1.480  11.666 -11.310
  730   2HB   LYS  99          1HB       LYS  99   2.144  11.800  -9.681
  731   1HG   LYS  99          2HG       LYS  99  -0.518  13.008  -9.942
  732   2HG   LYS  99          1HG       LYS  99  -0.503  11.278 -10.285
  733   1HD   LYS  99          2HD       LYS  99  -0.846  11.429  -7.939
  734   2HD   LYS  99          1HD       LYS  99   0.862  11.027  -8.123
  735   1HE   LYS  99          2HE       LYS  99   1.527  13.011  -7.223
  736   2HE   LYS  99          1HE       LYS  99   0.328  13.926  -8.158
  737   1HZ   LYS  99          1HZ       LYS  99  -0.327  12.202  -5.830
  738   2HZ   LYS  99          2HZ       LYS  99  -1.395  13.215  -6.678
  739   3HZ   LYS  99          3HZ       LYS  99  -0.147  13.886  -5.739
  740    H    ARG 100           H        ARG 100   2.617  14.758 -12.802
  741    HA   ARG 100           HA       ARG 100   5.424  13.855 -12.350
  742   1HB   ARG 100          2HB       ARG 100   5.660  14.650 -14.719
  743   2HB   ARG 100          1HB       ARG 100   4.388  13.445 -14.515
  744   1HG   ARG 100          2HG       ARG 100   2.681  15.006 -14.768
  745   2HG   ARG 100          1HG       ARG 100   3.705  16.358 -14.285
  746   1HD   ARG 100          2HD       ARG 100   3.253  16.386 -16.736
  747   2HD   ARG 100          1HD       ARG 100   4.979  16.142 -16.405
  748    HE   ARG 100           HE       ARG 100   3.689  13.592 -16.473
  749   1HH1  ARG 100          1HH2      ARG 100   5.569  15.783 -18.213
  750   2HH1  ARG 100          2HH2      ARG 100   5.343  15.018 -19.750
  751   1HH2  ARG 100          2HH1      ARG 100   2.965  12.779 -18.585
  752   2HH2  ARG 100          1HH1      ARG 100   3.869  13.317 -19.961
  753    H    SER 107           1H       SER 107   7.532   3.649   4.138
  754    HA   SER 107           HA       SER 107   7.505   6.035   3.955
  755   1HB   SER 107          2HB       SER 107   6.705   6.958   1.739
  756   2HB   SER 107          1HB       SER 107   8.256   6.128   1.655
  757    HG   SER 107           HG       SER 107   5.826   5.480   0.546
  758    H    THR 108           H        THR 108   5.817   5.745   5.489
  759    HA   THR 108           HA       THR 108   3.588   5.456   6.263
  760    HB   THR 108           HB       THR 108   2.204   7.117   5.282
  761    HG1  THR 108           HG1      THR 108   3.362   6.180   2.972
  762   1HG2  THR 108          1HG2      THR 108   4.901   7.637   5.735
  763   2HG2  THR 108          2HG2      THR 108   3.620   8.839   5.594
  764   3HG2  THR 108          3HG2      THR 108   4.576   8.401   4.178
  765    H    ASN 109           H        ASN 109   4.521   3.213   4.682
  766    HA   ASN 109           HA       ASN 109   2.302   2.508   2.860
  767   1HB   ASN 109          2HB       ASN 109   4.668   2.018   2.337
  768   2HB   ASN 109          1HB       ASN 109   4.784   1.028   3.794
  769   1HD2  ASN 109          1HD2      ASN 109   3.595   1.114   0.497
  770   2HD2  ASN 109          2HD2      ASN 109   3.024  -0.482   0.456
  771    HA   PRO 110           HA       PRO 110   0.217   0.451   6.196
  772   1HB   PRO 110          2HB       PRO 110  -1.871  -0.516   4.727
  773   2HB   PRO 110          1HB       PRO 110  -1.731   1.185   5.212
  774   1HG   PRO 110          2HG       PRO 110  -1.263  -0.069   2.579
  775   2HG   PRO 110          1HG       PRO 110  -1.816   1.564   2.976
  776   1HD   PRO 110          2HD       PRO 110   0.775   0.844   2.195
  777   2HD   PRO 110          1HD       PRO 110   0.290   2.386   2.929
  778    H    PHE 111           H        PHE 111   2.371  -1.025   4.548
  779    HA   PHE 111           HA       PHE 111   1.367  -3.767   5.171
  780   1HB   PHE 111          2HB       PHE 111   2.503  -2.745   2.562
  781   2HB   PHE 111          1HB       PHE 111   2.445  -4.463   2.948
  782    HD1  PHE 111           HD1      PHE 111   0.642  -1.697   1.605
  783    HD2  PHE 111           HD2      PHE 111   0.142  -5.405   3.711
  784    HE1  PHE 111           HE1      PHE 111  -1.732  -1.780   0.897
  785    HE2  PHE 111           HE2      PHE 111  -2.232  -5.489   3.001
  786    HZ   PHE 111           HZ       PHE 111  -3.166  -3.675   1.593
  787    H    LEU 112           HN       LEU 112   4.249  -2.081   3.854
  788    HA   LEU 112           HA       LEU 112   6.241  -3.846   4.713
  789   1HB   LEU 112          2HB       LEU 112   5.989  -0.914   4.211
  790   2HB   LEU 112          1HB       LEU 112   7.466  -1.470   4.997
  791    HG   LEU 112           HG       LEU 112   6.535  -3.018   2.627
  792   1HD1  LEU 112          1HD1      LEU 112   7.768  -1.357   1.152
  793   2HD1  LEU 112          2HD1      LEU 112   7.700  -0.224   2.502
  794   3HD1  LEU 112          3HD1      LEU 112   6.209  -0.801   1.758
  795   1HD2  LEU 112          1HD2      LEU 112   8.546  -3.863   3.360
  796   2HD2  LEU 112          2HD2      LEU 112   9.056  -2.327   4.059
  797   3HD2  LEU 112          3HD2      LEU 112   9.181  -2.589   2.319
  Start of MODEL   17
    1    HA   PRO   6           HA       PRO   6   1.820   5.457 -23.251
    2   1HB   PRO   6          2HB       PRO   6   0.599   3.010 -23.385
    3   2HB   PRO   6          1HB       PRO   6   1.024   3.957 -24.825
    4   1HG   PRO   6          2HG       PRO   6   2.435   1.639 -23.599
    5   2HG   PRO   6          1HG       PRO   6   2.188   2.035 -25.308
    6   1HD   PRO   6          2HD       PRO   6   4.531   2.479 -23.987
    7   2HD   PRO   6          1HD       PRO   6   3.989   3.446 -25.377
    8    H    TRP   7           H        TRP   7   0.133   4.691 -21.541
    9    HA   TRP   7           HA       TRP   7   1.601   4.027 -19.045
   10   1HB   TRP   7          2HB       TRP   7   0.124   6.022 -19.252
   11   2HB   TRP   7          1HB       TRP   7  -1.242   4.955 -19.575
   12    HD1  TRP   7           HD1      TRP   7   1.146   3.537 -17.129
   13    HE1  TRP   7           HE1      TRP   7   0.190   3.699 -14.742
   14    HE3  TRP   7           HE3      TRP   7  -2.796   6.656 -17.984
   15    HZ2  TRP   7           HZ2      TRP   7  -1.967   4.994 -13.374
   16    HZ3  TRP   7           HZ3      TRP   7  -4.287   7.339 -16.125
   17    HH2  TRP   7           HH2      TRP   7  -3.877   6.512 -13.823
   18    H    ALA   8           H        ALA   8   1.630   1.883 -18.483
   19    HA   ALA   8           HA       ALA   8   0.324  -0.280 -19.574
   20   1HB   ALA   8          1HB       ALA   8   0.538  -1.263 -17.245
   21   2HB   ALA   8          2HB       ALA   8   0.985   0.350 -16.690
   22   3HB   ALA   8          3HB       ALA   8   2.001  -0.497 -17.861
   23    H    VAL   9           H        VAL   9  -1.042   2.104 -17.394
   24    HA   VAL   9           HA       VAL   9  -3.528   0.526 -17.089
   25    HB   VAL   9           HB       VAL   9  -2.691   3.212 -15.976
   26   1HG1  VAL   9          1HG1      VAL   9  -5.080   1.553 -15.761
   27   2HG1  VAL   9          2HG1      VAL   9  -4.822   3.217 -15.232
   28   3HG1  VAL   9          3HG1      VAL   9  -4.357   1.877 -14.186
   29   1HG2  VAL   9          1HG2      VAL   9  -2.291   0.381 -14.980
   30   2HG2  VAL   9          2HG2      VAL   9  -2.163   1.787 -13.924
   31   3HG2  VAL   9          3HG2      VAL   9  -1.044   1.596 -15.278
   32    H    LYS  10           H        LYS  10  -4.946   0.753 -18.774
   33    HA   LYS  10           HA       LYS  10  -5.051   3.230 -20.380
   34   1HB   LYS  10          2HB       LYS  10  -5.688   0.417 -20.591
   35   2HB   LYS  10          1HB       LYS  10  -7.085   1.380 -21.069
   36   1HG   LYS  10          2HG       LYS  10  -6.073   2.089 -22.967
   37   2HG   LYS  10          1HG       LYS  10  -4.562   2.435 -22.124
   38   1HD   LYS  10          2HD       LYS  10  -4.004   0.682 -23.613
   39   2HD   LYS  10          1HD       LYS  10  -4.230  -0.126 -22.061
   40   1HE   LYS  10          2HE       LYS  10  -6.792   0.017 -23.320
   41   2HE   LYS  10          1HE       LYS  10  -5.636  -0.615 -24.509
   42   1HZ   LYS  10          1HZ       LYS  10  -5.817  -1.556 -21.697
   43   2HZ   LYS  10          2HZ       LYS  10  -4.857  -2.215 -22.934
   44   3HZ   LYS  10          3HZ       LYS  10  -6.549  -2.348 -23.007
   45    HA   PRO  11           HA       PRO  11  -8.743   4.892 -18.648
   46   1HB   PRO  11          2HB       PRO  11 -10.579   5.018 -20.682
   47   2HB   PRO  11          1HB       PRO  11  -9.174   6.100 -20.576
   48   1HG   PRO  11          2HG       PRO  11  -9.560   3.654 -22.231
   49   2HG   PRO  11          1HG       PRO  11  -8.774   5.185 -22.645
   50   1HD   PRO  11          2HD       PRO  11  -7.393   2.946 -21.987
   51   2HD   PRO  11          1HD       PRO  11  -6.786   4.584 -21.672
   52    H    GLU  12           H        GLU  12  -9.399   2.020 -20.641
   53    HA   GLU  12           HA       GLU  12 -11.886   1.321 -19.328
   54   1HB   GLU  12          2HB       GLU  12 -11.355  -0.909 -20.466
   55   2HB   GLU  12          1HB       GLU  12 -11.407   0.493 -21.535
   56   1HG   GLU  12          2HG       GLU  12  -9.124   0.493 -21.876
   57   2HG   GLU  12          1HG       GLU  12  -8.781  -0.205 -20.294
   58    H    ASP  13           H        ASP  13  -8.480   0.676 -18.710
   59    HA   ASP  13           HA       ASP  13  -8.963  -1.396 -16.705
   60   1HB   ASP  13          2HB       ASP  13  -6.645   0.225 -17.749
   61   2HB   ASP  13          1HB       ASP  13  -6.449  -0.721 -16.273
   62    H    LYS  14           H        LYS  14  -8.165   2.056 -16.764
   63    HA   LYS  14           HA       LYS  14  -8.068   2.417 -13.918
   64   1HB   LYS  14          2HB       LYS  14  -7.127   4.194 -15.078
   65   2HB   LYS  14          1HB       LYS  14  -8.283   4.066 -16.401
   66   1HG   LYS  14          2HG       LYS  14  -9.663   5.601 -15.470
   67   2HG   LYS  14          1HG       LYS  14  -9.551   4.853 -13.877
   68   1HD   LYS  14          2HD       LYS  14  -7.315   6.518 -15.031
   69   2HD   LYS  14          1HD       LYS  14  -8.615   7.212 -14.060
   70   1HE   LYS  14          2HE       LYS  14  -7.315   4.798 -12.916
   71   2HE   LYS  14          1HE       LYS  14  -6.330   6.275 -12.950
   72   1HZ   LYS  14          1HZ       LYS  14  -9.155   6.362 -12.103
   73   2HZ   LYS  14          2HZ       LYS  14  -7.905   7.460 -11.757
   74   3HZ   LYS  14          3HZ       LYS  14  -7.943   5.942 -10.993
   75    H    ALA  15           H        ALA  15 -10.615   2.421 -16.333
   76    HA   ALA  15           HA       ALA  15 -12.772   3.559 -14.941
   77   1HB   ALA  15          1HB       ALA  15 -14.034   1.668 -16.299
   78   2HB   ALA  15          2HB       ALA  15 -12.430   1.355 -16.961
   79   3HB   ALA  15          3HB       ALA  15 -13.175   2.940 -17.167
   80    H    LYS  16           H        LYS  16 -11.597   0.179 -14.844
   81    HA   LYS  16           HA       LYS  16 -13.499  -0.602 -12.789
   82   1HB   LYS  16          2HB       LYS  16 -12.651  -2.668 -13.279
   83   2HB   LYS  16          1HB       LYS  16 -11.864  -1.839 -14.617
   84   1HG   LYS  16          2HG       LYS  16  -9.814  -1.670 -13.454
   85   2HG   LYS  16          1HG       LYS  16 -10.566  -2.041 -11.903
   86   1HD   LYS  16          2HD       LYS  16  -9.313  -3.987 -12.800
   87   2HD   LYS  16          1HD       LYS  16 -11.037  -4.328 -12.641
   88   1HE   LYS  16          2HE       LYS  16 -10.652  -5.114 -14.805
   89   2HE   LYS  16          1HE       LYS  16 -11.074  -3.428 -15.163
   90   1HZ   LYS  16          1HZ       LYS  16  -8.932  -2.867 -15.554
   91   2HZ   LYS  16          2HZ       LYS  16  -8.787  -4.515 -15.943
   92   3HZ   LYS  16          3HZ       LYS  16  -8.310  -3.954 -14.411
   93    H    TYR  17           H        TYR  17 -10.335   0.862 -12.898
   94    HA   TYR  17           HA       TYR  17  -9.614   0.415 -10.111
   95   1HB   TYR  17          2HB       TYR  17  -8.743   2.485 -12.165
   96   2HB   TYR  17          1HB       TYR  17  -7.893   2.123 -10.667
   97    HD1  TYR  17           HD1      TYR  17  -6.262   1.916 -12.938
   98    HD2  TYR  17           HD2      TYR  17  -9.114  -0.954 -11.504
   99    HE1  TYR  17           HE1      TYR  17  -4.995   0.105 -14.065
  100    HE2  TYR  17           HE2      TYR  17  -7.864  -2.766 -12.644
  101    HH   TYR  17           HH       TYR  17  -6.150  -3.274 -13.963
  102    H    ASP  18           H        ASP  18 -11.228   2.940 -11.974
  103    HA   ASP  18           HA       ASP  18 -11.408   4.865  -9.800
  104   1HB   ASP  18          2HB       ASP  18 -11.498   5.107 -12.404
  105   2HB   ASP  18          1HB       ASP  18 -13.206   4.710 -12.222
  106    H    ALA  19           H        ALA  19 -13.057   1.962 -10.434
  107    HA   ALA  19           HA       ALA  19 -15.572   2.860  -9.111
  108   1HB   ALA  19          1HB       ALA  19 -16.346   1.309 -10.584
  109   2HB   ALA  19          2HB       ALA  19 -15.563   0.078  -9.594
  110   3HB   ALA  19          3HB       ALA  19 -14.705   0.788 -10.962
  111    H    ILE  20           H        ILE  20 -12.694   0.938  -8.699
  112    HA   ILE  20           HA       ILE  20 -13.446  -0.183  -6.107
  113    HB   ILE  20           HB       ILE  20 -10.950   0.019  -7.818
  114   1HG1  ILE  20          2HG1      ILE  20 -12.583  -2.415  -7.052
  115   2HG1  ILE  20          1HG1      ILE  20 -12.901  -1.469  -8.508
  116   1HG2  ILE  20          1HG2      ILE  20 -10.454  -0.060  -5.364
  117   2HG2  ILE  20          2HG2      ILE  20  -9.838  -1.437  -6.274
  118   3HG2  ILE  20          3HG2      ILE  20 -11.299  -1.605  -5.298
  119   1HD1  ILE  20          1HD1      ILE  20 -11.383  -3.469  -8.859
  120   2HD1  ILE  20          2HD1      ILE  20 -10.187  -2.643  -7.859
  121   3HD1  ILE  20          3HD1      ILE  20 -10.706  -1.926  -9.386
  122    H    PHE  21           H        PHE  21 -11.693   2.550  -7.442
  123    HA   PHE  21           HA       PHE  21 -10.500   3.459  -4.963
  124   1HB   PHE  21          2HB       PHE  21  -9.397   4.291  -6.821
  125   2HB   PHE  21          1HB       PHE  21 -10.876   4.377  -7.776
  126    HD1  PHE  21           HD1      PHE  21  -8.624   6.173  -5.548
  127    HD2  PHE  21           HD2      PHE  21 -12.506   6.238  -7.386
  128    HE1  PHE  21           HE1      PHE  21  -8.828   8.590  -5.034
  129    HE2  PHE  21           HE2      PHE  21 -12.710   8.654  -6.872
  130    HZ   PHE  21           HZ       PHE  21 -10.874   9.830  -5.695
  131    H    ASP  22           H        ASP  22 -13.397   4.254  -6.828
  132    HA   ASP  22           HA       ASP  22 -14.342   6.211  -4.843
  133   1HB   ASP  22          2HB       ASP  22 -14.729   6.691  -7.154
  134   2HB   ASP  22          1HB       ASP  22 -15.351   5.065  -7.459
  135    H    SER  23           H        SER  23 -14.250   2.919  -4.861
  136    HA   SER  23           HA       SER  23 -17.014   2.450  -3.889
  137   1HB   SER  23          2HB       SER  23 -14.702   0.907  -4.887
  138   2HB   SER  23          1HB       SER  23 -15.576   0.123  -3.574
  139    HG   SER  23           HG       SER  23 -16.351   0.675  -6.171
  140    H    LEU  24           H        LEU  24 -14.049   3.464  -2.673
  141    HA   LEU  24           HA       LEU  24 -14.536   2.344   0.060
  142   1HB   LEU  24          2HB       LEU  24 -12.118   3.936  -0.694
  143   2HB   LEU  24          1HB       LEU  24 -12.233   2.527   0.356
  144    HG   LEU  24           HG       LEU  24 -12.551   2.432  -2.653
  145   1HD1  LEU  24          1HD1      LEU  24 -10.299   2.219  -2.873
  146   2HD1  LEU  24          2HD1      LEU  24 -10.169   1.220  -1.424
  147   3HD1  LEU  24          3HD1      LEU  24 -10.222   2.976  -1.281
  148   1HD2  LEU  24          1HD2      LEU  24 -12.218   0.328  -0.493
  149   2HD2  LEU  24          2HD2      LEU  24 -12.095  -0.014  -2.218
  150   3HD2  LEU  24          3HD2      LEU  24 -13.619   0.558  -1.540
  151    H    SER  25           H        SER  25 -14.961   5.091  -1.856
  152    HA   SER  25           HA       SER  25 -15.942   7.184  -1.242
  153   1HB   SER  25          2HB       SER  25 -15.118   6.683   1.610
  154   2HB   SER  25          1HB       SER  25 -16.511   7.573   1.002
  155    HG   SER  25           HG       SER  25 -16.321   4.994   1.675
  156    HA   PRO  26           HA       PRO  26 -11.615   8.556  -1.444
  157   1HB   PRO  26          2HB       PRO  26 -12.058  10.342  -3.463
  158   2HB   PRO  26          1HB       PRO  26 -11.771   8.614  -3.745
  159   1HG   PRO  26          2HG       PRO  26 -14.325  10.131  -3.738
  160   2HG   PRO  26          1HG       PRO  26 -13.807   8.795  -4.777
  161   1HD   PRO  26          2HD       PRO  26 -15.516   8.501  -2.662
  162   2HD   PRO  26          1HD       PRO  26 -14.474   7.202  -3.280
  163    H    VAL  27           H        VAL  27 -10.695  10.501  -0.734
  164    HA   VAL  27           HA       VAL  27 -12.609  12.584   0.254
  165    HB   VAL  27           HB       VAL  27 -10.033  11.524   1.468
  166   1HG1  VAL  27          1HG1      VAL  27 -10.938  12.918   3.453
  167   2HG1  VAL  27          2HG1      VAL  27 -11.941  13.728   2.249
  168   3HG1  VAL  27          3HG1      VAL  27 -10.183  13.792   2.120
  169   1HG2  VAL  27          1HG2      VAL  27 -11.858   9.922   1.697
  170   2HG2  VAL  27          2HG2      VAL  27 -12.951  11.192   2.245
  171   3HG2  VAL  27          3HG2      VAL  27 -11.592  10.701   3.256
  172    H    ASN  28           H        ASN  28 -12.294  14.189  -1.289
  173    HA   ASN  28           HA       ASN  28 -11.146  15.943  -2.388
  174   1HB   ASN  28          2HB       ASN  28 -10.013  15.916  -0.059
  175   2HB   ASN  28          1HB       ASN  28  -8.702  15.044  -0.851
  176   1HD2  ASN  28          1HD2      ASN  28  -8.264  16.242  -3.212
  177   2HD2  ASN  28          2HD2      ASN  28  -7.991  17.911  -3.051
  178    H    GLY  29           H        GLY  29 -11.106  12.961  -3.130
  179   1HA   GLY  29          2HA       GLY  29 -10.380  11.915  -5.133
  180   2HA   GLY  29          1HA       GLY  29  -9.244  13.243  -5.383
  181    H    PHE  30           H        PHE  30  -9.561  11.289  -2.447
  182    HA   PHE  30           HA       PHE  30  -6.996   9.915  -3.063
  183   1HB   PHE  30          2HB       PHE  30  -7.552  11.841  -0.795
  184   2HB   PHE  30          1HB       PHE  30  -6.163  10.743  -0.803
  185    HD1  PHE  30           HD1      PHE  30  -7.544  13.833  -2.071
  186    HD2  PHE  30           HD2      PHE  30  -4.540  10.839  -2.723
  187    HE1  PHE  30           HE1      PHE  30  -6.320  15.395  -3.543
  188    HE2  PHE  30           HE2      PHE  30  -3.300  12.409  -4.199
  189    HZ   PHE  30           HZ       PHE  30  -4.189  14.691  -4.609
  190    H    LEU  31           H        LEU  31  -6.711   8.014  -1.902
  191    HA   LEU  31           HA       LEU  31  -8.988   7.184  -0.120
  192   1HB   LEU  31          2HB       LEU  31  -7.181   5.683  -2.027
  193   2HB   LEU  31          1HB       LEU  31  -8.123   4.854  -0.787
  194    HG   LEU  31           HG       LEU  31  -9.169   6.529  -3.071
  195   1HD1  LEU  31          1HD1      LEU  31  -8.905   3.667  -2.395
  196   2HD1  LEU  31          2HD1      LEU  31  -9.053   4.439  -3.978
  197   3HD1  LEU  31          3HD1      LEU  31 -10.493   4.135  -3.008
  198   1HD2  LEU  31          1HD2      LEU  31 -10.572   5.411  -0.629
  199   2HD2  LEU  31          2HD2      LEU  31 -11.427   5.900  -2.093
  200   3HD2  LEU  31          3HD2      LEU  31 -10.524   7.093  -1.157
  201    H    SER  32           H        SER  32  -8.373   6.678   1.953
  202    HA   SER  32           HA       SER  32  -5.595   7.099   2.734
  203   1HB   SER  32          2HB       SER  32  -6.493   6.715   4.976
  204   2HB   SER  32          1HB       SER  32  -7.622   7.724   4.076
  205    HG   SER  32           HG       SER  32  -8.796   5.802   3.602
  206    H    GLY  33           H        GLY  33  -4.112   5.531   3.378
  207   1HA   GLY  33          2HA       GLY  33  -3.954   3.065   2.151
  208   2HA   GLY  33          1HA       GLY  33  -3.251   3.351   3.745
  209    H    ASP  34           H        ASP  34  -5.958   3.942   4.871
  210    HA   ASP  34           HA       ASP  34  -6.624   1.314   5.807
  211   1HB   ASP  34          2HB       ASP  34  -6.961   3.576   6.916
  212   2HB   ASP  34          1HB       ASP  34  -8.335   3.812   5.836
  213    H    LYS  35           H        LYS  35  -7.805   3.259   3.095
  214    HA   LYS  35           HA       LYS  35 -10.068   1.410   2.623
  215   1HB   LYS  35          2HB       LYS  35  -8.997   3.903   1.258
  216   2HB   LYS  35          1HB       LYS  35 -10.438   3.039   0.721
  217   1HG   LYS  35          2HG       LYS  35 -11.454   3.377   2.960
  218   2HG   LYS  35          1HG       LYS  35 -10.028   4.291   3.454
  219   1HD   LYS  35          2HD       LYS  35 -10.451   5.878   1.565
  220   2HD   LYS  35          1HD       LYS  35 -11.947   5.009   1.219
  221   1HE   LYS  35          2HE       LYS  35 -12.938   6.411   2.712
  222   2HE   LYS  35          1HE       LYS  35 -12.070   5.512   3.973
  223   1HZ   LYS  35          1HZ       LYS  35 -10.248   6.971   3.845
  224   2HZ   LYS  35          2HZ       LYS  35 -11.614   7.981   3.871
  225   3HZ   LYS  35          3HZ       LYS  35 -10.801   7.683   2.409
  226    H    VAL  36           H        VAL  36  -6.913   2.328   1.333
  227    HA   VAL  36           HA       VAL  36  -7.077   0.554  -0.991
  228    HB   VAL  36           HB       VAL  36  -4.776   1.936   0.427
  229   1HG1  VAL  36          1HG1      VAL  36  -4.246  -0.043  -1.115
  230   2HG1  VAL  36          2HG1      VAL  36  -3.463   1.486  -1.509
  231   3HG1  VAL  36          3HG1      VAL  36  -4.866   0.954  -2.431
  232   1HG2  VAL  36          1HG2      VAL  36  -6.297   2.751  -2.067
  233   2HG2  VAL  36          2HG2      VAL  36  -5.056   3.681  -1.226
  234   3HG2  VAL  36          3HG2      VAL  36  -6.621   3.405  -0.460
  235    H    LYS  37           H        LYS  37  -5.429   0.489   2.176
  236    HA   LYS  37           HA       LYS  37  -3.897  -1.753   2.117
  237   1HB   LYS  37          2HB       LYS  37  -4.115  -0.560   4.145
  238   2HB   LYS  37          1HB       LYS  37  -5.867  -0.752   4.167
  239   1HG   LYS  37          2HG       LYS  37  -5.763  -2.878   5.019
  240   2HG   LYS  37          1HG       LYS  37  -4.259  -3.254   4.177
  241   1HD   LYS  37          2HD       LYS  37  -3.533  -1.225   5.937
  242   2HD   LYS  37          1HD       LYS  37  -4.658  -2.208   6.875
  243   1HE   LYS  37          2HE       LYS  37  -3.322  -4.250   6.118
  244   2HE   LYS  37          1HE       LYS  37  -2.097  -3.110   5.525
  245   1HZ   LYS  37          1HZ       LYS  37  -1.908  -3.891   7.942
  246   2HZ   LYS  37          2HZ       LYS  37  -3.229  -2.866   8.244
  247   3HZ   LYS  37          3HZ       LYS  37  -1.775  -2.228   7.640
  248    HA   PRO  38           HA       PRO  38  -7.616  -4.745   2.692
  249   1HB   PRO  38          2HB       PRO  38 -10.107  -3.737   2.137
  250   2HB   PRO  38          1HB       PRO  38  -9.402  -3.741   3.767
  251   1HG   PRO  38          2HG       PRO  38  -9.532  -1.529   1.767
  252   2HG   PRO  38          1HG       PRO  38  -9.811  -1.482   3.517
  253   1HD   PRO  38          2HD       PRO  38  -7.496  -0.656   2.422
  254   2HD   PRO  38          1HD       PRO  38  -7.557  -1.451   4.012
  255    H    VAL  39           H        VAL  39  -7.926  -2.206   0.260
  256    HA   VAL  39           HA       VAL  39  -9.055  -3.741  -1.863
  257    HB   VAL  39           HB       VAL  39  -7.513  -1.221  -1.458
  258   1HG1  VAL  39          1HG1      VAL  39  -6.413  -2.298  -3.444
  259   2HG1  VAL  39          2HG1      VAL  39  -7.244  -0.794  -3.826
  260   3HG1  VAL  39          3HG1      VAL  39  -7.989  -2.339  -4.234
  261   1HG2  VAL  39          1HG2      VAL  39  -9.919  -1.673  -3.209
  262   2HG2  VAL  39          2HG2      VAL  39  -9.455  -0.225  -2.318
  263   3HG2  VAL  39          3HG2      VAL  39 -10.083  -1.627  -1.453
  264    H    LEU  40           H        LEU  40  -5.775  -3.541  -0.597
  265    HA   LEU  40           HA       LEU  40  -4.664  -4.969  -2.942
  266   1HB   LEU  40          2HB       LEU  40  -3.305  -4.082  -0.391
  267   2HB   LEU  40          1HB       LEU  40  -2.564  -4.370  -1.962
  268    HG   LEU  40           HG       LEU  40  -4.619  -2.223  -1.412
  269   1HD1  LEU  40          1HD1      LEU  40  -1.676  -2.296  -1.191
  270   2HD1  LEU  40          2HD1      LEU  40  -2.833  -1.183  -0.458
  271   3HD1  LEU  40          3HD1      LEU  40  -2.313  -0.944  -2.128
  272   1HD2  LEU  40          1HD2      LEU  40  -3.885  -1.438  -3.679
  273   2HD2  LEU  40          2HD2      LEU  40  -4.689  -3.008  -3.709
  274   3HD2  LEU  40          3HD2      LEU  40  -2.932  -2.914  -3.833
  275    H    LEU  41           H        LEU  41  -5.536  -5.587   0.427
  276    HA   LEU  41           HA       LEU  41  -4.137  -8.137   0.593
  277   1HB   LEU  41          2HB       LEU  41  -6.504  -7.066   2.162
  278   2HB   LEU  41          1HB       LEU  41  -5.396  -8.337   2.677
  279    HG   LEU  41           HG       LEU  41  -4.281  -5.666   1.929
  280   1HD1  LEU  41          1HD1      LEU  41  -5.966  -6.327   4.305
  281   2HD1  LEU  41          2HD1      LEU  41  -5.802  -4.799   3.442
  282   3HD1  LEU  41          3HD1      LEU  41  -4.543  -5.316   4.565
  283   1HD2  LEU  41          1HD2      LEU  41  -2.434  -6.759   2.651
  284   2HD2  LEU  41          2HD2      LEU  41  -3.413  -8.132   3.172
  285   3HD2  LEU  41          3HD2      LEU  41  -3.141  -6.777   4.268
  286    H    ASN  42           H        ASN  42  -7.025  -7.013  -0.866
  287    HA   ASN  42           HA       ASN  42  -8.495  -9.518  -0.705
  288   1HB   ASN  42          2HB       ASN  42  -8.871  -6.791  -1.517
  289   2HB   ASN  42          1HB       ASN  42  -9.376  -7.840  -2.842
  290   1HD2  ASN  42          1HD2      ASN  42 -10.839  -6.236  -0.515
  291   2HD2  ASN  42          2HD2      ASN  42 -11.986  -7.363   0.028
  292    H    SER  43           H        SER  43  -5.917  -8.328  -2.616
  293    HA   SER  43           HA       SER  43  -6.519  -9.865  -5.043
  294   1HB   SER  43          2HB       SER  43  -4.529  -8.831  -5.836
  295   2HB   SER  43          1HB       SER  43  -5.251  -7.639  -4.759
  296    HG   SER  43           HG       SER  43  -3.843  -8.347  -3.134
  297    H    LYS  44           H        LYS  44  -5.832 -10.979  -2.108
  298    HA   LYS  44           HA       LYS  44  -4.868 -12.988  -1.319
  299   1HB   LYS  44          2HB       LYS  44  -5.658 -13.307  -4.022
  300   2HB   LYS  44          1HB       LYS  44  -4.082 -14.085  -3.868
  301   1HG   LYS  44          2HG       LYS  44  -5.297 -15.846  -3.085
  302   2HG   LYS  44          1HG       LYS  44  -5.291 -14.931  -1.577
  303   1HD   LYS  44          2HD       LYS  44  -7.474 -14.216  -1.834
  304   2HD   LYS  44          1HD       LYS  44  -7.402 -14.290  -3.596
  305   1HE   LYS  44          2HE       LYS  44  -8.816 -16.115  -2.870
  306   2HE   LYS  44          1HE       LYS  44  -7.267 -16.836  -3.352
  307   1HZ   LYS  44          1HZ       LYS  44  -7.956 -17.618  -1.156
  308   2HZ   LYS  44          2HZ       LYS  44  -8.000 -16.017  -0.589
  309   3HZ   LYS  44          3HZ       LYS  44  -6.525 -16.713  -1.062
  310    H    LEU  45           H        LEU  45  -3.213 -10.528  -2.513
  311    HA   LEU  45           HA       LEU  45  -0.574 -11.784  -2.963
  312   1HB   LEU  45          2HB       LEU  45  -1.808  -9.050  -2.987
  313   2HB   LEU  45          1HB       LEU  45  -0.053  -9.197  -2.898
  314    HG   LEU  45           HG       LEU  45  -1.800 -10.490  -5.009
  315   1HD1  LEU  45          1HD1      LEU  45  -0.600  -7.839  -4.749
  316   2HD1  LEU  45          2HD1      LEU  45  -1.777  -8.423  -5.925
  317   3HD1  LEU  45          3HD1      LEU  45  -0.055  -8.680  -6.197
  318   1HD2  LEU  45          1HD2      LEU  45   0.735 -11.218  -4.113
  319   2HD2  LEU  45          2HD2      LEU  45   1.076 -10.185  -5.502
  320   3HD2  LEU  45          3HD2      LEU  45   0.053 -11.610  -5.695
  321    HA   PRO  46           HA       PRO  46   0.684 -11.390   1.222
  322   1HB   PRO  46          2HB       PRO  46   3.391 -11.226   0.873
  323   2HB   PRO  46          1HB       PRO  46   2.479 -12.730   0.657
  324   1HG   PRO  46          2HG       PRO  46   3.598 -10.898  -1.366
  325   2HG   PRO  46          1HG       PRO  46   3.369 -12.648  -1.425
  326   1HD   PRO  46          2HD       PRO  46   1.733 -10.770  -2.651
  327   2HD   PRO  46          1HD       PRO  46   1.299 -12.459  -2.323
  328    H    VAL  47           H        VAL  47   1.993  -9.825   2.641
  329    HA   VAL  47           HA       VAL  47   1.312  -7.096   2.030
  330    HB   VAL  47           HB       VAL  47   2.610  -8.715   4.168
  331   1HG1  VAL  47          1HG1      VAL  47   3.205  -6.551   5.392
  332   2HG1  VAL  47          2HG1      VAL  47   3.112  -5.752   3.823
  333   3HG1  VAL  47          3HG1      VAL  47   4.298  -7.025   4.092
  334   1HG2  VAL  47          1HG2      VAL  47   1.023  -6.643   5.204
  335   2HG2  VAL  47          2HG2      VAL  47   0.538  -8.321   4.958
  336   3HG2  VAL  47          3HG2      VAL  47   0.231  -7.122   3.702
  337    H    ASP  48           H        ASP  48   3.814  -9.053   0.911
  338    HA   ASP  48           HA       ASP  48   5.947  -7.074   0.916
  339   1HB   ASP  48          2HB       ASP  48   5.443  -9.850  -0.003
  340   2HB   ASP  48          1HB       ASP  48   6.687  -8.955  -0.876
  341    H    ILE  49           H        ILE  49   3.383  -8.139  -1.234
  342    HA   ILE  49           HA       ILE  49   4.391  -6.563  -3.506
  343    HB   ILE  49           HB       ILE  49   1.638  -7.756  -3.194
  344   1HG1  ILE  49          2HG1      ILE  49   3.215  -9.491  -2.458
  345   2HG1  ILE  49          1HG1      ILE  49   2.569  -9.890  -4.050
  346   1HG2  ILE  49          1HG2      ILE  49   2.621  -8.293  -5.709
  347   2HG2  ILE  49          2HG2      ILE  49   3.370  -6.742  -5.331
  348   3HG2  ILE  49          3HG2      ILE  49   1.615  -6.905  -5.291
  349   1HD1  ILE  49          1HD1      ILE  49   5.230  -8.558  -3.508
  350   2HD1  ILE  49          2HD1      ILE  49   4.579  -8.930  -5.110
  351   3HD1  ILE  49          3HD1      ILE  49   4.992 -10.237  -3.996
  352    H    LEU  50           H        LEU  50   1.900  -6.433  -1.038
  353    HA   LEU  50           HA       LEU  50   0.665  -3.984  -2.023
  354   1HB   LEU  50          2HB       LEU  50   0.545  -5.187   0.743
  355   2HB   LEU  50          1HB       LEU  50  -0.698  -4.256  -0.090
  356    HG   LEU  50           HG       LEU  50   0.245  -7.051  -0.795
  357   1HD1  LEU  50          1HD1      LEU  50  -2.485  -6.053   0.041
  358   2HD1  LEU  50          2HD1      LEU  50  -1.323  -6.782   1.151
  359   3HD1  LEU  50          3HD1      LEU  50  -1.985  -7.730  -0.182
  360   1HD2  LEU  50          1HD2      LEU  50  -2.109  -6.195  -2.203
  361   2HD2  LEU  50          2HD2      LEU  50  -0.570  -6.739  -2.870
  362   3HD2  LEU  50          3HD2      LEU  50  -0.814  -5.034  -2.490
  363    H    GLY  51           H        GLY  51   3.277  -4.883   0.122
  364   1HA   GLY  51          2HA       GLY  51   3.469  -2.323   1.497
  365   2HA   GLY  51          1HA       GLY  51   4.740  -3.549   1.421
  366    H    ARG  52           H        ARG  52   4.476  -3.670  -1.510
  367    HA   ARG  52           HA       ARG  52   6.147  -1.295  -2.147
  368   1HB   ARG  52          2HB       ARG  52   6.147  -4.114  -2.720
  369   2HB   ARG  52          1HB       ARG  52   6.091  -3.207  -4.232
  370   1HG   ARG  52          2HG       ARG  52   7.948  -1.751  -3.004
  371   2HG   ARG  52          1HG       ARG  52   8.218  -3.267  -2.139
  372   1HD   ARG  52          2HD       ARG  52   9.659  -3.235  -4.115
  373   2HD   ARG  52          1HD       ARG  52   8.354  -4.410  -4.407
  374    HE   ARG  52           HE       ARG  52   7.207  -2.717  -5.742
  375   1HH1  ARG  52          1HH2      ARG  52   9.582  -1.044  -4.107
  376   2HH1  ARG  52          2HH2      ARG  52  10.129  -0.133  -5.473
  377   1HH2  ARG  52          2HH1      ARG  52   8.210  -1.927  -7.748
  378   2HH2  ARG  52          1HH1      ARG  52   9.335  -0.638  -7.546
  379    H    VAL  53           H        VAL  53   3.263  -3.087  -3.233
  380    HA   VAL  53           HA       VAL  53   2.814  -1.639  -5.644
  381    HB   VAL  53           HB       VAL  53   1.129  -3.164  -3.674
  382   1HG1  VAL  53          1HG1      VAL  53  -0.287  -1.324  -4.600
  383   2HG1  VAL  53          2HG1      VAL  53  -0.811  -2.919  -5.138
  384   3HG1  VAL  53          3HG1      VAL  53   0.107  -1.878  -6.227
  385   1HG2  VAL  53          1HG2      VAL  53   1.532  -3.673  -6.628
  386   2HG2  VAL  53          2HG2      VAL  53   1.168  -4.830  -5.343
  387   3HG2  VAL  53          3HG2      VAL  53   2.779  -4.115  -5.455
  388    H    TRP  54           H        TRP  54   1.768  -0.928  -2.299
  389    HA   TRP  54           HA       TRP  54   0.216   1.401  -2.989
  390   1HB   TRP  54          2HB       TRP  54  -0.159   0.496  -0.837
  391   2HB   TRP  54          1HB       TRP  54   1.569   0.339  -0.508
  392    HD1  TRP  54           HD1      TRP  54   2.949   2.665  -0.166
  393    HE1  TRP  54           HE1      TRP  54   2.199   4.922   0.795
  394    HE3  TRP  54           HE3      TRP  54  -2.121   2.092  -0.401
  395    HZ2  TRP  54           HZ2      TRP  54  -0.215   6.291   1.434
  396    HZ3  TRP  54           HZ3      TRP  54  -3.620   3.905   0.412
  397    HH2  TRP  54           HH2      TRP  54  -2.670   5.987   1.327
  398    H    GLU  55           H        GLU  55   3.550   1.059  -1.697
  399    HA   GLU  55           HA       GLU  55   4.258   3.763  -1.623
  400   1HB   GLU  55          2HB       GLU  55   5.811   1.253  -2.249
  401   2HB   GLU  55          1HB       GLU  55   6.591   2.817  -2.005
  402   1HG   GLU  55          2HG       GLU  55   4.975   2.765   0.164
  403   2HG   GLU  55          1HG       GLU  55   5.276   1.037  -0.033
  404    H    LEU  56           H        LEU  56   5.032   1.564  -4.339
  405    HA   LEU  56           HA       LEU  56   5.869   3.634  -6.120
  406   1HB   LEU  56          2HB       LEU  56   4.533   0.989  -6.779
  407   2HB   LEU  56          1HB       LEU  56   5.627   1.902  -7.812
  408    HG   LEU  56           HG       LEU  56   6.774   1.353  -5.179
  409   1HD1  LEU  56          1HD1      LEU  56   6.671  -0.929  -5.100
  410   2HD1  LEU  56          2HD1      LEU  56   6.692  -1.088  -6.859
  411   3HD1  LEU  56          3HD1      LEU  56   5.193  -0.687  -6.033
  412   1HD2  LEU  56          1HD2      LEU  56   7.984   2.171  -7.254
  413   2HD2  LEU  56          2HD2      LEU  56   7.702   0.589  -7.975
  414   3HD2  LEU  56          3HD2      LEU  56   8.711   0.735  -6.532
  415    H    SER  57           H        SER  57   2.698   2.383  -5.250
  416    HA   SER  57           HA       SER  57   1.226   3.708  -7.389
  417   1HB   SER  57          2HB       SER  57   0.439   1.697  -6.218
  418   2HB   SER  57          1HB       SER  57   0.441   2.569  -4.687
  419    HG   SER  57           HG       SER  57  -1.506   3.131  -5.222
  420    H    ASP  58           H        ASP  58   2.312   4.469  -4.136
  421    HA   ASP  58           HA       ASP  58   0.667   6.793  -3.709
  422   1HB   ASP  58          2HB       ASP  58   2.446   5.205  -2.292
  423   2HB   ASP  58          1HB       ASP  58   3.292   6.748  -2.418
  424    H    ILE  59           H        ILE  59   1.308   7.374  -6.188
  425    HA   ILE  59           HA       ILE  59   3.724   8.412  -7.026
  426    HB   ILE  59           HB       ILE  59   1.016   9.756  -7.344
  427   1HG1  ILE  59          2HG1      ILE  59   0.985   7.312  -7.930
  428   2HG1  ILE  59          1HG1      ILE  59   0.737   8.352  -9.327
  429   1HG2  ILE  59          1HG2      ILE  59   3.088  11.004  -8.071
  430   2HG2  ILE  59          2HG2      ILE  59   1.940  10.671  -9.369
  431   3HG2  ILE  59          3HG2      ILE  59   3.399   9.691  -9.207
  432   1HD1  ILE  59          1HD1      ILE  59   3.171   8.170  -9.847
  433   2HD1  ILE  59          2HD1      ILE  59   2.334   6.616  -9.912
  434   3HD1  ILE  59          3HD1      ILE  59   3.334   7.024  -8.514
  435    H    ASP  60           H        ASP  60   1.499   9.871  -4.686
  436    HA   ASP  60           HA       ASP  60   3.285  12.246  -4.420
  437   1HB   ASP  60          2HB       ASP  60   0.722  11.781  -2.910
  438   2HB   ASP  60          1HB       ASP  60   1.410  13.301  -3.479
  439    H    HIS  61           H        HIS  61   2.429   9.277  -2.827
  440    HA   HIS  61           HA       HIS  61   3.218   8.320  -0.809
  441   1HB   HIS  61          2HB       HIS  61   5.222  10.591  -0.971
  442   2HB   HIS  61          1HB       HIS  61   5.445   9.029  -0.184
  443    HD1  HIS  61           HD1      HIS  61   6.020   7.012  -1.662
  444    HD2  HIS  61           HD2      HIS  61   5.312  10.489  -3.850
  445    HE1  HIS  61           HE1      HIS  61   6.767   6.531  -4.033
  446    H    ASP  62           H        ASP  62   1.113  10.330  -0.646
  447    HA   ASP  62           HA       ASP  62   1.807  11.918   1.772
  448   1HB   ASP  62          2HB       ASP  62  -0.146  13.172   1.201
  449   2HB   ASP  62          1HB       ASP  62   0.628  12.784  -0.335
  450    H    GLY  63           H        GLY  63   0.641   8.858   1.118
  451   1HA   GLY  63          2HA       GLY  63  -0.029   7.359   2.911
  452   2HA   GLY  63          1HA       GLY  63  -0.684   8.746   3.779
  453    H    MET  64           H        MET  64  -1.359   8.535   0.395
  454    HA   MET  64           HA       MET  64  -3.936   7.174   0.800
  455   1HB   MET  64          2HB       MET  64  -4.066   9.910  -0.405
  456   2HB   MET  64          1HB       MET  64  -5.302   9.017   0.477
  457   1HG   MET  64          2HG       MET  64  -4.016   9.349   2.570
  458   2HG   MET  64          1HG       MET  64  -2.843  10.313   1.673
  459   1HE   MET  64          1HE       MET  64  -7.176  10.636   1.809
  460   2HE   MET  64          2HE       MET  64  -6.732  11.096   3.450
  461   3HE   MET  64          3HE       MET  64  -6.136   9.582   2.775
  462    H    LEU  65           H        LEU  65  -5.067   6.829  -1.288
  463    HA   LEU  65           HA       LEU  65  -3.196   6.975  -3.635
  464   1HB   LEU  65          2HB       LEU  65  -5.148   4.913  -2.620
  465   2HB   LEU  65          1HB       LEU  65  -4.708   4.946  -4.326
  466    HG   LEU  65           HG       LEU  65  -2.867   4.547  -1.957
  467   1HD1  LEU  65          1HD1      LEU  65  -2.537   2.383  -2.840
  468   2HD1  LEU  65          2HD1      LEU  65  -3.159   2.839  -4.426
  469   3HD1  LEU  65          3HD1      LEU  65  -4.265   2.656  -3.066
  470   1HD2  LEU  65          1HD2      LEU  65  -1.118   4.325  -3.852
  471   2HD2  LEU  65          2HD2      LEU  65  -1.605   5.956  -3.394
  472   3HD2  LEU  65          3HD2      LEU  65  -2.274   5.212  -4.847
  473    H    ASP  66           H        ASP  66  -4.018   8.742  -4.826
  474    HA   ASP  66           HA       ASP  66  -6.861   9.368  -4.865
  475   1HB   ASP  66          2HB       ASP  66  -6.054  10.984  -6.662
  476   2HB   ASP  66          1HB       ASP  66  -5.249  11.134  -5.103
  477    H    ARG  67           H        ARG  67  -8.154   9.336  -6.863
  478    HA   ARG  67           HA       ARG  67  -8.621   6.948  -8.068
  479   1HB   ARG  67          2HB       ARG  67  -9.374   8.344 -10.063
  480   2HB   ARG  67          1HB       ARG  67 -10.003   8.845  -8.496
  481   1HG   ARG  67          2HG       ARG  67  -9.230  10.902  -9.051
  482   2HG   ARG  67          1HG       ARG  67  -7.637  10.257  -8.656
  483   1HD   ARG  67          2HD       ARG  67  -7.588   9.402 -11.106
  484   2HD   ARG  67          1HD       ARG  67  -8.915  10.548 -11.375
  485    HE   ARG  67           HE       ARG  67  -6.840  11.858  -9.904
  486   1HH1  ARG  67          1HH2      ARG  67  -6.425  10.042 -12.672
  487   2HH1  ARG  67          2HH2      ARG  67  -5.901  11.350 -13.679
  488   1HH2  ARG  67          2HH1      ARG  67  -6.666  13.800 -11.345
  489   2HH2  ARG  67          1HH1      ARG  67  -6.038  13.479 -12.926
  490    H    ASP  68           H        ASP  68  -6.226   9.279  -9.341
  491    HA   ASP  68           HA       ASP  68  -5.397   7.553 -11.522
  492   1HB   ASP  68          2HB       ASP  68  -5.186  10.180 -10.913
  493   2HB   ASP  68          1HB       ASP  68  -3.584   9.637 -10.413
  494    H    GLU  69           H        GLU  69  -4.153   8.208  -8.262
  495    HA   GLU  69           HA       GLU  69  -1.768   6.577  -8.535
  496   1HB   GLU  69          2HB       GLU  69  -3.388   7.798  -6.304
  497   2HB   GLU  69          1HB       GLU  69  -2.029   6.735  -5.936
  498   1HG   GLU  69          2HG       GLU  69  -0.612   8.181  -7.442
  499   2HG   GLU  69          1HG       GLU  69  -1.967   9.308  -7.518
  500    H    PHE  70           H        PHE  70  -4.969   6.101  -7.074
  501    HA   PHE  70           HA       PHE  70  -4.636   3.422  -6.182
  502   1HB   PHE  70          2HB       PHE  70  -6.483   5.158  -5.764
  503   2HB   PHE  70          1HB       PHE  70  -7.138   4.689  -7.332
  504    HD1  PHE  70           HD1      PHE  70  -6.769   3.788  -3.839
  505    HD2  PHE  70           HD2      PHE  70  -7.827   2.306  -7.728
  506    HE1  PHE  70           HE1      PHE  70  -7.882   1.837  -2.790
  507    HE2  PHE  70           HE2      PHE  70  -8.940   0.355  -6.680
  508    HZ   PHE  70           HZ       PHE  70  -8.966   0.122  -4.211
  509    H    ALA  71           H        ALA  71  -4.912   4.783  -9.353
  510    HA   ALA  71           HA       ALA  71  -5.950   2.404 -10.686
  511   1HB   ALA  71          1HB       ALA  71  -4.309   4.523 -12.029
  512   2HB   ALA  71          2HB       ALA  71  -5.852   4.983 -11.310
  513   3HB   ALA  71          3HB       ALA  71  -5.800   3.758 -12.577
  514    H    VAL  72           H        VAL  72  -2.740   3.939 -10.489
  515    HA   VAL  72           HA       VAL  72  -1.289   1.953 -11.922
  516    HB   VAL  72           HB       VAL  72  -0.432   3.728  -9.603
  517   1HG1  VAL  72          1HG1      VAL  72   1.662   2.982  -9.959
  518   2HG1  VAL  72          2HG1      VAL  72   1.527   3.290 -11.690
  519   3HG1  VAL  72          3HG1      VAL  72   0.987   1.749 -11.023
  520   1HG2  VAL  72          1HG2      VAL  72   0.127   5.388 -11.284
  521   2HG2  VAL  72          2HG2      VAL  72  -1.558   4.919 -11.523
  522   3HG2  VAL  72          3HG2      VAL  72  -0.305   4.277 -12.586
  523    H    ALA  73           H        ALA  73  -2.554   2.000  -8.655
  524    HA   ALA  73           HA       ALA  73  -0.884  -0.282  -7.780
  525   1HB   ALA  73          1HB       ALA  73  -2.864   0.246  -5.891
  526   2HB   ALA  73          2HB       ALA  73  -2.566   1.816  -6.642
  527   3HB   ALA  73          3HB       ALA  73  -1.236   0.927  -5.902
  528    H    MET  74           H        MET  74  -3.736   0.072  -9.562
  529    HA   MET  74           HA       MET  74  -5.146  -2.259  -8.420
  530   1HB   MET  74          2HB       MET  74  -5.529  -0.357 -10.742
  531   2HB   MET  74          1HB       MET  74  -6.570  -1.766 -10.536
  532   1HG   MET  74          2HG       MET  74  -6.127  -0.001  -8.166
  533   2HG   MET  74          1HG       MET  74  -7.196   0.583  -9.441
  534   1HE   MET  74          1HE       MET  74  -7.134  -3.005  -6.899
  535   2HE   MET  74          2HE       MET  74  -7.782  -1.634  -6.002
  536   3HE   MET  74          3HE       MET  74  -6.239  -1.478  -6.841
  537    H    PHE  75           H        PHE  75  -3.398  -1.477 -11.434
  538    HA   PHE  75           HA       PHE  75  -3.574  -4.235 -12.379
  539   1HB   PHE  75          2HB       PHE  75  -2.473  -3.378 -14.274
  540   2HB   PHE  75          1HB       PHE  75  -3.327  -1.962 -13.663
  541    HD1  PHE  75           HD1      PHE  75  -0.028  -3.726 -13.483
  542    HD2  PHE  75           HD2      PHE  75  -2.165  -0.020 -13.113
  543    HE1  PHE  75           HE1      PHE  75   2.121  -2.505 -13.268
  544    HE2  PHE  75           HE2      PHE  75  -0.021   1.194 -12.911
  545    HZ   PHE  75           HZ       PHE  75   2.118  -0.041 -12.991
  546    H    LEU  76           H        LEU  76  -1.414  -2.245 -10.496
  547    HA   LEU  76           HA       LEU  76   0.937  -3.882 -10.475
  548   1HB   LEU  76          2HB       LEU  76  -0.323  -1.697  -8.949
  549   2HB   LEU  76          1HB       LEU  76   0.728  -2.724  -7.978
  550    HG   LEU  76           HG       LEU  76   1.553  -1.511 -10.626
  551   1HD1  LEU  76          1HD1      LEU  76   1.714  -0.501  -7.807
  552   2HD1  LEU  76          2HD1      LEU  76   1.411   0.393  -9.297
  553   3HD1  LEU  76          3HD1      LEU  76   3.044  -0.152  -8.911
  554   1HD2  LEU  76          1HD2      LEU  76   3.506  -2.633 -10.349
  555   2HD2  LEU  76          2HD2      LEU  76   2.611  -3.631  -9.205
  556   3HD2  LEU  76          3HD2      LEU  76   3.570  -2.268  -8.625
  557    H    VAL  77           H        VAL  77  -2.182  -4.069  -8.946
  558    HA   VAL  77           HA       VAL  77  -1.377  -6.276  -7.151
  559    HB   VAL  77           HB       VAL  77  -3.939  -4.708  -7.649
  560   1HG1  VAL  77          1HG1      VAL  77  -4.929  -6.511  -6.665
  561   2HG1  VAL  77          2HG1      VAL  77  -4.193  -5.904  -5.182
  562   3HG1  VAL  77          3HG1      VAL  77  -3.392  -7.172  -6.109
  563   1HG2  VAL  77          1HG2      VAL  77  -2.288  -4.692  -5.130
  564   2HG2  VAL  77          2HG2      VAL  77  -3.354  -3.444  -5.774
  565   3HG2  VAL  77          3HG2      VAL  77  -1.777  -3.720  -6.513
  566    H    TYR  78           H        TYR  78  -3.534  -5.698  -9.928
  567    HA   TYR  78           HA       TYR  78  -4.473  -8.444 -10.031
  568   1HB   TYR  78          2HB       TYR  78  -4.755  -5.893 -11.484
  569   2HB   TYR  78          1HB       TYR  78  -4.943  -7.327 -12.494
  570    HD1  TYR  78           HD1      TYR  78  -6.682  -5.082 -10.473
  571    HD2  TYR  78           HD2      TYR  78  -6.343  -9.292 -11.259
  572    HE1  TYR  78           HE1      TYR  78  -8.951  -5.434  -9.542
  573    HE2  TYR  78           HE2      TYR  78  -8.616  -9.647 -10.333
  574    HH   TYR  78           HH       TYR  78 -10.212  -8.632  -8.943
  575    H    CYS  79           H        CYS  79  -1.801  -6.664 -11.481
  576    HA   CYS  79           HA       CYS  79  -1.192  -8.756 -13.438
  577   1HB   CYS  79          2HB       CYS  79   0.350  -6.342 -12.424
  578   2HB   CYS  79          1HB       CYS  79   0.762  -7.282 -13.857
  579    HG   CYS  79           HG       CYS  79  -1.803  -6.564 -14.655
  580    H    ALA  80           H        ALA  80  -0.651  -8.299 -10.088
  581    HA   ALA  80           HA       ALA  80   1.890  -9.795  -9.996
  582   1HB   ALA  80          1HB       ALA  80   1.187  -9.636  -7.462
  583   2HB   ALA  80          2HB       ALA  80  -0.029  -8.512  -8.070
  584   3HB   ALA  80          3HB       ALA  80   1.685  -8.173  -8.311
  585    H    LEU  81           H        LEU  81  -1.469 -10.387 -10.061
  586    HA   LEU  81           HA       LEU  81  -1.305 -13.059  -8.802
  587   1HB   LEU  81          2HB       LEU  81  -3.688 -11.975 -10.268
  588   2HB   LEU  81          1HB       LEU  81  -3.639 -12.906  -8.773
  589    HG   LEU  81           HG       LEU  81  -3.035  -9.978  -9.174
  590   1HD1  LEU  81          1HD1      LEU  81  -5.389 -10.686  -8.817
  591   2HD1  LEU  81          2HD1      LEU  81  -4.781  -9.693  -7.493
  592   3HD1  LEU  81          3HD1      LEU  81  -4.909 -11.441  -7.297
  593   1HD2  LEU  81          1HD2      LEU  81  -1.410 -11.412  -7.618
  594   2HD2  LEU  81          2HD2      LEU  81  -2.761 -11.284  -6.492
  595   3HD2  LEU  81          3HD2      LEU  81  -1.987  -9.828  -7.112
  596    H    GLU  82           H        GLU  82  -1.849 -11.541 -11.945
  597    HA   GLU  82           HA       GLU  82  -2.332 -13.960 -13.433
  598   1HB   GLU  82          2HB       GLU  82  -2.498 -11.230 -13.805
  599   2HB   GLU  82          1HB       GLU  82  -1.123 -11.662 -14.822
  600   1HG   GLU  82          2HG       GLU  82  -3.148 -13.636 -15.211
  601   2HG   GLU  82          1HG       GLU  82  -3.903 -12.048 -15.356
  602    H    LYS  83           H        LYS  83   0.527 -11.828 -13.231
  603    HA   LYS  83           HA       LYS  83   2.432 -13.961 -13.090
  604   1HB   LYS  83          2HB       LYS  83   1.314 -14.228 -15.405
  605   2HB   LYS  83          1HB       LYS  83   2.217 -12.787 -15.861
  606   1HG   LYS  83          2HG       LYS  83   4.167 -13.925 -15.992
  607   2HG   LYS  83          1HG       LYS  83   3.867 -14.768 -14.471
  608   1HD   LYS  83          2HD       LYS  83   3.388 -16.627 -15.644
  609   2HD   LYS  83          1HD       LYS  83   1.994 -15.793 -16.330
  610   1HE   LYS  83          2HE       LYS  83   4.789 -15.482 -17.465
  611   2HE   LYS  83          1HE       LYS  83   3.640 -16.700 -18.054
  612   1HZ   LYS  83          1HZ       LYS  83   3.191 -13.765 -17.912
  613   2HZ   LYS  83          2HZ       LYS  83   2.002 -14.902 -18.339
  614   3HZ   LYS  83          3HZ       LYS  83   3.369 -14.688 -19.324
  615    H    GLU  84           H        GLU  84   1.715 -10.633 -13.980
  616    HA   GLU  84           HA       GLU  84   4.499  -9.774 -14.122
  617   1HB   GLU  84          2HB       GLU  84   1.944  -8.812 -14.774
  618   2HB   GLU  84          1HB       GLU  84   2.540  -7.710 -13.533
  619   1HG   GLU  84          2HG       GLU  84   4.301  -8.523 -15.839
  620   2HG   GLU  84          1HG       GLU  84   3.145  -7.201 -16.007
  621    HA   PRO  85           HA       PRO  85   4.680  -9.646  -9.623
  622   1HB   PRO  85          2HB       PRO  85   7.402  -9.421  -9.488
  623   2HB   PRO  85          1HB       PRO  85   6.579 -10.972  -9.747
  624   1HG   PRO  85          2HG       PRO  85   7.964  -9.215 -11.696
  625   2HG   PRO  85          1HG       PRO  85   7.873 -10.980 -11.631
  626   1HD   PRO  85          2HD       PRO  85   6.387  -9.397 -13.326
  627   2HD   PRO  85          1HD       PRO  85   5.943 -11.042 -12.830
  628    H    VAL  86           H        VAL  86   6.469  -8.009  -8.324
  629    HA   VAL  86           HA       VAL  86   5.824  -5.316  -9.458
  630    HB   VAL  86           HB       VAL  86   6.404  -6.259  -6.630
  631   1HG1  VAL  86          1HG1      VAL  86   5.184  -3.624  -7.441
  632   2HG1  VAL  86          2HG1      VAL  86   6.935  -3.813  -7.345
  633   3HG1  VAL  86          3HG1      VAL  86   5.940  -4.063  -5.908
  634   1HG2  VAL  86          1HG2      VAL  86   3.943  -5.955  -8.282
  635   2HG2  VAL  86          2HG2      VAL  86   3.845  -5.406  -6.610
  636   3HG2  VAL  86          3HG2      VAL  86   4.279  -7.077  -6.966
  637    HA   PRO  87           HA       PRO  87  10.176  -4.820  -9.838
  638   1HB   PRO  87          2HB       PRO  87  10.168  -2.169 -10.511
  639   2HB   PRO  87          1HB       PRO  87   9.653  -3.452 -11.618
  640   1HG   PRO  87          2HG       PRO  87   8.044  -1.469 -10.180
  641   2HG   PRO  87          1HG       PRO  87   7.665  -2.394 -11.636
  642   1HD   PRO  87          2HD       PRO  87   6.777  -2.887  -8.978
  643   2HD   PRO  87          1HD       PRO  87   6.453  -3.854 -10.433
  644    H    MET  88           H        MET  88  11.458  -2.326  -9.244
  645    HA   MET  88           HA       MET  88  11.106  -2.211  -6.264
  646   1HB   MET  88          2HB       MET  88  13.679  -1.911  -7.835
  647   2HB   MET  88          1HB       MET  88  13.507  -2.165  -6.097
  648   1HG   MET  88          2HG       MET  88  12.549  -4.391  -6.497
  649   2HG   MET  88          1HG       MET  88  12.661  -4.139  -8.238
  650   1HE   MET  88          1HE       MET  88  15.820  -5.123  -5.174
  651   2HE   MET  88          2HE       MET  88  14.448  -6.156  -5.564
  652   3HE   MET  88          3HE       MET  88  14.169  -4.526  -4.957
  653    H    SER  89           H        SER  89  10.701  -0.374  -9.002
  654    HA   SER  89           HA       SER  89  10.756   2.099  -7.456
  655   1HB   SER  89          2HB       SER  89  13.122   1.417  -8.322
  656   2HB   SER  89          1HB       SER  89  12.516   2.005  -9.861
  657    HG   SER  89           HG       SER  89  11.982   3.676  -7.756
  658    H    LEU  90           H        LEU  90   9.033   0.442  -9.201
  659    HA   LEU  90           HA       LEU  90   7.346   0.764 -10.820
  660   1HB   LEU  90          2HB       LEU  90   7.616   2.954  -9.091
  661   2HB   LEU  90          1HB       LEU  90   7.439   3.661 -10.698
  662    HG   LEU  90           HG       LEU  90   5.625   1.512  -9.593
  663   1HD1  LEU  90          1HD1      LEU  90   5.542   3.786  -8.405
  664   2HD1  LEU  90          2HD1      LEU  90   4.024   3.224  -9.103
  665   3HD1  LEU  90          3HD1      LEU  90   4.976   4.452  -9.937
  666   1HD2  LEU  90          1HD2      LEU  90   4.413   1.728 -11.558
  667   2HD2  LEU  90          2HD2      LEU  90   6.047   2.018 -12.157
  668   3HD2  LEU  90          3HD2      LEU  90   4.969   3.378 -11.840
  669    HA   PRO  91           HA       PRO  91   9.953   1.688 -14.386
  670   1HB   PRO  91          2HB       PRO  91   8.357   0.388 -16.192
  671   2HB   PRO  91          1HB       PRO  91   9.517  -0.462 -15.147
  672   1HG   PRO  91          2HG       PRO  91   6.573  -0.142 -14.840
  673   2HG   PRO  91          1HG       PRO  91   7.592  -1.558 -14.530
  674   1HD   PRO  91          2HD       PRO  91   6.671   0.063 -12.551
  675   2HD   PRO  91          1HD       PRO  91   8.205  -0.824 -12.441
  676    HA   PRO  92           HA       PRO  92   7.599   4.952 -16.137
  677   1HB   PRO  92          2HB       PRO  92   8.378   4.990 -18.751
  678   2HB   PRO  92          1HB       PRO  92   9.450   5.466 -17.419
  679   1HG   PRO  92          2HG       PRO  92   9.409   2.984 -19.020
  680   2HG   PRO  92          1HG       PRO  92  10.766   3.801 -18.234
  681   1HD   PRO  92          2HD       PRO  92   9.438   1.529 -17.291
  682   2HD   PRO  92          1HD       PRO  92  10.540   2.563 -16.356
  683    H    ALA  93           H        ALA  93   6.929   1.814 -17.236
  684    HA   ALA  93           HA       ALA  93   4.871   2.593 -19.194
  685   1HB   ALA  93          1HB       ALA  93   5.332   0.471 -19.839
  686   2HB   ALA  93          2HB       ALA  93   4.671  -0.126 -18.317
  687   3HB   ALA  93          3HB       ALA  93   6.383   0.274 -18.437
  688    H    LEU  94           H        LEU  94   4.968   3.087 -16.047
  689    HA   LEU  94           HA       LEU  94   2.105   2.336 -15.617
  690   1HB   LEU  94          2HB       LEU  94   4.334   2.318 -13.584
  691   2HB   LEU  94          1HB       LEU  94   2.707   1.678 -13.371
  692    HG   LEU  94           HG       LEU  94   4.758   0.655 -15.351
  693   1HD1  LEU  94          1HD1      LEU  94   4.836   0.266 -12.691
  694   2HD1  LEU  94          2HD1      LEU  94   5.294  -0.990 -13.841
  695   3HD1  LEU  94          3HD1      LEU  94   3.685  -0.999 -13.122
  696   1HD2  LEU  94          1HD2      LEU  94   2.985  -0.263 -16.368
  697   2HD2  LEU  94          2HD2      LEU  94   1.887   0.403 -15.154
  698   3HD2  LEU  94          3HD2      LEU  94   2.647  -1.171 -14.897
  699    H    VAL  95           H        VAL  95   4.700   4.649 -15.127
  700    HA   VAL  95           HA       VAL  95   2.993   6.382 -13.439
  701    HB   VAL  95           HB       VAL  95   5.155   7.781 -13.518
  702   1HG1  VAL  95          1HG1      VAL  95   6.009   6.585 -11.722
  703   2HG1  VAL  95          2HG1      VAL  95   5.724   5.025 -12.493
  704   3HG1  VAL  95          3HG1      VAL  95   4.374   5.928 -11.806
  705   1HG2  VAL  95          1HG2      VAL  95   7.099   6.861 -14.453
  706   2HG2  VAL  95          2HG2      VAL  95   5.872   6.460 -15.656
  707   3HG2  VAL  95          3HG2      VAL  95   6.415   5.237 -14.507
  708    HA   PRO  96           HA       PRO  96   1.640   8.860 -16.785
  709   1HB   PRO  96          2HB       PRO  96   1.235  11.220 -15.452
  710   2HB   PRO  96          1HB       PRO  96   0.154   9.820 -15.295
  711   1HG   PRO  96          2HG       PRO  96   2.327  10.744 -13.475
  712   2HG   PRO  96          1HG       PRO  96   0.723  10.105 -13.081
  713   1HD   PRO  96          2HD       PRO  96   2.981   8.608 -12.920
  714   2HD   PRO  96          1HD       PRO  96   1.389   7.916 -13.315
  715    HA   PRO  97           HA       PRO  97   4.993  11.258 -18.282
  716   1HB   PRO  97          2HB       PRO  97   3.786  13.389 -19.495
  717   2HB   PRO  97          1HB       PRO  97   3.739  11.743 -20.158
  718   1HG   PRO  97          2HG       PRO  97   1.664  13.230 -18.631
  719   2HG   PRO  97          1HG       PRO  97   1.482  12.113 -19.993
  720   1HD   PRO  97          2HD       PRO  97   1.005  11.424 -17.392
  721   2HD   PRO  97          1HD       PRO  97   1.494  10.265 -18.648
  722    H    SER  98           H        SER  98   2.865  12.697 -15.967
  723    HA   SER  98           HA       SER  98   4.263  15.229 -15.711
  724   1HB   SER  98          2HB       SER  98   2.575  15.659 -14.216
  725   2HB   SER  98          1HB       SER  98   1.860  14.217 -14.929
  726    HG   SER  98           HG       SER  98   2.986  14.617 -12.447
  727    H    LYS  99           H        LYS  99   4.166  12.321 -13.664
  728    HA   LYS  99           HA       LYS  99   6.596  13.223 -12.235
  729   1HB   LYS  99          2HB       LYS  99   4.310  11.558 -11.773
  730   2HB   LYS  99          1HB       LYS  99   5.756  10.568 -11.580
  731   1HG   LYS  99          2HG       LYS  99   6.218  13.116 -10.346
  732   2HG   LYS  99          1HG       LYS  99   4.692  12.464  -9.746
  733   1HD   LYS  99          2HD       LYS  99   5.792  10.359  -9.151
  734   2HD   LYS  99          1HD       LYS  99   7.317  10.946  -9.817
  735   1HE   LYS  99          2HE       LYS  99   6.590  12.977  -8.067
  736   2HE   LYS  99          1HE       LYS  99   6.111  11.501  -7.205
  737   1HZ   LYS  99          1HZ       LYS  99   8.660  11.480  -8.640
  738   2HZ   LYS  99          2HZ       LYS  99   8.221  10.691  -7.201
  739   3HZ   LYS  99          3HZ       LYS  99   8.596  12.347  -7.184
  740    H    ARG 100           H        ARG 100   6.326  12.220 -15.185
  741    HA   ARG 100           HA       ARG 100   8.235   9.926 -15.055
  742   1HB   ARG 100          2HB       ARG 100   6.513   9.280 -16.433
  743   2HB   ARG 100          1HB       ARG 100   6.094  10.938 -16.843
  744   1HG   ARG 100          2HG       ARG 100   7.442  10.965 -18.670
  745   2HG   ARG 100          1HG       ARG 100   8.708  10.032 -17.876
  746   1HD   ARG 100          2HD       ARG 100   7.518   8.842 -19.806
  747   2HD   ARG 100          1HD       ARG 100   7.534   7.954 -18.271
  748    HE   ARG 100           HE       ARG 100   5.226   9.431 -18.072
  749   1HH1  ARG 100          1HH2      ARG 100   5.045   9.546 -21.027
  750   2HH1  ARG 100          2HH2      ARG 100   4.183   8.094 -21.411
  751   1HH2  ARG 100          2HH1      ARG 100   4.762   6.621 -18.324
  752   2HH2  ARG 100          1HH1      ARG 100   4.023   6.436 -19.880
  753    H    SER 107           1H       SER 107   8.188   4.383   4.820
  754    HA   SER 107           HA       SER 107   6.981   6.701   3.390
  755   1HB   SER 107          2HB       SER 107   7.830   4.927   1.926
  756   2HB   SER 107          1HB       SER 107   7.031   3.702   2.907
  757    HG   SER 107           HG       SER 107   5.041   4.675   2.340
  758    H    THR 108           H        THR 108   4.542   6.422   3.375
  759    HA   THR 108           HA       THR 108   3.617   5.608   6.078
  760    HB   THR 108           HB       THR 108   1.563   6.852   5.297
  761    HG1  THR 108           HG1      THR 108   1.802   6.480   3.088
  762   1HG2  THR 108          1HG2      THR 108   3.873   8.639   4.702
  763   2HG2  THR 108          2HG2      THR 108   3.845   7.843   6.276
  764   3HG2  THR 108          3HG2      THR 108   2.511   8.890   5.793
  765    H    ASN 109           H        ASN 109   4.264   3.636   3.861
  766    HA   ASN 109           HA       ASN 109   1.902   2.566   2.692
  767   1HB   ASN 109          2HB       ASN 109   4.213   1.999   2.066
  768   2HB   ASN 109          1HB       ASN 109   4.460   1.238   3.635
  769   1HD2  ASN 109          1HD2      ASN 109   3.415   0.666   0.430
  770   2HD2  ASN 109          2HD2      ASN 109   2.711  -0.858   0.675
  771    HA   PRO 110           HA       PRO 110  -0.060   0.921   6.291
  772   1HB   PRO 110          2HB       PRO 110  -1.982  -0.536   5.003
  773   2HB   PRO 110          1HB       PRO 110  -2.043   1.230   5.154
  774   1HG   PRO 110          2HG       PRO 110  -1.282  -0.443   2.831
  775   2HG   PRO 110          1HG       PRO 110  -2.102   1.123   2.877
  776   1HD   PRO 110          2HD       PRO 110   0.570   0.749   2.267
  777   2HD   PRO 110          1HD       PRO 110  -0.147   2.277   2.820
  778    H    PHE 111           H        PHE 111   1.091  -1.165   3.664
  779    HA   PHE 111           HA       PHE 111   0.811  -3.627   5.229
  780   1HB   PHE 111          2HB       PHE 111   2.409  -3.094   2.708
  781   2HB   PHE 111          1HB       PHE 111   1.776  -4.643   3.257
  782    HD1  PHE 111           HD1      PHE 111   0.986  -1.482   1.594
  783    HD2  PHE 111           HD2      PHE 111  -0.653  -5.077   3.276
  784    HE1  PHE 111           HE1      PHE 111  -1.155  -1.055   0.423
  785    HE2  PHE 111           HE2      PHE 111  -2.790  -4.645   2.108
  786    HZ   PHE 111           HZ       PHE 111  -3.044  -2.636   0.687
  787    H    LEU 112           HN       LEU 112   3.443  -1.364   4.439
  788    HA   LEU 112           HA       LEU 112   5.659  -2.877   5.350
  789   1HB   LEU 112          2HB       LEU 112   4.940  -0.127   4.751
  790   2HB   LEU 112          1HB       LEU 112   6.075  -0.199   6.095
  791    HG   LEU 112           HG       LEU 112   7.191  -0.077   3.849
  792   1HD1  LEU 112          1HD1      LEU 112   8.597  -0.972   5.487
  793   2HD1  LEU 112          2HD1      LEU 112   8.574  -2.269   4.293
  794   3HD1  LEU 112          3HD1      LEU 112   7.570  -2.384   5.739
  795   1HD2  LEU 112          1HD2      LEU 112   7.064  -1.937   2.336
  796   2HD2  LEU 112          2HD2      LEU 112   5.400  -1.519   2.746
  797   3HD2  LEU 112          3HD2      LEU 112   6.173  -2.909   3.507
  Start of MODEL   18
    1    HA   PRO   6           HA       PRO   6   0.921   7.394 -23.022
    2   1HB   PRO   6          2HB       PRO   6  -1.049   5.506 -22.817
    3   2HB   PRO   6          1HB       PRO   6  -0.695   6.372 -24.324
    4   1HG   PRO   6          2HG       PRO   6   0.076   3.624 -23.496
    5   2HG   PRO   6          1HG       PRO   6  -0.406   4.231 -25.086
    6   1HD   PRO   6          2HD       PRO   6   2.187   3.740 -24.361
    7   2HD   PRO   6          1HD       PRO   6   1.709   4.910 -25.610
    8    H    TRP   7           H        TRP   7  -0.646   6.835 -21.003
    9    HA   TRP   7           HA       TRP   7   1.030   6.304 -18.737
   10   1HB   TRP   7          2HB       TRP   7  -1.010   7.704 -18.774
   11   2HB   TRP   7          1HB       TRP   7  -1.990   6.274 -19.099
   12    HD1  TRP   7           HD1      TRP   7   0.838   5.714 -16.728
   13    HE1  TRP   7           HE1      TRP   7  -0.065   5.492 -14.320
   14    HE3  TRP   7           HE3      TRP   7  -3.984   7.220 -17.452
   15    HZ2  TRP   7           HZ2      TRP   7  -2.511   5.898 -12.895
   16    HZ3  TRP   7           HZ3      TRP   7  -5.578   7.293 -15.558
   17    HH2  TRP   7           HH2      TRP   7  -4.849   6.635 -13.281
   18    H    ALA   8           H        ALA   8   1.645   4.330 -17.929
   19    HA   ALA   8           HA       ALA   8   1.288   1.833 -19.022
   20   1HB   ALA   8          1HB       ALA   8   1.626   1.009 -16.657
   21   2HB   ALA   8          2HB       ALA   8   1.379   2.667 -16.108
   22   3HB   ALA   8          3HB       ALA   8   2.753   2.277 -17.143
   23    H    VAL   9           H        VAL   9  -1.054   3.628 -17.121
   24    HA   VAL   9           HA       VAL   9  -2.907   1.290 -17.099
   25    HB   VAL   9           HB       VAL   9  -2.799   3.990 -15.734
   26   1HG1  VAL   9          1HG1      VAL   9  -4.900   3.046 -14.532
   27   2HG1  VAL   9          2HG1      VAL   9  -5.058   2.001 -15.943
   28   3HG1  VAL   9          3HG1      VAL   9  -5.116   3.753 -16.133
   29   1HG2  VAL   9          1HG2      VAL   9  -2.675   2.614 -13.708
   30   2HG2  VAL   9          2HG2      VAL   9  -1.413   2.119 -14.837
   31   3HG2  VAL   9          3HG2      VAL   9  -2.875   1.148 -14.667
   32    H    LYS  10           H        LYS  10  -4.499   1.193 -18.631
   33    HA   LYS  10           HA       LYS  10  -4.825   3.402 -20.543
   34   1HB   LYS  10          2HB       LYS  10  -5.507   0.544 -20.233
   35   2HB   LYS  10          1HB       LYS  10  -6.698   1.481 -21.134
   36   1HG   LYS  10          2HG       LYS  10  -4.085   2.272 -22.002
   37   2HG   LYS  10          1HG       LYS  10  -4.179   0.511 -22.048
   38   1HD   LYS  10          2HD       LYS  10  -6.635   1.309 -23.068
   39   2HD   LYS  10          1HD       LYS  10  -5.509   2.484 -23.749
   40   1HE   LYS  10          2HE       LYS  10  -4.814   0.928 -25.239
   41   2HE   LYS  10          1HE       LYS  10  -4.288  -0.110 -23.900
   42   1HZ   LYS  10          1HZ       LYS  10  -6.767  -0.610 -23.636
   43   2HZ   LYS  10          2HZ       LYS  10  -5.950  -1.349 -24.931
   44   3HZ   LYS  10          3HZ       LYS  10  -6.937   0.007 -25.207
   45    HA   PRO  11           HA       PRO  11  -8.541   5.149 -18.989
   46   1HB   PRO  11          2HB       PRO  11 -10.310   5.027 -21.083
   47   2HB   PRO  11          1HB       PRO  11  -8.950   6.167 -21.029
   48   1HG   PRO  11          2HG       PRO  11  -9.176   3.555 -22.451
   49   2HG   PRO  11          1HG       PRO  11  -8.462   5.080 -23.003
   50   1HD   PRO  11          2HD       PRO  11  -6.958   3.023 -22.114
   51   2HD   PRO  11          1HD       PRO  11  -6.484   4.720 -21.873
   52    H    GLU  12           H        GLU  12  -8.966   2.076 -20.691
   53    HA   GLU  12           HA       GLU  12 -11.489   1.392 -19.415
   54   1HB   GLU  12          2HB       GLU  12 -11.092  -0.750 -20.512
   55   2HB   GLU  12          1HB       GLU  12 -10.601   0.536 -21.614
   56   1HG   GLU  12          2HG       GLU  12  -8.248   0.233 -20.499
   57   2HG   GLU  12          1HG       GLU  12  -8.879  -1.342 -20.019
   58    H    ASP  13           H        ASP  13  -8.084   1.005 -18.651
   59    HA   ASP  13           HA       ASP  13  -8.551  -0.934 -16.497
   60   1HB   ASP  13          2HB       ASP  13  -6.404   0.027 -18.083
   61   2HB   ASP  13          1HB       ASP  13  -6.016   0.462 -16.417
   62    H    LYS  14           H        LYS  14  -7.903   2.531 -16.860
   63    HA   LYS  14           HA       LYS  14  -7.777   3.091 -14.024
   64   1HB   LYS  14          2HB       LYS  14  -7.041   4.423 -16.201
   65   2HB   LYS  14          1HB       LYS  14  -8.673   5.083 -16.084
   66   1HG   LYS  14          2HG       LYS  14  -7.625   5.144 -13.462
   67   2HG   LYS  14          1HG       LYS  14  -6.340   5.743 -14.512
   68   1HD   LYS  14          2HD       LYS  14  -8.127   7.226 -15.598
   69   2HD   LYS  14          1HD       LYS  14  -9.156   6.803 -14.228
   70   1HE   LYS  14          2HE       LYS  14  -7.528   7.727 -12.657
   71   2HE   LYS  14          1HE       LYS  14  -6.392   8.048 -13.981
   72   1HZ   LYS  14          1HZ       LYS  14  -8.387   9.728 -13.118
   73   2HZ   LYS  14          2HZ       LYS  14  -8.999   9.059 -14.554
   74   3HZ   LYS  14          3HZ       LYS  14  -7.507   9.870 -14.560
   75    H    ALA  15           H        ALA  15 -10.298   2.462 -16.272
   76    HA   ALA  15           HA       ALA  15 -12.453   3.873 -14.931
   77   1HB   ALA  15          1HB       ALA  15 -12.200   2.903 -17.360
   78   2HB   ALA  15          2HB       ALA  15 -13.778   2.820 -16.577
   79   3HB   ALA  15          3HB       ALA  15 -12.742   1.394 -16.626
   80    H    LYS  16           H        LYS  16 -11.260   0.504 -14.945
   81    HA   LYS  16           HA       LYS  16 -13.172  -0.380 -12.941
   82   1HB   LYS  16          2HB       LYS  16 -12.201  -2.446 -13.358
   83   2HB   LYS  16          1HB       LYS  16 -11.728  -1.594 -14.825
   84   1HG   LYS  16          2HG       LYS  16  -9.593  -0.960 -13.659
   85   2HG   LYS  16          1HG       LYS  16 -10.051  -2.058 -12.360
   86   1HD   LYS  16          2HD       LYS  16  -9.908  -2.921 -15.259
   87   2HD   LYS  16          1HD       LYS  16  -8.537  -3.060 -14.160
   88   1HE   LYS  16          2HE       LYS  16 -11.254  -4.238 -13.508
   89   2HE   LYS  16          1HE       LYS  16  -9.986  -5.156 -14.343
   90   1HZ   LYS  16          1HZ       LYS  16  -8.717  -5.246 -12.511
   91   2HZ   LYS  16          2HZ       LYS  16 -10.156  -4.915 -11.670
   92   3HZ   LYS  16          3HZ       LYS  16  -9.079  -3.656 -12.044
   93    H    TYR  17           H        TYR  17 -10.193   1.316 -12.952
   94    HA   TYR  17           HA       TYR  17  -9.410   0.673 -10.188
   95   1HB   TYR  17          2HB       TYR  17  -8.524   2.737 -12.236
   96   2HB   TYR  17          1HB       TYR  17  -7.722   2.473 -10.691
   97    HD1  TYR  17           HD1      TYR  17  -8.953  -0.639 -11.668
   98    HD2  TYR  17           HD2      TYR  17  -5.856   2.174 -12.638
   99    HE1  TYR  17           HE1      TYR  17  -7.613  -2.462 -12.675
  100    HE2  TYR  17           HE2      TYR  17  -4.503   0.347 -13.638
  101    HH   TYR  17           HH       TYR  17  -5.040  -2.839 -13.097
  102    H    ASP  18           H        ASP  18 -11.226   3.110 -11.941
  103    HA   ASP  18           HA       ASP  18 -11.345   4.992  -9.679
  104   1HB   ASP  18          2HB       ASP  18 -11.655   5.023 -12.474
  105   2HB   ASP  18          1HB       ASP  18 -13.257   5.383 -11.831
  106    H    ALA  19           H        ALA  19 -12.999   2.165 -10.572
  107    HA   ALA  19           HA       ALA  19 -15.576   2.975  -9.327
  108   1HB   ALA  19          1HB       ALA  19 -14.582   0.992 -11.207
  109   2HB   ALA  19          2HB       ALA  19 -16.252   1.457 -10.884
  110   3HB   ALA  19          3HB       ALA  19 -15.481   0.205  -9.911
  111    H    ILE  20           H        ILE  20 -12.688   1.104  -8.837
  112    HA   ILE  20           HA       ILE  20 -13.524  -0.125  -6.321
  113    HB   ILE  20           HB       ILE  20 -10.933   0.203  -7.869
  114   1HG1  ILE  20          2HG1      ILE  20 -12.626  -2.269  -7.444
  115   2HG1  ILE  20          1HG1      ILE  20 -12.817  -1.204  -8.838
  116   1HG2  ILE  20          1HG2      ILE  20 -11.537  -1.485  -5.441
  117   2HG2  ILE  20          2HG2      ILE  20 -10.476  -0.079  -5.493
  118   3HG2  ILE  20          3HG2      ILE  20 -10.046  -1.540  -6.381
  119   1HD1  ILE  20          1HD1      ILE  20 -10.179  -2.475  -8.059
  120   2HD1  ILE  20          2HD1      ILE  20 -10.545  -1.605  -9.550
  121   3HD1  ILE  20          3HD1      ILE  20 -11.286  -3.177  -9.239
  122    H    PHE  21           H        PHE  21 -11.571   2.588  -7.480
  123    HA   PHE  21           HA       PHE  21 -10.530   3.450  -4.946
  124   1HB   PHE  21          2HB       PHE  21  -9.381   4.388  -6.704
  125   2HB   PHE  21          1HB       PHE  21 -10.799   4.397  -7.744
  126    HD1  PHE  21           HD1      PHE  21  -8.759   6.321  -5.429
  127    HD2  PHE  21           HD2      PHE  21 -12.531   6.189  -7.478
  128    HE1  PHE  21           HE1      PHE  21  -9.079   8.744  -4.997
  129    HE2  PHE  21           HE2      PHE  21 -12.851   8.607  -7.045
  130    HZ   PHE  21           HZ       PHE  21 -11.130   9.884  -5.805
  131    H    ASP  22           H        ASP  22 -13.501   4.077  -6.730
  132    HA   ASP  22           HA       ASP  22 -14.444   6.072  -4.764
  133   1HB   ASP  22          2HB       ASP  22 -14.965   6.573  -7.015
  134   2HB   ASP  22          1HB       ASP  22 -15.408   4.902  -7.374
  135    H    SER  23           H        SER  23 -14.397   2.711  -5.031
  136    HA   SER  23           HA       SER  23 -17.037   2.186  -3.835
  137   1HB   SER  23          2HB       SER  23 -16.034   0.603  -5.398
  138   2HB   SER  23          1HB       SER  23 -14.569   0.512  -4.421
  139    HG   SER  23           HG       SER  23 -15.912  -0.331  -2.725
  140    H    LEU  24           H        LEU  24 -14.001   3.207  -2.784
  141    HA   LEU  24           HA       LEU  24 -14.299   2.090  -0.032
  142   1HB   LEU  24          2HB       LEU  24 -11.990   3.685  -1.149
  143   2HB   LEU  24          1HB       LEU  24 -11.963   2.459   0.118
  144    HG   LEU  24           HG       LEU  24 -12.819   1.690  -2.649
  145   1HD1  LEU  24          1HD1      LEU  24 -10.160   1.020  -2.594
  146   2HD1  LEU  24          2HD1      LEU  24 -10.148   2.611  -1.837
  147   3HD1  LEU  24          3HD1      LEU  24 -10.827   2.406  -3.452
  148   1HD2  LEU  24          1HD2      LEU  24 -13.024   0.085  -0.786
  149   2HD2  LEU  24          2HD2      LEU  24 -11.311   0.293  -0.417
  150   3HD2  LEU  24          3HD2      LEU  24 -11.801  -0.458  -1.935
  151    H    SER  25           H        SER  25 -14.819   4.830  -1.938
  152    HA   SER  25           HA       SER  25 -15.842   6.900  -1.300
  153   1HB   SER  25          2HB       SER  25 -14.923   6.410   1.526
  154   2HB   SER  25          1HB       SER  25 -16.337   7.296   0.965
  155    HG   SER  25           HG       SER  25 -17.330   5.397   0.476
  156    HA   PRO  26           HA       PRO  26 -11.651   8.563  -1.607
  157   1HB   PRO  26          2HB       PRO  26 -12.294  10.438  -3.477
  158   2HB   PRO  26          1HB       PRO  26 -11.960   8.744  -3.885
  159   1HG   PRO  26          2HG       PRO  26 -14.557  10.158  -3.662
  160   2HG   PRO  26          1HG       PRO  26 -14.059   8.876  -4.774
  161   1HD   PRO  26          2HD       PRO  26 -15.625   8.489  -2.539
  162   2HD   PRO  26          1HD       PRO  26 -14.661   7.225  -3.328
  163    H    VAL  27           H        VAL  27 -10.796  10.547  -0.845
  164    HA   VAL  27           HA       VAL  27 -12.788  12.406   0.412
  165    HB   VAL  27           HB       VAL  27 -10.022  11.562   1.347
  166   1HG1  VAL  27          1HG1      VAL  27 -12.002  12.874   3.140
  167   2HG1  VAL  27          2HG1      VAL  27 -11.239  13.900   1.925
  168   3HG1  VAL  27          3HG1      VAL  27 -10.247  13.032   3.097
  169   1HG2  VAL  27          1HG2      VAL  27 -12.038   9.888   1.407
  170   2HG2  VAL  27          2HG2      VAL  27 -12.622  10.912   2.719
  171   3HG2  VAL  27          3HG2      VAL  27 -11.062  10.102   2.861
  172    H    ASN  28           H        ASN  28 -12.737  14.162  -0.982
  173    HA   ASN  28           HA       ASN  28 -11.835  16.027  -2.124
  174   1HB   ASN  28          2HB       ASN  28 -10.732  16.183   0.158
  175   2HB   ASN  28          1HB       ASN  28  -9.353  15.324  -0.525
  176   1HD2  ASN  28          1HD2      ASN  28  -8.151  16.413  -2.296
  177   2HD2  ASN  28          2HD2      ASN  28  -8.231  18.101  -2.461
  178    H    GLY  29           H        GLY  29 -11.283  13.028  -2.860
  179   1HA   GLY  29          2HA       GLY  29 -10.508  12.271  -5.013
  180   2HA   GLY  29          1HA       GLY  29  -9.438  13.673  -5.092
  181    H    PHE  30           H        PHE  30  -9.754  11.496  -2.321
  182    HA   PHE  30           HA       PHE  30  -7.144  10.243  -2.954
  183   1HB   PHE  30          2HB       PHE  30  -7.733  12.049  -0.603
  184   2HB   PHE  30          1HB       PHE  30  -6.317  10.990  -0.675
  185    HD1  PHE  30           HD1      PHE  30  -7.758  14.116  -1.743
  186    HD2  PHE  30           HD2      PHE  30  -4.758  11.187  -2.663
  187    HE1  PHE  30           HE1      PHE  30  -6.600  15.761  -3.177
  188    HE2  PHE  30           HE2      PHE  30  -3.588  12.839  -4.102
  189    HZ   PHE  30           HZ       PHE  30  -4.509  15.131  -4.361
  190    H    LEU  31           H        LEU  31  -6.837   8.288  -1.964
  191    HA   LEU  31           HA       LEU  31  -9.073   7.271  -0.239
  192   1HB   LEU  31          2HB       LEU  31  -7.158   6.038  -2.221
  193   2HB   LEU  31          1HB       LEU  31  -7.913   5.033  -0.985
  194    HG   LEU  31           HG       LEU  31  -9.248   6.582  -3.201
  195   1HD1  LEU  31          1HD1      LEU  31  -8.844   4.453  -3.988
  196   2HD1  LEU  31          2HD1      LEU  31 -10.364   4.152  -3.146
  197   3HD1  LEU  31          3HD1      LEU  31  -8.829   3.752  -2.366
  198   1HD2  LEU  31          1HD2      LEU  31 -11.403   5.762  -2.106
  199   2HD2  LEU  31          2HD2      LEU  31 -10.598   7.093  -1.277
  200   3HD2  LEU  31          3HD2      LEU  31 -10.446   5.451  -0.656
  201    H    SER  32           H        SER  32  -8.452   6.386   1.784
  202    HA   SER  32           HA       SER  32  -5.699   7.075   2.626
  203   1HB   SER  32          2HB       SER  32  -6.618   6.853   4.845
  204   2HB   SER  32          1HB       SER  32  -7.829   7.680   3.868
  205    HG   SER  32           HG       SER  32  -8.899   6.060   4.893
  206    H    GLY  33           H        GLY  33  -4.200   5.568   3.347
  207   1HA   GLY  33          2HA       GLY  33  -3.972   3.076   2.181
  208   2HA   GLY  33          1HA       GLY  33  -3.274   3.430   3.763
  209    H    ASP  34           H        ASP  34  -6.016   3.976   4.852
  210    HA   ASP  34           HA       ASP  34  -6.595   1.328   5.846
  211   1HB   ASP  34          2HB       ASP  34  -8.200   3.906   5.890
  212   2HB   ASP  34          1HB       ASP  34  -8.452   2.524   6.954
  213    H    LYS  35           H        LYS  35  -7.751   3.190   3.104
  214    HA   LYS  35           HA       LYS  35 -10.072   1.390   2.711
  215   1HB   LYS  35          2HB       LYS  35  -8.970   3.911   1.441
  216   2HB   LYS  35          1HB       LYS  35 -10.335   3.038   0.742
  217   1HG   LYS  35          2HG       LYS  35 -11.730   3.491   2.555
  218   2HG   LYS  35          1HG       LYS  35 -10.377   3.724   3.663
  219   1HD   LYS  35          2HD       LYS  35 -10.016   5.902   2.988
  220   2HD   LYS  35          1HD       LYS  35 -10.643   5.615   1.363
  221   1HE   LYS  35          2HE       LYS  35 -12.468   6.758   2.195
  222   2HE   LYS  35          1HE       LYS  35 -12.891   5.160   2.840
  223   1HZ   LYS  35          1HZ       LYS  35 -12.878   6.550   4.704
  224   2HZ   LYS  35          2HZ       LYS  35 -11.479   7.375   4.204
  225   3HZ   LYS  35          3HZ       LYS  35 -11.372   5.775   4.764
  226    H    VAL  36           H        VAL  36  -6.924   2.235   1.384
  227    HA   VAL  36           HA       VAL  36  -7.129   0.485  -0.937
  228    HB   VAL  36           HB       VAL  36  -4.816   1.797   0.510
  229   1HG1  VAL  36          1HG1      VAL  36  -4.755   0.973  -2.366
  230   2HG1  VAL  36          2HG1      VAL  36  -4.484  -0.253  -1.125
  231   3HG1  VAL  36          3HG1      VAL  36  -3.423   1.151  -1.224
  232   1HG2  VAL  36          1HG2      VAL  36  -6.656   3.264  -0.461
  233   2HG2  VAL  36          2HG2      VAL  36  -6.205   2.634  -2.047
  234   3HG2  VAL  36          3HG2      VAL  36  -5.040   3.562  -1.101
  235    H    LYS  37           H        LYS  37  -5.677   0.259   2.310
  236    HA   LYS  37           HA       LYS  37  -4.138  -2.000   2.234
  237   1HB   LYS  37          2HB       LYS  37  -5.774  -0.607   4.152
  238   2HB   LYS  37          1HB       LYS  37  -5.903  -2.337   4.445
  239   1HG   LYS  37          2HG       LYS  37  -3.225  -2.116   4.018
  240   2HG   LYS  37          1HG       LYS  37  -3.566  -0.546   4.749
  241   1HD   LYS  37          2HD       LYS  37  -4.347  -1.495   6.743
  242   2HD   LYS  37          1HD       LYS  37  -4.686  -3.048   5.982
  243   1HE   LYS  37          2HE       LYS  37  -1.859  -2.372   5.746
  244   2HE   LYS  37          1HE       LYS  37  -2.379  -2.401   7.442
  245   1HZ   LYS  37          1HZ       LYS  37  -2.264  -4.562   5.517
  246   2HZ   LYS  37          2HZ       LYS  37  -3.696  -4.509   6.427
  247   3HZ   LYS  37          3HZ       LYS  37  -2.193  -4.616   7.209
  248    HA   PRO  38           HA       PRO  38  -7.919  -4.967   2.488
  249   1HB   PRO  38          2HB       PRO  38 -10.371  -3.882   1.890
  250   2HB   PRO  38          1HB       PRO  38  -9.735  -3.992   3.545
  251   1HG   PRO  38          2HG       PRO  38  -9.739  -1.670   1.667
  252   2HG   PRO  38          1HG       PRO  38 -10.093  -1.713   3.403
  253   1HD   PRO  38          2HD       PRO  38  -7.721  -0.871   2.464
  254   2HD   PRO  38          1HD       PRO  38  -7.857  -1.764   3.997
  255    H    VAL  39           H        VAL  39  -8.022  -2.295   0.200
  256    HA   VAL  39           HA       VAL  39  -9.078  -3.717  -2.059
  257    HB   VAL  39           HB       VAL  39  -7.450  -1.242  -1.538
  258   1HG1  VAL  39          1HG1      VAL  39  -6.795  -2.434  -3.783
  259   2HG1  VAL  39          2HG1      VAL  39  -7.172  -0.717  -3.794
  260   3HG1  VAL  39          3HG1      VAL  39  -8.382  -1.887  -4.322
  261   1HG2  VAL  39          1HG2      VAL  39 -10.188  -1.921  -1.697
  262   2HG2  VAL  39          2HG2      VAL  39  -9.840  -0.942  -3.120
  263   3HG2  VAL  39          3HG2      VAL  39  -9.494  -0.313  -1.509
  264    H    LEU  40           H        LEU  40  -5.834  -3.469  -0.670
  265    HA   LEU  40           HA       LEU  40  -4.614  -4.844  -2.999
  266   1HB   LEU  40          2HB       LEU  40  -3.368  -4.005  -0.371
  267   2HB   LEU  40          1HB       LEU  40  -2.553  -4.272  -1.911
  268    HG   LEU  40           HG       LEU  40  -4.647  -2.142  -1.465
  269   1HD1  LEU  40          1HD1      LEU  40  -2.944  -1.202  -0.245
  270   2HD1  LEU  40          2HD1      LEU  40  -2.354  -0.772  -1.852
  271   3HD1  LEU  40          3HD1      LEU  40  -1.707  -2.190  -1.025
  272   1HD2  LEU  40          1HD2      LEU  40  -2.632  -2.514  -3.692
  273   2HD2  LEU  40          2HD2      LEU  40  -3.939  -1.332  -3.629
  274   3HD2  LEU  40          3HD2      LEU  40  -4.309  -3.050  -3.784
  275    H    LEU  41           H        LEU  41  -5.388  -5.448   0.417
  276    HA   LEU  41           HA       LEU  41  -4.065  -8.014   0.555
  277   1HB   LEU  41          2HB       LEU  41  -6.397  -6.900   2.146
  278   2HB   LEU  41          1HB       LEU  41  -5.296  -8.179   2.661
  279    HG   LEU  41           HG       LEU  41  -4.118  -5.560   1.844
  280   1HD1  LEU  41          1HD1      LEU  41  -4.716  -4.432   3.779
  281   2HD1  LEU  41          2HD1      LEU  41  -5.011  -5.921   4.676
  282   3HD1  LEU  41          3HD1      LEU  41  -6.188  -5.360   3.490
  283   1HD2  LEU  41          1HD2      LEU  41  -3.009  -6.545   4.221
  284   2HD2  LEU  41          2HD2      LEU  41  -2.336  -6.732   2.601
  285   3HD2  LEU  41          3HD2      LEU  41  -3.377  -7.987   3.274
  286    H    ASN  42           H        ASN  42  -6.947  -6.892  -0.916
  287    HA   ASN  42           HA       ASN  42  -8.423  -9.388  -0.695
  288   1HB   ASN  42          2HB       ASN  42  -8.821  -6.690  -1.559
  289   2HB   ASN  42          1HB       ASN  42  -9.286  -7.757  -2.884
  290   1HD2  ASN  42          1HD2      ASN  42 -10.244  -6.565   0.230
  291   2HD2  ASN  42          2HD2      ASN  42 -11.632  -7.526   0.404
  292    H    SER  43           H        SER  43  -5.851  -8.229  -2.603
  293    HA   SER  43           HA       SER  43  -6.371  -9.759  -5.035
  294   1HB   SER  43          2HB       SER  43  -3.652  -8.832  -4.278
  295   2HB   SER  43          1HB       SER  43  -4.547  -8.580  -5.776
  296    HG   SER  43           HG       SER  43  -4.541  -7.125  -3.406
  297    H    LYS  44           H        LYS  44  -5.716 -10.819  -2.006
  298    HA   LYS  44           HA       LYS  44  -4.910 -12.892  -1.199
  299   1HB   LYS  44          2HB       LYS  44  -5.741 -13.294  -3.798
  300   2HB   LYS  44          1HB       LYS  44  -4.068 -13.847  -3.858
  301   1HG   LYS  44          2HG       LYS  44  -4.488 -15.656  -2.547
  302   2HG   LYS  44          1HG       LYS  44  -5.544 -14.740  -1.470
  303   1HD   LYS  44          2HD       LYS  44  -6.730 -16.538  -2.774
  304   2HD   LYS  44          1HD       LYS  44  -7.392 -14.922  -3.016
  305   1HE   LYS  44          2HE       LYS  44  -6.114 -14.698  -5.119
  306   2HE   LYS  44          1HE       LYS  44  -5.434 -16.319  -4.878
  307   1HZ   LYS  44          1HZ       LYS  44  -7.862 -15.708  -6.045
  308   2HZ   LYS  44          2HZ       LYS  44  -8.253 -16.337  -4.517
  309   3HZ   LYS  44          3HZ       LYS  44  -7.308 -17.247  -5.596
  310    H    LEU  45           H        LEU  45  -3.160 -10.455  -2.193
  311    HA   LEU  45           HA       LEU  45  -0.530 -11.822  -2.457
  312   1HB   LEU  45          2HB       LEU  45  -1.658  -9.072  -2.881
  313   2HB   LEU  45          1HB       LEU  45   0.080  -9.258  -2.656
  314    HG   LEU  45           HG       LEU  45  -1.573 -10.727  -4.729
  315   1HD1  LEU  45          1HD1      LEU  45   0.335  -8.379  -4.925
  316   2HD1  LEU  45          2HD1      LEU  45  -1.385  -8.378  -5.311
  317   3HD1  LEU  45          3HD1      LEU  45  -0.256  -9.287  -6.313
  318   1HD2  LEU  45          1HD2      LEU  45   0.838 -11.476  -3.581
  319   2HD2  LEU  45          2HD2      LEU  45   1.350 -10.580  -5.011
  320   3HD2  LEU  45          3HD2      LEU  45   0.276 -11.968  -5.180
  321    HA   PRO  46           HA       PRO  46   0.486 -11.048   1.732
  322   1HB   PRO  46          2HB       PRO  46   3.212 -10.980   1.524
  323   2HB   PRO  46          1HB       PRO  46   2.273 -12.478   1.389
  324   1HG   PRO  46          2HG       PRO  46   3.525 -10.837  -0.729
  325   2HG   PRO  46          1HG       PRO  46   3.305 -12.589  -0.635
  326   1HD   PRO  46          2HD       PRO  46   1.746 -10.873  -2.133
  327   2HD   PRO  46          1HD       PRO  46   1.260 -12.498  -1.618
  328    H    VAL  47           H        VAL  47   2.084  -9.453   2.988
  329    HA   VAL  47           HA       VAL  47   1.396  -6.742   2.206
  330    HB   VAL  47           HB       VAL  47   2.695  -8.244   4.430
  331   1HG1  VAL  47          1HG1      VAL  47   3.356  -5.376   3.782
  332   2HG1  VAL  47          2HG1      VAL  47   4.436  -6.666   4.305
  333   3HG1  VAL  47          3HG1      VAL  47   3.315  -5.934   5.454
  334   1HG2  VAL  47          1HG2      VAL  47   0.274  -6.951   3.940
  335   2HG2  VAL  47          2HG2      VAL  47   1.113  -5.880   5.062
  336   3HG2  VAL  47          3HG2      VAL  47   0.830  -7.565   5.497
  337    H    ASP  48           H        ASP  48   3.773  -8.843   1.134
  338    HA   ASP  48           HA       ASP  48   5.979  -6.919   0.975
  339   1HB   ASP  48          2HB       ASP  48   6.539  -9.222   1.282
  340   2HB   ASP  48          1HB       ASP  48   5.439  -9.733   0.003
  341    H    ILE  49           H        ILE  49   3.425  -8.205  -1.086
  342    HA   ILE  49           HA       ILE  49   4.446  -6.844  -3.488
  343    HB   ILE  49           HB       ILE  49   1.688  -8.005  -3.117
  344   1HG1  ILE  49          2HG1      ILE  49   3.197  -9.665  -2.125
  345   2HG1  ILE  49          1HG1      ILE  49   2.625 -10.235  -3.692
  346   1HG2  ILE  49          1HG2      ILE  49   3.675  -7.829  -5.391
  347   2HG2  ILE  49          2HG2      ILE  49   2.133  -6.985  -5.249
  348   3HG2  ILE  49          3HG2      ILE  49   2.163  -8.734  -5.486
  349   1HD1  ILE  49          1HD1      ILE  49   5.245  -8.784  -3.291
  350   2HD1  ILE  49          2HD1      ILE  49   4.678  -9.581  -4.761
  351   3HD1  ILE  49          3HD1      ILE  49   5.087 -10.540  -3.338
  352    H    LEU  50           H        LEU  50   1.960  -6.481  -1.046
  353    HA   LEU  50           HA       LEU  50   0.733  -4.139  -2.294
  354   1HB   LEU  50          2HB       LEU  50   0.535  -5.146   0.552
  355   2HB   LEU  50          1HB       LEU  50  -0.671  -4.232  -0.355
  356    HG   LEU  50           HG       LEU  50   0.251  -7.048  -1.003
  357   1HD1  LEU  50          1HD1      LEU  50  -2.405  -6.063   0.070
  358   2HD1  LEU  50          2HD1      LEU  50  -1.158  -6.846   1.044
  359   3HD1  LEU  50          3HD1      LEU  50  -1.957  -7.739  -0.253
  360   1HD2  LEU  50          1HD2      LEU  50  -0.908  -5.080  -2.655
  361   2HD2  LEU  50          2HD2      LEU  50  -2.219  -6.183  -2.236
  362   3HD2  LEU  50          3HD2      LEU  50  -0.756  -6.802  -3.002
  363    H    GLY  51           H        GLY  51   3.336  -4.832  -0.087
  364   1HA   GLY  51          2HA       GLY  51   3.461  -2.167   1.091
  365   2HA   GLY  51          1HA       GLY  51   4.736  -3.389   1.170
  366    H    ARG  52           H        ARG  52   4.520  -3.715  -1.790
  367    HA   ARG  52           HA       ARG  52   6.258  -1.410  -2.522
  368   1HB   ARG  52          2HB       ARG  52   6.174  -4.256  -2.978
  369   2HB   ARG  52          1HB       ARG  52   6.187  -3.401  -4.521
  370   1HG   ARG  52          2HG       ARG  52   8.085  -1.984  -3.503
  371   2HG   ARG  52          1HG       ARG  52   8.203  -3.259  -2.288
  372   1HD   ARG  52          2HD       ARG  52   8.043  -4.377  -4.974
  373   2HD   ARG  52          1HD       ARG  52   9.425  -3.282  -4.802
  374    HE   ARG  52           HE       ARG  52   9.565  -4.710  -2.480
  375   1HH1  ARG  52          1HH2      ARG  52   7.961  -6.703  -4.284
  376   2HH1  ARG  52          2HH2      ARG  52   9.249  -7.752  -4.776
  377   1HH2  ARG  52          2HH1      ARG  52  11.757  -5.586  -3.756
  378   2HH2  ARG  52          1HH1      ARG  52  11.399  -7.119  -4.477
  379    H    VAL  53           H        VAL  53   3.250  -3.069  -3.391
  380    HA   VAL  53           HA       VAL  53   2.882  -1.681  -5.907
  381    HB   VAL  53           HB       VAL  53   1.110  -3.173  -3.968
  382   1HG1  VAL  53          1HG1      VAL  53  -0.760  -2.379  -4.948
  383   2HG1  VAL  53          2HG1      VAL  53  -0.124  -2.783  -6.542
  384   3HG1  VAL  53          3HG1      VAL  53   0.229  -1.213  -5.828
  385   1HG2  VAL  53          1HG2      VAL  53   1.613  -3.855  -6.853
  386   2HG2  VAL  53          2HG2      VAL  53   1.303  -4.931  -5.487
  387   3HG2  VAL  53          3HG2      VAL  53   2.883  -4.166  -5.665
  388    H    TRP  54           H        TRP  54   1.898  -1.013  -2.543
  389    HA   TRP  54           HA       TRP  54   0.285   1.293  -3.161
  390   1HB   TRP  54          2HB       TRP  54   0.023   0.384  -0.988
  391   2HB   TRP  54          1HB       TRP  54   1.767   0.273  -0.730
  392    HD1  TRP  54           HD1      TRP  54   3.092   2.668  -0.535
  393    HE1  TRP  54           HE1      TRP  54   2.323   4.904   0.450
  394    HE3  TRP  54           HE3      TRP  54  -1.945   1.882  -0.420
  395    HZ2  TRP  54           HZ2      TRP  54  -0.116   6.188   1.247
  396    HZ3  TRP  54           HZ3      TRP  54  -3.474   3.636   0.476
  397    HH2  TRP  54           HH2      TRP  54  -2.564   5.769   1.295
  398    H    GLU  55           H        GLU  55   3.697   0.979  -2.067
  399    HA   GLU  55           HA       GLU  55   4.346   3.728  -2.112
  400   1HB   GLU  55          2HB       GLU  55   5.953   1.222  -2.640
  401   2HB   GLU  55          1HB       GLU  55   6.684   2.813  -2.415
  402   1HG   GLU  55          2HG       GLU  55   5.024   2.731  -0.267
  403   2HG   GLU  55          1HG       GLU  55   5.422   1.021  -0.429
  404    H    LEU  56           H        LEU  56   5.031   1.350  -4.700
  405    HA   LEU  56           HA       LEU  56   5.851   3.271  -6.646
  406   1HB   LEU  56          2HB       LEU  56   4.530   0.546  -6.897
  407   2HB   LEU  56          1HB       LEU  56   5.332   1.390  -8.223
  408    HG   LEU  56           HG       LEU  56   6.916   1.148  -5.730
  409   1HD1  LEU  56          1HD1      LEU  56   7.093  -1.117  -5.631
  410   2HD1  LEU  56          2HD1      LEU  56   7.047  -1.285  -7.388
  411   3HD1  LEU  56          3HD1      LEU  56   5.546  -1.114  -6.480
  412   1HD2  LEU  56          1HD2      LEU  56   7.276   1.480  -8.591
  413   2HD2  LEU  56          2HD2      LEU  56   8.291   0.173  -7.985
  414   3HD2  LEU  56          3HD2      LEU  56   8.423   1.789  -7.289
  415    H    SER  57           H        SER  57   2.776   2.571  -5.300
  416    HA   SER  57           HA       SER  57   1.223   3.678  -7.580
  417   1HB   SER  57          2HB       SER  57   0.392   1.711  -6.440
  418   2HB   SER  57          1HB       SER  57   0.555   2.500  -4.873
  419    HG   SER  57           HG       SER  57  -0.958   4.099  -5.757
  420    H    ASP  58           H        ASP  58   2.133   4.409  -4.232
  421    HA   ASP  58           HA       ASP  58   0.531   6.808  -3.989
  422   1HB   ASP  58          2HB       ASP  58   2.299   5.136  -2.437
  423   2HB   ASP  58          1HB       ASP  58   2.678   6.839  -2.169
  424    H    ILE  59           H        ILE  59   1.152   8.128  -5.855
  425    HA   ILE  59           HA       ILE  59   3.836   8.849  -6.520
  426    HB   ILE  59           HB       ILE  59   1.310  10.521  -6.732
  427   1HG1  ILE  59          2HG1      ILE  59   0.731   8.404  -7.663
  428   2HG1  ILE  59          1HG1      ILE  59   1.200   9.397  -9.041
  429   1HG2  ILE  59          1HG2      ILE  59   2.567  11.916  -7.968
  430   2HG2  ILE  59          2HG2      ILE  59   3.116  10.584  -8.986
  431   3HG2  ILE  59          3HG2      ILE  59   3.987  10.978  -7.503
  432   1HD1  ILE  59          1HD1      ILE  59   2.295   7.285  -9.326
  433   2HD1  ILE  59          2HD1      ILE  59   2.849   7.274  -7.651
  434   3HD1  ILE  59          3HD1      ILE  59   3.537   8.423  -8.799
  435    H    ASP  60           H        ASP  60   1.568  10.071  -4.103
  436    HA   ASP  60           HA       ASP  60   3.514  12.181  -3.282
  437   1HB   ASP  60          2HB       ASP  60   0.862  11.843  -1.961
  438   2HB   ASP  60          1HB       ASP  60   1.670  13.318  -2.482
  439    H    HIS  61           H        HIS  61   2.486   9.033  -2.479
  440    HA   HIS  61           HA       HIS  61   2.706   7.712  -0.528
  441   1HB   HIS  61          2HB       HIS  61   5.019   7.691   0.176
  442   2HB   HIS  61          1HB       HIS  61   4.990   8.052  -1.548
  443    HD1  HIS  61           HD1      HIS  61   5.482   9.720   1.810
  444    HD2  HIS  61           HD2      HIS  61   5.984  10.586  -2.237
  445    HE1  HIS  61           HE1      HIS  61   6.742  11.914   1.698
  446    H    ASP  62           H        ASP  62   1.146  10.056  -0.025
  447    HA   ASP  62           HA       ASP  62   2.113  11.156   2.550
  448   1HB   ASP  62          2HB       ASP  62   0.206  12.632   2.288
  449   2HB   ASP  62          1HB       ASP  62   0.972  12.481   0.706
  450    H    GLY  63           H        GLY  63   0.644   8.356   1.563
  451   1HA   GLY  63          2HA       GLY  63  -0.092   6.699   3.182
  452   2HA   GLY  63          1HA       GLY  63  -0.668   8.011   4.209
  453    H    MET  64           H        MET  64  -1.343   8.307   0.829
  454    HA   MET  64           HA       MET  64  -4.035   7.076   1.116
  455   1HB   MET  64          2HB       MET  64  -3.603   9.967   0.275
  456   2HB   MET  64          1HB       MET  64  -5.150   9.147   0.415
  457   1HG   MET  64          2HG       MET  64  -3.615   9.010   2.890
  458   2HG   MET  64          1HG       MET  64  -3.912  10.663   2.385
  459   1HE   MET  64          1HE       MET  64  -7.701  10.793   1.899
  460   2HE   MET  64          2HE       MET  64  -6.951   9.704   0.735
  461   3HE   MET  64          3HE       MET  64  -6.123  11.189   1.201
  462    H    LEU  65           H        LEU  65  -5.124   6.910  -1.029
  463    HA   LEU  65           HA       LEU  65  -3.177   7.032  -3.312
  464   1HB   LEU  65          2HB       LEU  65  -5.201   5.017  -2.386
  465   2HB   LEU  65          1HB       LEU  65  -4.839   5.124  -4.108
  466    HG   LEU  65           HG       LEU  65  -2.861   4.608  -1.870
  467   1HD1  LEU  65          1HD1      LEU  65  -3.250   2.848  -4.255
  468   2HD1  LEU  65          2HD1      LEU  65  -4.479   2.803  -2.991
  469   3HD1  LEU  65          3HD1      LEU  65  -2.801   2.416  -2.605
  470   1HD2  LEU  65          1HD2      LEU  65  -1.304   4.293  -3.926
  471   2HD2  LEU  65          2HD2      LEU  65  -1.661   5.942  -3.412
  472   3HD2  LEU  65          3HD2      LEU  65  -2.501   5.249  -4.799
  473    H    ASP  66           H        ASP  66  -3.822   8.804  -4.539
  474    HA   ASP  66           HA       ASP  66  -6.517   9.833  -4.604
  475   1HB   ASP  66          2HB       ASP  66  -4.275  10.990  -5.074
  476   2HB   ASP  66          1HB       ASP  66  -4.352  10.238  -6.666
  477    H    ARG  67           H        ARG  67  -7.721  10.032  -6.747
  478    HA   ARG  67           HA       ARG  67  -8.567   7.544  -7.742
  479   1HB   ARG  67          2HB       ARG  67  -9.755   8.841  -9.332
  480   2HB   ARG  67          1HB       ARG  67  -9.506   9.956  -7.991
  481   1HG   ARG  67          2HG       ARG  67  -7.457  10.812  -9.154
  482   2HG   ARG  67          1HG       ARG  67  -7.862   9.788 -10.532
  483   1HD   ARG  67          2HD       ARG  67  -9.582  12.025  -9.398
  484   2HD   ARG  67          1HD       ARG  67  -8.744  12.025 -10.962
  485    HE   ARG  67           HE       ARG  67 -10.168   9.896 -11.420
  486   1HH1  ARG  67          1HH2      ARG  67 -11.352  12.878 -11.233
  487   2HH1  ARG  67          2HH2      ARG  67 -12.931  12.482 -10.641
  488   1HH2  ARG  67          2HH1      ARG  67 -12.104   9.207  -9.854
  489   2HH2  ARG  67          1HH1      ARG  67 -13.357  10.404  -9.859
  490    H    ASP  68           H        ASP  68  -6.002   9.671  -8.976
  491    HA   ASP  68           HA       ASP  68  -5.342   7.875 -11.206
  492   1HB   ASP  68          2HB       ASP  68  -5.033  10.260 -11.457
  493   2HB   ASP  68          1HB       ASP  68  -4.089  10.346  -9.970
  494    H    GLU  69           H        GLU  69  -4.295   8.463  -7.919
  495    HA   GLU  69           HA       GLU  69  -1.809   6.957  -8.069
  496   1HB   GLU  69          2HB       GLU  69  -2.896   8.772  -6.383
  497   2HB   GLU  69          1HB       GLU  69  -3.335   7.292  -5.528
  498   1HG   GLU  69          2HG       GLU  69  -1.103   6.646  -5.234
  499   2HG   GLU  69          1HG       GLU  69  -0.532   7.695  -6.531
  500    H    PHE  70           H        PHE  70  -5.103   6.315  -6.887
  501    HA   PHE  70           HA       PHE  70  -4.680   3.635  -5.995
  502   1HB   PHE  70          2HB       PHE  70  -6.614   5.246  -5.571
  503   2HB   PHE  70          1HB       PHE  70  -7.192   4.847  -7.189
  504    HD1  PHE  70           HD1      PHE  70  -6.531   3.518  -3.801
  505    HD2  PHE  70           HD2      PHE  70  -8.168   2.695  -7.684
  506    HE1  PHE  70           HE1      PHE  70  -7.602   1.465  -2.913
  507    HE2  PHE  70           HE2      PHE  70  -9.236   0.642  -6.798
  508    HZ   PHE  70           HZ       PHE  70  -8.951   0.028  -4.413
  509    H    ALA  71           H        ALA  71  -4.893   5.040  -9.147
  510    HA   ALA  71           HA       ALA  71  -5.781   2.664 -10.585
  511   1HB   ALA  71          1HB       ALA  71  -4.095   4.874 -11.742
  512   2HB   ALA  71          2HB       ALA  71  -5.729   5.241 -11.181
  513   3HB   ALA  71          3HB       ALA  71  -5.482   4.051 -12.457
  514    H    VAL  72           H        VAL  72  -2.662   4.276 -10.098
  515    HA   VAL  72           HA       VAL  72  -0.960   2.502 -11.470
  516    HB   VAL  72           HB       VAL  72  -0.487   3.994  -8.871
  517   1HG1  VAL  72          1HG1      VAL  72   1.294   2.901 -11.035
  518   2HG1  VAL  72          2HG1      VAL  72   1.456   2.748  -9.288
  519   3HG1  VAL  72          3HG1      VAL  72   1.809   4.287 -10.073
  520   1HG2  VAL  72          1HG2      VAL  72  -1.260   5.732 -10.154
  521   2HG2  VAL  72          2HG2      VAL  72  -0.935   4.897 -11.671
  522   3HG2  VAL  72          3HG2      VAL  72   0.383   5.681 -10.795
  523    H    ALA  73           H        ALA  73  -2.439   2.245  -8.282
  524    HA   ALA  73           HA       ALA  73  -0.821  -0.119  -7.562
  525   1HB   ALA  73          1HB       ALA  73  -2.819   0.252  -5.678
  526   2HB   ALA  73          2HB       ALA  73  -2.559   1.876  -6.319
  527   3HB   ALA  73          3HB       ALA  73  -1.210   0.976  -5.626
  528    H    MET  74           H        MET  74  -3.631   0.344  -9.402
  529    HA   MET  74           HA       MET  74  -5.044  -2.065  -8.436
  530   1HB   MET  74          2HB       MET  74  -5.425  -0.086 -10.702
  531   2HB   MET  74          1HB       MET  74  -6.505  -1.457 -10.442
  532   1HG   MET  74          2HG       MET  74  -5.930   0.193  -8.051
  533   2HG   MET  74          1HG       MET  74  -6.897   0.974  -9.304
  534   1HE   MET  74          1HE       MET  74  -6.283  -1.237  -6.748
  535   2HE   MET  74          2HE       MET  74  -7.362  -2.629  -6.820
  536   3HE   MET  74          3HE       MET  74  -7.874  -1.167  -5.980
  537    H    PHE  75           H        PHE  75  -3.213  -1.086 -11.335
  538    HA   PHE  75           HA       PHE  75  -3.400  -3.779 -12.473
  539   1HB   PHE  75          2HB       PHE  75  -2.364  -2.787 -14.326
  540   2HB   PHE  75          1HB       PHE  75  -3.163  -1.399 -13.590
  541    HD1  PHE  75           HD1      PHE  75  -0.005  -2.878 -14.533
  542    HD2  PHE  75           HD2      PHE  75  -1.832   0.100 -12.038
  543    HE1  PHE  75           HE1      PHE  75   2.187  -1.750 -14.277
  544    HE2  PHE  75           HE2      PHE  75   0.355   1.228 -11.782
  545    HZ   PHE  75           HZ       PHE  75   2.370   0.306 -12.899
  546    H    LEU  76           H        LEU  76  -1.333  -2.006 -10.324
  547    HA   LEU  76           HA       LEU  76   1.024  -3.694 -10.560
  548   1HB   LEU  76          2HB       LEU  76  -0.003  -1.443  -8.960
  549   2HB   LEU  76          1HB       LEU  76   1.049  -2.533  -8.054
  550    HG   LEU  76           HG       LEU  76   1.774  -1.392 -10.763
  551   1HD1  LEU  76          1HD1      LEU  76   2.010  -0.274  -8.017
  552   2HD1  LEU  76          2HD1      LEU  76   1.902   0.561  -9.568
  553   3HD1  LEU  76          3HD1      LEU  76   3.436  -0.134  -9.046
  554   1HD2  LEU  76          1HD2      LEU  76   2.959  -3.315  -8.890
  555   2HD2  LEU  76          2HD2      LEU  76   4.066  -2.009  -9.313
  556   3HD2  LEU  76          3HD2      LEU  76   3.356  -3.010 -10.580
  557    H    VAL  77           H        VAL  77  -2.021  -3.800  -8.872
  558    HA   VAL  77           HA       VAL  77  -1.156  -5.985  -7.073
  559    HB   VAL  77           HB       VAL  77  -3.717  -4.409  -7.546
  560   1HG1  VAL  77          1HG1      VAL  77  -4.923  -5.896  -6.319
  561   2HG1  VAL  77          2HG1      VAL  77  -3.622  -6.084  -5.146
  562   3HG1  VAL  77          3HG1      VAL  77  -3.619  -7.046  -6.621
  563   1HG2  VAL  77          1HG2      VAL  77  -1.822  -4.637  -5.181
  564   2HG2  VAL  77          2HG2      VAL  77  -3.256  -3.613  -5.257
  565   3HG2  VAL  77          3HG2      VAL  77  -1.885  -3.292  -6.315
  566    H    TYR  78           H        TYR  78  -3.401  -5.431  -9.782
  567    HA   TYR  78           HA       TYR  78  -4.294  -8.162  -9.970
  568   1HB   TYR  78          2HB       TYR  78  -4.510  -5.603 -11.402
  569   2HB   TYR  78          1HB       TYR  78  -4.625  -7.015 -12.454
  570    HD1  TYR  78           HD1      TYR  78  -6.496  -4.834 -10.482
  571    HD2  TYR  78           HD2      TYR  78  -6.067  -9.021 -11.349
  572    HE1  TYR  78           HE1      TYR  78  -8.812  -5.229  -9.698
  573    HE2  TYR  78           HE2      TYR  78  -8.392  -9.417 -10.567
  574    HH   TYR  78           HH       TYR  78 -10.476  -6.712  -9.558
  575    H    CYS  79           H        CYS  79  -1.517  -6.427 -11.277
  576    HA   CYS  79           HA       CYS  79  -0.882  -8.488 -13.253
  577   1HB   CYS  79          2HB       CYS  79  -0.281  -6.106 -13.522
  578   2HB   CYS  79          1HB       CYS  79   0.714  -6.188 -12.068
  579    HG   CYS  79           HG       CYS  79   1.669  -8.312 -13.939
  580    H    ALA  80           H        ALA  80  -0.449  -8.080  -9.867
  581    HA   ALA  80           HA       ALA  80   1.915  -9.845  -9.768
  582   1HB   ALA  80          1HB       ALA  80   1.456  -9.441  -7.237
  583   2HB   ALA  80          2HB       ALA  80   0.275  -8.258  -7.801
  584   3HB   ALA  80          3HB       ALA  80   1.981  -8.067  -8.211
  585    H    LEU  81           H        LEU  81  -1.443 -10.128  -9.901
  586    HA   LEU  81           HA       LEU  81  -1.624 -12.586  -8.264
  587   1HB   LEU  81          2HB       LEU  81  -3.746 -11.483 -10.093
  588   2HB   LEU  81          1HB       LEU  81  -3.948 -12.298  -8.544
  589    HG   LEU  81           HG       LEU  81  -3.195  -9.459  -9.119
  590   1HD1  LEU  81          1HD1      LEU  81  -4.928  -8.968  -7.586
  591   2HD1  LEU  81          2HD1      LEU  81  -4.883 -10.588  -6.890
  592   3HD1  LEU  81          3HD1      LEU  81  -5.535 -10.340  -8.511
  593   1HD2  LEU  81          1HD2      LEU  81  -1.449  -9.722  -7.651
  594   2HD2  LEU  81          2HD2      LEU  81  -2.135 -11.181  -6.940
  595   3HD2  LEU  81          3HD2      LEU  81  -2.736  -9.596  -6.450
  596    H    GLU  82           H        GLU  82  -1.605 -11.543 -11.627
  597    HA   GLU  82           HA       GLU  82  -2.292 -14.091 -12.782
  598   1HB   GLU  82          2HB       GLU  82  -1.088 -11.486 -13.626
  599   2HB   GLU  82          1HB       GLU  82  -0.920 -12.858 -14.721
  600   1HG   GLU  82          2HG       GLU  82  -2.957 -12.066 -15.449
  601   2HG   GLU  82          1HG       GLU  82  -3.521 -13.132 -14.162
  602    H    LYS  83           H        LYS  83   0.860 -12.413 -12.627
  603    HA   LYS  83           HA       LYS  83   2.352 -14.640 -11.644
  604   1HB   LYS  83          2HB       LYS  83   1.365 -15.279 -14.039
  605   2HB   LYS  83          1HB       LYS  83   2.804 -14.423 -14.582
  606   1HG   LYS  83          2HG       LYS  83   3.625 -16.592 -14.346
  607   2HG   LYS  83          1HG       LYS  83   4.017 -15.897 -12.774
  608   1HD   LYS  83          2HD       LYS  83   1.341 -16.874 -12.645
  609   2HD   LYS  83          1HD       LYS  83   2.345 -18.146 -13.341
  610   1HE   LYS  83          2HE       LYS  83   3.239 -18.586 -11.309
  611   2HE   LYS  83          1HE       LYS  83   3.749 -16.894 -11.142
  612   1HZ   LYS  83          1HZ       LYS  83   2.162 -17.297  -9.442
  613   2HZ   LYS  83          2HZ       LYS  83   1.086 -18.049 -10.521
  614   3HZ   LYS  83          3HZ       LYS  83   1.371 -16.377 -10.627
  615    H    GLU  84           H        GLU  84   3.015 -12.288 -10.785
  616    HA   GLU  84           HA       GLU  84   5.619 -11.707 -11.925
  617   1HB   GLU  84          2HB       GLU  84   3.291 -10.495 -13.077
  618   2HB   GLU  84          1HB       GLU  84   4.255  -9.237 -12.300
  619   1HG   GLU  84          2HG       GLU  84   6.079  -9.585 -13.678
  620   2HG   GLU  84          1HG       GLU  84   5.683 -11.282 -13.949
  621    HA   PRO  85           HA       PRO  85   5.779 -10.032  -7.829
  622   1HB   PRO  85          2HB       PRO  85   8.404  -9.285  -7.878
  623   2HB   PRO  85          1HB       PRO  85   7.891 -10.975  -7.711
  624   1HG   PRO  85          2HG       PRO  85   8.943  -9.545 -10.084
  625   2HG   PRO  85          1HG       PRO  85   9.159 -11.231  -9.590
  626   1HD   PRO  85          2HD       PRO  85   7.410 -10.358 -11.553
  627   2HD   PRO  85          1HD       PRO  85   7.292 -11.910 -10.695
  628    H    VAL  86           H        VAL  86   7.090  -7.845  -6.996
  629    HA   VAL  86           HA       VAL  86   6.398  -5.639  -8.912
  630    HB   VAL  86           HB       VAL  86   5.745  -6.021  -5.978
  631   1HG1  VAL  86          1HG1      VAL  86   4.923  -3.719  -5.961
  632   2HG1  VAL  86          2HG1      VAL  86   5.416  -3.504  -7.640
  633   3HG1  VAL  86          3HG1      VAL  86   6.635  -3.725  -6.384
  634   1HG2  VAL  86          1HG2      VAL  86   3.699  -5.010  -7.809
  635   2HG2  VAL  86          2HG2      VAL  86   3.634  -6.391  -6.714
  636   3HG2  VAL  86          3HG2      VAL  86   4.342  -6.571  -8.320
  637    HA   PRO  87           HA       PRO  87  10.520  -4.499  -7.682
  638   1HB   PRO  87          2HB       PRO  87  10.753  -2.338  -9.333
  639   2HB   PRO  87          1HB       PRO  87  10.875  -4.008  -9.921
  640   1HG   PRO  87          2HG       PRO  87   8.673  -2.071 -10.203
  641   2HG   PRO  87          1HG       PRO  87   9.129  -3.426 -11.242
  642   1HD   PRO  87          2HD       PRO  87   7.026  -3.368  -9.373
  643   2HD   PRO  87          1HD       PRO  87   7.651  -4.798 -10.223
  644    H    MET  88           H        MET  88  11.426  -1.945  -7.403
  645    HA   MET  88           HA       MET  88   9.455  -0.679  -5.516
  646   1HB   MET  88          2HB       MET  88  12.441  -0.381  -5.389
  647   2HB   MET  88          1HB       MET  88  11.264  -0.185  -4.096
  648   1HG   MET  88          2HG       MET  88  11.161  -2.885  -5.174
  649   2HG   MET  88          1HG       MET  88  12.790  -2.485  -4.641
  650   1HE   MET  88          1HE       MET  88  13.610  -2.764  -2.703
  651   2HE   MET  88          2HE       MET  88  12.748  -4.283  -2.481
  652   3HE   MET  88          3HE       MET  88  12.830  -3.122  -1.158
  653    H    SER  89           H        SER  89  10.463  -0.266  -8.525
  654    HA   SER  89           HA       SER  89  11.075   2.643  -8.166
  655   1HB   SER  89          2HB       SER  89  11.674   0.800 -10.484
  656   2HB   SER  89          1HB       SER  89  12.233   2.458 -10.290
  657    HG   SER  89           HG       SER  89  13.866   1.167  -9.565
  658    H    LEU  90           H        LEU  90   9.015   3.463  -8.222
  659    HA   LEU  90           HA       LEU  90   6.917   2.660  -9.982
  660   1HB   LEU  90          2HB       LEU  90   5.982   4.078  -8.481
  661   2HB   LEU  90          1HB       LEU  90   7.559   4.723  -8.042
  662    HG   LEU  90           HG       LEU  90   7.462   6.267  -9.950
  663   1HD1  LEU  90          1HD1      LEU  90   5.841   6.176 -11.574
  664   2HD1  LEU  90          2HD1      LEU  90   4.582   5.719 -10.425
  665   3HD1  LEU  90          3HD1      LEU  90   5.698   4.500 -11.042
  666   1HD2  LEU  90          1HD2      LEU  90   6.233   6.570  -7.596
  667   2HD2  LEU  90          2HD2      LEU  90   4.806   6.630  -8.632
  668   3HD2  LEU  90          3HD2      LEU  90   6.113   7.793  -8.861
  669    HA   PRO  91           HA       PRO  91   9.170   3.967 -13.640
  670   1HB   PRO  91          2HB       PRO  91   7.319   2.977 -15.410
  671   2HB   PRO  91          1HB       PRO  91   8.554   1.979 -14.616
  672   1HG   PRO  91          2HG       PRO  91   5.683   2.359 -13.893
  673   2HG   PRO  91          1HG       PRO  91   6.646   0.873 -13.930
  674   1HD   PRO  91          2HD       PRO  91   6.105   2.156 -11.627
  675   2HD   PRO  91          1HD       PRO  91   7.652   1.312 -11.889
  676    HA   PRO  92           HA       PRO  92   7.107   7.727 -14.546
  677   1HB   PRO  92          2HB       PRO  92   8.420   8.373 -16.849
  678   2HB   PRO  92          1HB       PRO  92   9.173   8.478 -15.246
  679   1HG   PRO  92          2HG       PRO  92   9.485   6.412 -17.353
  680   2HG   PRO  92          1HG       PRO  92  10.673   7.043 -16.205
  681   1HD   PRO  92          2HD       PRO  92   9.369   4.630 -15.947
  682   2HD   PRO  92          1HD       PRO  92  10.105   5.530 -14.605
  683    H    ALA  93           H        ALA  93   6.858   4.975 -16.557
  684    HA   ALA  93           HA       ALA  93   5.194   6.228 -18.641
  685   1HB   ALA  93          1HB       ALA  93   6.537   3.702 -18.075
  686   2HB   ALA  93          2HB       ALA  93   6.026   4.357 -19.632
  687   3HB   ALA  93          3HB       ALA  93   4.893   3.429 -18.649
  688    H    LEU  94           H        LEU  94   4.861   4.784 -15.547
  689    HA   LEU  94           HA       LEU  94   1.913   4.475 -15.813
  690   1HB   LEU  94          2HB       LEU  94   2.855   2.521 -14.958
  691   2HB   LEU  94          1HB       LEU  94   4.182   3.381 -14.197
  692    HG   LEU  94           HG       LEU  94   2.521   2.336 -12.612
  693   1HD1  LEU  94          1HD1      LEU  94   2.243   5.096 -11.832
  694   2HD1  LEU  94          2HD1      LEU  94   3.837   4.830 -12.546
  695   3HD1  LEU  94          3HD1      LEU  94   3.309   3.856 -11.170
  696   1HD2  LEU  94          1HD2      LEU  94   0.591   4.420 -12.627
  697   2HD2  LEU  94          2HD2      LEU  94   0.336   2.708 -12.962
  698   3HD2  LEU  94          3HD2      LEU  94   0.717   3.816 -14.279
  699    H    VAL  95           H        VAL  95   4.240   6.712 -14.844
  700    HA   VAL  95           HA       VAL  95   2.713   7.793 -12.551
  701    HB   VAL  95           HB       VAL  95   5.399   7.592 -13.341
  702   1HG1  VAL  95          1HG1      VAL  95   5.243   9.602 -14.709
  703   2HG1  VAL  95          2HG1      VAL  95   6.169   9.969 -13.254
  704   3HG1  VAL  95          3HG1      VAL  95   4.487  10.484 -13.383
  705   1HG2  VAL  95          1HG2      VAL  95   4.642   9.519 -11.194
  706   2HG2  VAL  95          2HG2      VAL  95   5.785   8.177 -11.150
  707   3HG2  VAL  95          3HG2      VAL  95   4.053   7.864 -11.044
  708    HA   PRO  96           HA       PRO  96   0.641  10.798 -15.036
  709   1HB   PRO  96          2HB       PRO  96  -0.098  12.498 -13.024
  710   2HB   PRO  96          1HB       PRO  96  -0.884  10.931 -13.298
  711   1HG   PRO  96          2HG       PRO  96   1.137  11.708 -11.269
  712   2HG   PRO  96          1HG       PRO  96  -0.224  10.586 -11.138
  713   1HD   PRO  96          2HD       PRO  96   2.399   9.825 -11.477
  714   2HD   PRO  96          1HD       PRO  96   0.995   8.827 -11.912
  715    HA   PRO  97           HA       PRO  97   3.335  14.226 -15.641
  716   1HB   PRO  97          2HB       PRO  97   1.651  16.358 -15.975
  717   2HB   PRO  97          1HB       PRO  97   1.835  15.075 -17.188
  718   1HG   PRO  97          2HG       PRO  97  -0.313  15.477 -15.172
  719   2HG   PRO  97          1HG       PRO  97  -0.427  14.906 -16.843
  720   1HD   PRO  97          2HD       PRO  97  -0.522  13.256 -14.670
  721   2HD   PRO  97          1HD       PRO  97   0.049  12.745 -16.272
  722    H    SER  98           H        SER  98   1.272  14.205 -12.904
  723    HA   SER  98           HA       SER  98   2.156  16.730 -11.737
  724   1HB   SER  98          2HB       SER  98   0.802  14.252 -10.622
  725   2HB   SER  98          1HB       SER  98   1.001  15.755  -9.728
  726    HG   SER  98           HG       SER  98  -0.675  15.125 -11.852
  727    H    LYS  99           H        LYS  99   3.391  13.512 -11.953
  728    HA   LYS  99           HA       LYS  99   5.200  13.814  -9.636
  729   1HB   LYS  99          2HB       LYS  99   3.946  11.713 -10.857
  730   2HB   LYS  99          1HB       LYS  99   5.542  11.621 -11.604
  731   1HG   LYS  99          2HG       LYS  99   5.432  12.045  -8.654
  732   2HG   LYS  99          1HG       LYS  99   5.018  10.439  -9.260
  733   1HD   LYS  99          2HD       LYS  99   7.166  10.486 -10.592
  734   2HD   LYS  99          1HD       LYS  99   7.590  11.967  -9.733
  735   1HE   LYS  99          2HE       LYS  99   6.773  10.122  -7.743
  736   2HE   LYS  99          1HE       LYS  99   7.867   9.242  -8.830
  737   1HZ   LYS  99          1HZ       LYS  99   9.012  10.568  -7.060
  738   2HZ   LYS  99          2HZ       LYS  99   8.424  11.974  -7.811
  739   3HZ   LYS  99          3HZ       LYS  99   9.489  10.945  -8.644
  740    H    ARG 100           H        ARG 100   5.150  15.049 -12.705
  741    HA   ARG 100           HA       ARG 100   8.131  15.210 -12.768
  742   1HB   ARG 100          2HB       ARG 100   7.967  14.750 -15.248
  743   2HB   ARG 100          1HB       ARG 100   7.519  13.382 -14.233
  744   1HG   ARG 100          2HG       ARG 100   5.225  13.655 -14.650
  745   2HG   ARG 100          1HG       ARG 100   5.425  15.325 -15.183
  746   1HD   ARG 100          2HD       ARG 100   5.146  14.181 -17.227
  747   2HD   ARG 100          1HD       ARG 100   6.915  14.234 -17.076
  748    HE   ARG 100           HE       ARG 100   6.222  11.942 -15.693
  749   1HH1  ARG 100          1HH2      ARG 100   4.205  12.647 -18.185
  750   2HH1  ARG 100          2HH2      ARG 100   4.682  11.343 -19.219
  751   1HH2  ARG 100          2HH1      ARG 100   7.444  10.482 -17.307
  752   2HH2  ARG 100          1HH1      ARG 100   6.515  10.118 -18.723
  753    H    SER 107           1H       SER 107   3.330   7.162   9.732
  754    HA   SER 107           HA       SER 107   3.991   5.467   8.389
  755   1HB   SER 107          2HB       SER 107   2.351   3.765   8.647
  756   2HB   SER 107          1HB       SER 107   1.977   4.922   9.921
  757    HG   SER 107           HG       SER 107   0.071   4.854   9.001
  758    H    THR 108           H        THR 108   4.631   5.954   6.292
  759    HA   THR 108           HA       THR 108   2.968   7.018   4.228
  760    HB   THR 108           HB       THR 108   4.864   6.238   2.787
  761    HG1  THR 108           HG1      THR 108   6.202   4.779   3.511
  762   1HG2  THR 108          1HG2      THR 108   4.887   8.242   4.532
  763   2HG2  THR 108          2HG2      THR 108   6.341   7.799   3.637
  764   3HG2  THR 108          3HG2      THR 108   6.127   7.250   5.299
  765    H    ASN 109           H        ASN 109   4.358   3.743   4.241
  766    HA   ASN 109           HA       ASN 109   2.045   2.764   2.665
  767   1HB   ASN 109          2HB       ASN 109   4.387   2.317   1.991
  768   2HB   ASN 109          1HB       ASN 109   4.660   1.489   3.523
  769   1HD2  ASN 109          1HD2      ASN 109   3.592   1.050   0.299
  770   2HD2  ASN 109          2HD2      ASN 109   2.938  -0.505   0.481
  771    HA   PRO 110           HA       PRO 110   0.294   1.094   6.386
  772   1HB   PRO 110          2HB       PRO 110  -1.737  -0.298   5.194
  773   2HB   PRO 110          1HB       PRO 110  -1.764   1.465   5.405
  774   1HG   PRO 110          2HG       PRO 110  -1.142  -0.140   2.983
  775   2HG   PRO 110          1HG       PRO 110  -2.007   1.398   3.130
  776   1HD   PRO 110          2HD       PRO 110   0.599   1.173   2.309
  777   2HD   PRO 110          1HD       PRO 110  -0.087   2.628   3.065
  778    H    PHE 111           H        PHE 111   1.347  -0.849   3.639
  779    HA   PHE 111           HA       PHE 111   1.105  -3.403   5.069
  780   1HB   PHE 111          2HB       PHE 111   2.541  -2.634   2.509
  781   2HB   PHE 111          1HB       PHE 111   2.124  -4.271   3.004
  782    HD1  PHE 111           HD1      PHE 111   0.815  -1.052   1.787
  783    HD2  PHE 111           HD2      PHE 111  -0.172  -5.066   2.952
  784    HE1  PHE 111           HE1      PHE 111  -1.436  -0.790   0.783
  785    HE2  PHE 111           HE2      PHE 111  -2.423  -4.804   1.947
  786    HZ   PHE 111           HZ       PHE 111  -3.055  -2.666   0.867
  787    H    LEU 112           HN       LEU 112   3.817  -1.301   4.020
  788    HA   LEU 112           HA       LEU 112   6.000  -2.799   4.922
  789   1HB   LEU 112          2HB       LEU 112   5.330  -0.057   4.280
  790   2HB   LEU 112          1HB       LEU 112   6.495  -0.105   5.602
  791    HG   LEU 112           HG       LEU 112   7.675  -0.082   3.452
  792   1HD1  LEU 112          1HD1      LEU 112   8.350  -1.587   5.489
  793   2HD1  LEU 112          2HD1      LEU 112   9.173  -1.812   3.944
  794   3HD1  LEU 112          3HD1      LEU 112   7.888  -2.918   4.429
  795   1HD2  LEU 112          1HD2      LEU 112   5.538  -1.533   2.527
  796   2HD2  LEU 112          2HD2      LEU 112   6.773  -2.784   2.675
  797   3HD2  LEU 112          3HD2      LEU 112   7.070  -1.366   1.669
  Start of MODEL   19
    1    HA   PRO   6           HA       PRO   6   1.494   5.919 -23.608
    2   1HB   PRO   6          2HB       PRO   6  -0.775   4.539 -22.963
    3   2HB   PRO   6          1HB       PRO   6  -0.422   5.098 -24.611
    4   1HG   PRO   6          2HG       PRO   6  -0.199   2.385 -23.445
    5   2HG   PRO   6          1HG       PRO   6  -0.614   2.879 -25.091
    6   1HD   PRO   6          2HD       PRO   6   1.857   1.917 -24.286
    7   2HD   PRO   6          1HD       PRO   6   1.550   2.849 -25.766
    8    H    TRP   7           H        TRP   7  -0.096   5.774 -21.426
    9    HA   TRP   7           HA       TRP   7   1.579   5.576 -19.182
   10   1HB   TRP   7          2HB       TRP   7  -0.614   6.694 -19.274
   11   2HB   TRP   7          1HB       TRP   7  -1.420   5.137 -19.465
   12    HD1  TRP   7           HD1      TRP   7   1.471   5.118 -17.122
   13    HE1  TRP   7           HE1      TRP   7   0.636   4.966 -14.681
   14    HE3  TRP   7           HE3      TRP   7  -3.503   5.978 -17.847
   15    HZ2  TRP   7           HZ2      TRP   7  -1.823   5.188 -13.237
   16    HZ3  TRP   7           HZ3      TRP   7  -5.070   6.009 -15.927
   17    HH2  TRP   7           HH2      TRP   7  -4.238   5.615 -13.625
   18    H    ALA   8           H        ALA   8   2.401   3.818 -18.078
   19    HA   ALA   8           HA       ALA   8   2.428   1.186 -18.885
   20   1HB   ALA   8          1HB       ALA   8   2.289   2.322 -16.077
   21   2HB   ALA   8          2HB       ALA   8   3.751   2.078 -17.042
   22   3HB   ALA   8          3HB       ALA   8   2.833   0.687 -16.456
   23    H    VAL   9           H        VAL   9  -0.222   2.847 -17.299
   24    HA   VAL   9           HA       VAL   9  -1.711   0.304 -16.889
   25    HB   VAL   9           HB       VAL   9  -2.123   3.216 -16.157
   26   1HG1  VAL   9          1HG1      VAL   9  -4.337   2.452 -16.556
   27   2HG1  VAL   9          2HG1      VAL   9  -4.103   2.250 -14.819
   28   3HG1  VAL   9          3HG1      VAL   9  -3.991   0.855 -15.894
   29   1HG2  VAL   9          1HG2      VAL   9  -1.647   0.680 -14.559
   30   2HG2  VAL   9          2HG2      VAL   9  -1.987   2.257 -13.847
   31   3HG2  VAL   9          3HG2      VAL   9  -0.510   2.012 -14.778
   32    H    LYS  10           H        LYS  10  -3.845   0.033 -17.891
   33    HA   LYS  10           HA       LYS  10  -3.992   1.263 -20.578
   34   1HB   LYS  10          2HB       LYS  10  -4.945  -1.126 -19.145
   35   2HB   LYS  10          1HB       LYS  10  -6.142  -0.445 -20.248
   36   1HG   LYS  10          2HG       LYS  10  -4.303  -0.386 -22.009
   37   2HG   LYS  10          1HG       LYS  10  -3.334  -1.362 -20.906
   38   1HD   LYS  10          2HD       LYS  10  -5.648  -2.773 -20.865
   39   2HD   LYS  10          1HD       LYS  10  -5.718  -2.118 -22.500
   40   1HE   LYS  10          2HE       LYS  10  -3.037  -3.056 -21.932
   41   2HE   LYS  10          1HE       LYS  10  -4.220  -4.352 -21.662
   42   1HZ   LYS  10          1HZ       LYS  10  -3.367  -3.810 -24.070
   43   2HZ   LYS  10          2HZ       LYS  10  -4.563  -2.605 -23.992
   44   3HZ   LYS  10          3HZ       LYS  10  -4.985  -4.239 -23.797
   45    HA   PRO  11           HA       PRO  11  -7.213   4.090 -19.633
   46   1HB   PRO  11          2HB       PRO  11  -8.878   3.803 -21.790
   47   2HB   PRO  11          1HB       PRO  11  -7.312   4.633 -21.886
   48   1HG   PRO  11          2HG       PRO  11  -8.040   1.857 -22.689
   49   2HG   PRO  11          1HG       PRO  11  -6.981   3.024 -23.498
   50   1HD   PRO  11          2HD       PRO  11  -6.031   0.966 -22.011
   51   2HD   PRO  11          1HD       PRO  11  -5.181   2.521 -22.160
   52    H    GLU  12           H        GLU  12  -8.095   0.819 -20.513
   53    HA   GLU  12           HA       GLU  12 -10.784   0.999 -19.311
   54   1HB   GLU  12          2HB       GLU  12  -9.406  -1.549 -20.115
   55   2HB   GLU  12          1HB       GLU  12 -11.096  -1.089 -20.321
   56   1HG   GLU  12          2HG       GLU  12 -10.021   0.791 -21.874
   57   2HG   GLU  12          1HG       GLU  12  -8.723  -0.396 -21.999
   58    H    ASP  13           H        ASP  13  -7.565   0.203 -18.364
   59    HA   ASP  13           HA       ASP  13  -8.283  -1.517 -16.107
   60   1HB   ASP  13          2HB       ASP  13  -5.902  -0.449 -17.468
   61   2HB   ASP  13          1HB       ASP  13  -5.710  -0.580 -15.719
   62    H    LYS  14           H        LYS  14  -7.226   1.840 -16.589
   63    HA   LYS  14           HA       LYS  14  -7.302   2.570 -13.811
   64   1HB   LYS  14          2HB       LYS  14  -6.055   3.966 -15.229
   65   2HB   LYS  14          1HB       LYS  14  -7.305   3.971 -16.469
   66   1HG   LYS  14          2HG       LYS  14  -7.270   6.142 -15.366
   67   2HG   LYS  14          1HG       LYS  14  -8.761   5.301 -14.940
   68   1HD   LYS  14          2HD       LYS  14  -8.220   5.301 -12.753
   69   2HD   LYS  14          1HD       LYS  14  -6.627   4.623 -13.094
   70   1HE   LYS  14          2HE       LYS  14  -6.516   6.900 -12.020
   71   2HE   LYS  14          1HE       LYS  14  -5.757   6.863 -13.626
   72   1HZ   LYS  14          1HZ       LYS  14  -8.628   7.350 -13.538
   73   2HZ   LYS  14          2HZ       LYS  14  -7.447   8.013 -14.564
   74   3HZ   LYS  14          3HZ       LYS  14  -7.642   8.614 -12.987
   75    H    ALA  15           H        ALA  15  -9.657   2.453 -16.402
   76    HA   ALA  15           HA       ALA  15 -11.765   4.003 -15.288
   77   1HB   ALA  15          1HB       ALA  15 -12.652   1.575 -16.633
   78   2HB   ALA  15          2HB       ALA  15 -11.288   2.302 -17.482
   79   3HB   ALA  15          3HB       ALA  15 -12.751   3.244 -17.191
   80    H    LYS  16           H        LYS  16 -10.779   0.644 -14.802
   81    HA   LYS  16           HA       LYS  16 -12.966   0.040 -12.948
   82   1HB   LYS  16          2HB       LYS  16 -10.362  -1.470 -13.164
   83   2HB   LYS  16          1HB       LYS  16 -11.992  -2.110 -12.944
   84   1HG   LYS  16          2HG       LYS  16 -12.115  -0.735 -15.363
   85   2HG   LYS  16          1HG       LYS  16 -10.549  -1.542 -15.406
   86   1HD   LYS  16          2HD       LYS  16 -12.625  -3.296 -14.352
   87   2HD   LYS  16          1HD       LYS  16 -13.025  -2.715 -15.970
   88   1HE   LYS  16          2HE       LYS  16 -11.229  -3.795 -16.949
   89   2HE   LYS  16          1HE       LYS  16 -10.221  -3.652 -15.496
   90   1HZ   LYS  16          1HZ       LYS  16 -11.260  -5.404 -14.479
   91   2HZ   LYS  16          2HZ       LYS  16 -11.333  -5.923 -16.095
   92   3HZ   LYS  16          3HZ       LYS  16 -12.697  -5.224 -15.362
   93    H    TYR  17           H        TYR  17  -9.501   0.748 -12.802
   94    HA   TYR  17           HA       TYR  17  -9.103   0.650 -10.000
   95   1HB   TYR  17          2HB       TYR  17  -8.000   2.627 -12.031
   96   2HB   TYR  17          1HB       TYR  17  -7.257   2.191 -10.499
   97    HD1  TYR  17           HD1      TYR  17  -5.519   1.916 -12.679
   98    HD2  TYR  17           HD2      TYR  17  -8.612  -0.802 -11.460
   99    HE1  TYR  17           HE1      TYR  17  -4.299   0.050 -13.767
  100    HE2  TYR  17           HE2      TYR  17  -7.406  -2.665 -12.559
  101    HH   TYR  17           HH       TYR  17  -5.722  -3.199 -13.945
  102    H    ASP  18           H        ASP  18 -10.794   2.864 -12.095
  103    HA   ASP  18           HA       ASP  18 -10.992   4.990 -10.039
  104   1HB   ASP  18          2HB       ASP  18 -11.584   4.559 -12.902
  105   2HB   ASP  18          1HB       ASP  18 -12.723   5.623 -12.077
  106    H    ALA  19           H        ALA  19 -12.722   2.135 -10.887
  107    HA   ALA  19           HA       ALA  19 -15.271   3.138  -9.704
  108   1HB   ALA  19          1HB       ALA  19 -14.350   0.975 -11.486
  109   2HB   ALA  19          2HB       ALA  19 -15.943   1.726 -11.381
  110   3HB   ALA  19          3HB       ALA  19 -15.508   0.423 -10.275
  111    H    ILE  20           H        ILE  20 -12.505   1.119  -9.128
  112    HA   ILE  20           HA       ILE  20 -13.491  -0.086  -6.649
  113    HB   ILE  20           HB       ILE  20 -10.884   0.125  -8.183
  114   1HG1  ILE  20          2HG1      ILE  20 -12.503  -2.336  -7.504
  115   2HG1  ILE  20          1HG1      ILE  20 -12.853  -1.353  -8.927
  116   1HG2  ILE  20          1HG2      ILE  20  -9.695  -0.796  -6.508
  117   2HG2  ILE  20          2HG2      ILE  20 -11.013  -1.861  -6.028
  118   3HG2  ILE  20          3HG2      ILE  20 -10.976  -0.192  -5.462
  119   1HD1  ILE  20          1HD1      ILE  20 -10.183  -2.648  -8.294
  120   2HD1  ILE  20          2HD1      ILE  20 -10.531  -1.656  -9.711
  121   3HD1  ILE  20          3HD1      ILE  20 -11.339  -3.211  -9.503
  122    H    PHE  21           H        PHE  21 -11.553   2.638  -7.732
  123    HA   PHE  21           HA       PHE  21 -10.482   3.465  -5.196
  124   1HB   PHE  21          2HB       PHE  21  -9.372   4.404  -6.981
  125   2HB   PHE  21          1HB       PHE  21 -10.826   4.465  -7.972
  126    HD1  PHE  21           HD1      PHE  21  -8.570   6.336  -5.924
  127    HD2  PHE  21           HD2      PHE  21 -12.618   6.226  -7.353
  128    HE1  PHE  21           HE1      PHE  21  -8.812   8.751  -5.418
  129    HE2  PHE  21           HE2      PHE  21 -12.863   8.641  -6.845
  130    HZ   PHE  21           HZ       PHE  21 -10.961   9.902  -5.878
  131    H    ASP  22           H        ASP  22 -13.439   4.184  -6.967
  132    HA   ASP  22           HA       ASP  22 -14.387   6.100  -4.934
  133   1HB   ASP  22          2HB       ASP  22 -14.823   6.686  -7.180
  134   2HB   ASP  22          1HB       ASP  22 -15.313   5.043  -7.604
  135    H    SER  23           H        SER  23 -14.457   2.735  -5.404
  136    HA   SER  23           HA       SER  23 -17.136   2.219  -4.347
  137   1HB   SER  23          2HB       SER  23 -16.546   0.268  -5.341
  138   2HB   SER  23          1HB       SER  23 -14.871   0.797  -5.469
  139    HG   SER  23           HG       SER  23 -16.103  -0.295  -3.148
  140    H    LEU  24           H        LEU  24 -14.118   3.127  -3.073
  141    HA   LEU  24           HA       LEU  24 -14.569   1.964  -0.387
  142   1HB   LEU  24          2HB       LEU  24 -12.397   3.852  -1.321
  143   2HB   LEU  24          1HB       LEU  24 -12.306   2.654  -0.031
  144    HG   LEU  24           HG       LEU  24 -12.751   1.884  -2.920
  145   1HD1  LEU  24          1HD1      LEU  24 -10.109   1.263  -2.118
  146   2HD1  LEU  24          2HD1      LEU  24 -10.371   2.956  -1.707
  147   3HD1  LEU  24          3HD1      LEU  24 -10.610   2.403  -3.366
  148   1HD2  LEU  24          1HD2      LEU  24 -13.104   0.399  -0.718
  149   2HD2  LEU  24          2HD2      LEU  24 -11.357   0.213  -0.878
  150   3HD2  LEU  24          3HD2      LEU  24 -12.420  -0.285  -2.195
  151    H    SER  25           H        SER  25 -13.927   5.116  -1.851
  152    HA   SER  25           HA       SER  25 -15.751   6.909  -1.213
  153   1HB   SER  25          2HB       SER  25 -14.662   5.871   1.402
  154   2HB   SER  25          1HB       SER  25 -15.245   7.528   1.287
  155    HG   SER  25           HG       SER  25 -16.818   5.834   1.895
  156    HA   PRO  26           HA       PRO  26 -11.673   8.698  -2.059
  157   1HB   PRO  26          2HB       PRO  26 -12.603  10.576  -3.807
  158   2HB   PRO  26          1HB       PRO  26 -12.281   8.895  -4.278
  159   1HG   PRO  26          2HG       PRO  26 -14.870  10.200  -3.603
  160   2HG   PRO  26          1HG       PRO  26 -14.498   9.042  -4.890
  161   1HD   PRO  26          2HD       PRO  26 -15.716   8.328  -2.568
  162   2HD   PRO  26          1HD       PRO  26 -14.657   7.227  -3.479
  163    H    VAL  27           H        VAL  27 -10.780  10.593  -1.219
  164    HA   VAL  27           HA       VAL  27 -12.659  12.422   0.242
  165    HB   VAL  27           HB       VAL  27  -9.764  11.737   0.846
  166   1HG1  VAL  27          1HG1      VAL  27 -10.059  12.915   2.848
  167   2HG1  VAL  27          2HG1      VAL  27 -11.815  12.778   2.784
  168   3HG1  VAL  27          3HG1      VAL  27 -10.979  13.895   1.706
  169   1HG2  VAL  27          1HG2      VAL  27 -11.181   9.723   0.995
  170   2HG2  VAL  27          2HG2      VAL  27 -12.321  10.593   2.020
  171   3HG2  VAL  27          3HG2      VAL  27 -10.692  10.255   2.604
  172    H    ASN  28           H        ASN  28 -12.819  14.030  -1.381
  173    HA   ASN  28           HA       ASN  28 -12.123  15.909  -2.621
  174   1HB   ASN  28          2HB       ASN  28 -11.162  16.830  -0.703
  175   2HB   ASN  28          1HB       ASN  28 -10.033  15.495  -0.501
  176   1HD2  ASN  28          1HD2      ASN  28  -7.914  16.002  -1.070
  177   2HD2  ASN  28          2HD2      ASN  28  -7.462  17.213  -2.170
  178    H    GLY  29           H        GLY  29 -11.050  12.921  -3.089
  179   1HA   GLY  29          2HA       GLY  29 -10.274  12.330  -5.361
  180   2HA   GLY  29          1HA       GLY  29  -9.211  13.738  -5.295
  181    H    PHE  30           H        PHE  30  -9.677  11.501  -2.611
  182    HA   PHE  30           HA       PHE  30  -7.050  10.216  -3.140
  183   1HB   PHE  30          2HB       PHE  30  -7.725  12.017  -0.814
  184   2HB   PHE  30          1HB       PHE  30  -6.352  10.901  -0.788
  185    HD1  PHE  30           HD1      PHE  30  -7.711  13.990  -2.170
  186    HD2  PHE  30           HD2      PHE  30  -4.519  11.138  -2.427
  187    HE1  PHE  30           HE1      PHE  30  -6.390  15.600  -3.495
  188    HE2  PHE  30           HE2      PHE  30  -3.176  12.758  -3.749
  189    HZ   PHE  30           HZ       PHE  30  -4.114  14.993  -4.287
  190    H    LEU  31           H        LEU  31  -6.725   8.299  -2.001
  191    HA   LEU  31           HA       LEU  31  -9.048   7.303  -0.375
  192   1HB   LEU  31          2HB       LEU  31  -7.201   6.007  -2.382
  193   2HB   LEU  31          1HB       LEU  31  -7.977   5.029  -1.137
  194    HG   LEU  31           HG       LEU  31  -9.291   6.639  -3.324
  195   1HD1  LEU  31          1HD1      LEU  31  -8.949   3.781  -2.540
  196   2HD1  LEU  31          2HD1      LEU  31  -8.971   4.512  -4.151
  197   3HD1  LEU  31          3HD1      LEU  31 -10.483   4.242  -3.285
  198   1HD2  LEU  31          1HD2      LEU  31 -10.602   7.162  -1.379
  199   2HD2  LEU  31          2HD2      LEU  31 -10.478   5.508  -0.773
  200   3HD2  LEU  31          3HD2      LEU  31 -11.450   5.854  -2.206
  201    H    SER  32           H        SER  32  -8.478   6.602   1.672
  202    HA   SER  32           HA       SER  32  -5.701   7.072   2.513
  203   1HB   SER  32          2HB       SER  32  -6.652   6.718   4.742
  204   2HB   SER  32          1HB       SER  32  -7.708   7.779   3.816
  205    HG   SER  32           HG       SER  32  -8.592   5.469   3.217
  206    H    GLY  33           H        GLY  33  -4.231   5.492   3.102
  207   1HA   GLY  33          2HA       GLY  33  -4.163   2.979   1.966
  208   2HA   GLY  33          1HA       GLY  33  -3.420   3.295   3.536
  209    H    ASP  34           H        ASP  34  -6.071   3.979   4.705
  210    HA   ASP  34           HA       ASP  34  -6.798   1.437   5.774
  211   1HB   ASP  34          2HB       ASP  34  -7.146   3.884   6.581
  212   2HB   ASP  34          1HB       ASP  34  -8.620   3.829   5.617
  213    H    LYS  35           H        LYS  35  -7.878   3.172   2.904
  214    HA   LYS  35           HA       LYS  35 -10.123   1.269   2.494
  215   1HB   LYS  35          2HB       LYS  35  -9.159   3.821   1.169
  216   2HB   LYS  35          1HB       LYS  35 -10.504   2.871   0.537
  217   1HG   LYS  35          2HG       LYS  35 -11.716   3.126   2.649
  218   2HG   LYS  35          1HG       LYS  35 -10.358   4.006   3.346
  219   1HD   LYS  35          2HD       LYS  35 -10.717   5.524   1.173
  220   2HD   LYS  35          1HD       LYS  35 -12.362   4.903   1.324
  221   1HE   LYS  35          2HE       LYS  35 -12.626   5.826   3.504
  222   2HE   LYS  35          1HE       LYS  35 -10.884   6.109   3.679
  223   1HZ   LYS  35          1HZ       LYS  35 -10.916   7.838   2.189
  224   2HZ   LYS  35          2HZ       LYS  35 -12.435   8.042   2.922
  225   3HZ   LYS  35          3HZ       LYS  35 -12.315   7.295   1.401
  226    H    VAL  36           H        VAL  36  -6.956   2.207   1.273
  227    HA   VAL  36           HA       VAL  36  -7.092   0.420  -1.060
  228    HB   VAL  36           HB       VAL  36  -4.843   1.952   0.281
  229   1HG1  VAL  36          1HG1      VAL  36  -4.271  -0.044  -1.260
  230   2HG1  VAL  36          2HG1      VAL  36  -3.519   1.507  -1.628
  231   3HG1  VAL  36          3HG1      VAL  36  -4.906   0.954  -2.567
  232   1HG2  VAL  36          1HG2      VAL  36  -6.564   2.594  -2.136
  233   2HG2  VAL  36          2HG2      VAL  36  -5.235   3.582  -1.532
  234   3HG2  VAL  36          3HG2      VAL  36  -6.689   3.370  -0.557
  235    H    LYS  37           H        LYS  37  -5.321   0.467   2.059
  236    HA   LYS  37           HA       LYS  37  -3.763  -1.799   1.903
  237   1HB   LYS  37          2HB       LYS  37  -3.847  -0.387   3.861
  238   2HB   LYS  37          1HB       LYS  37  -5.527  -0.819   4.164
  239   1HG   LYS  37          2HG       LYS  37  -3.924  -3.211   3.953
  240   2HG   LYS  37          1HG       LYS  37  -3.223  -2.123   5.152
  241   1HD   LYS  37          2HD       LYS  37  -6.114  -2.202   5.399
  242   2HD   LYS  37          1HD       LYS  37  -5.429  -3.823   5.515
  243   1HE   LYS  37          2HE       LYS  37  -3.743  -2.854   7.180
  244   2HE   LYS  37          1HE       LYS  37  -4.774  -1.410   7.224
  245   1HZ   LYS  37          1HZ       LYS  37  -5.285  -3.324   8.851
  246   2HZ   LYS  37          2HZ       LYS  37  -5.952  -4.100   7.495
  247   3HZ   LYS  37          3HZ       LYS  37  -6.573  -2.606   8.014
  248    HA   PRO  38           HA       PRO  38  -7.450  -4.682   3.013
  249   1HB   PRO  38          2HB       PRO  38  -9.964  -3.660   2.588
  250   2HB   PRO  38          1HB       PRO  38  -9.141  -3.585   4.161
  251   1HG   PRO  38          2HG       PRO  38  -9.364  -1.493   2.040
  252   2HG   PRO  38          1HG       PRO  38  -9.541  -1.336   3.796
  253   1HD   PRO  38          2HD       PRO  38  -7.285  -0.611   2.552
  254   2HD   PRO  38          1HD       PRO  38  -7.259  -1.360   4.165
  255    H    VAL  39           H        VAL  39  -7.880  -2.255   0.499
  256    HA   VAL  39           HA       VAL  39  -9.142  -3.908  -1.484
  257    HB   VAL  39           HB       VAL  39  -7.657  -1.318  -1.290
  258   1HG1  VAL  39          1HG1      VAL  39  -6.681  -1.809  -3.324
  259   2HG1  VAL  39          2HG1      VAL  39  -8.231  -1.187  -3.884
  260   3HG1  VAL  39          3HG1      VAL  39  -7.963  -2.926  -3.790
  261   1HG2  VAL  39          1HG2      VAL  39  -9.732  -0.453  -1.505
  262   2HG2  VAL  39          2HG2      VAL  39 -10.309  -2.096  -1.232
  263   3HG2  VAL  39          3HG2      VAL  39 -10.113  -1.492  -2.877
  264    H    LEU  40           H        LEU  40  -5.800  -3.385  -0.509
  265    HA   LEU  40           HA       LEU  40  -4.692  -4.813  -2.831
  266   1HB   LEU  40          2HB       LEU  40  -3.485  -3.731  -0.267
  267   2HB   LEU  40          1HB       LEU  40  -2.572  -4.271  -1.673
  268    HG   LEU  40           HG       LEU  40  -4.602  -2.027  -1.673
  269   1HD1  LEU  40          1HD1      LEU  40  -2.777  -1.060  -0.612
  270   2HD1  LEU  40          2HD1      LEU  40  -2.337  -0.798  -2.301
  271   3HD1  LEU  40          3HD1      LEU  40  -1.621  -2.135  -1.400
  272   1HD2  LEU  40          1HD2      LEU  40  -4.498  -3.197  -3.811
  273   2HD2  LEU  40          2HD2      LEU  40  -2.736  -3.107  -3.803
  274   3HD2  LEU  40          3HD2      LEU  40  -3.693  -1.634  -3.963
  275    H    LEU  41           H        LEU  41  -5.637  -5.500   0.460
  276    HA   LEU  41           HA       LEU  41  -4.104  -7.978   0.671
  277   1HB   LEU  41          2HB       LEU  41  -6.368  -6.697   2.222
  278   2HB   LEU  41          1HB       LEU  41  -5.589  -8.201   2.716
  279    HG   LEU  41           HG       LEU  41  -3.900  -5.803   2.103
  280   1HD1  LEU  41          1HD1      LEU  41  -4.087  -5.124   4.477
  281   2HD1  LEU  41          2HD1      LEU  41  -5.322  -6.359   4.724
  282   3HD1  LEU  41          3HD1      LEU  41  -5.641  -4.997   3.649
  283   1HD2  LEU  41          1HD2      LEU  41  -3.579  -8.470   3.134
  284   2HD2  LEU  41          2HD2      LEU  41  -3.091  -7.317   4.378
  285   3HD2  LEU  41          3HD2      LEU  41  -2.325  -7.277   2.788
  286    H    ASN  42           H        ASN  42  -7.012  -6.999  -0.836
  287    HA   ASN  42           HA       ASN  42  -8.314  -9.625  -0.641
  288   1HB   ASN  42          2HB       ASN  42  -9.120  -7.004  -0.995
  289   2HB   ASN  42          1HB       ASN  42  -9.277  -7.668  -2.621
  290   1HD2  ASN  42          1HD2      ASN  42 -11.675  -7.051  -1.559
  291   2HD2  ASN  42          2HD2      ASN  42 -12.491  -8.422  -0.981
  292    H    SER  43           H        SER  43  -5.857  -8.272  -2.509
  293    HA   SER  43           HA       SER  43  -6.505  -9.587  -5.057
  294   1HB   SER  43          2HB       SER  43  -3.797  -8.543  -4.348
  295   2HB   SER  43          1HB       SER  43  -4.721  -8.335  -5.833
  296    HG   SER  43           HG       SER  43  -6.008  -6.841  -4.791
  297    H    LYS  44           H        LYS  44  -5.776 -10.935  -2.236
  298    HA   LYS  44           HA       LYS  44  -4.814 -13.019  -1.650
  299   1HB   LYS  44          2HB       LYS  44  -5.846 -13.440  -3.995
  300   2HB   LYS  44          1HB       LYS  44  -4.192 -13.309  -4.593
  301   1HG   LYS  44          2HG       LYS  44  -4.080 -15.002  -2.331
  302   2HG   LYS  44          1HG       LYS  44  -5.462 -15.543  -3.285
  303   1HD   LYS  44          2HD       LYS  44  -4.159 -16.092  -5.117
  304   2HD   LYS  44          1HD       LYS  44  -2.915 -14.906  -4.721
  305   1HE   LYS  44          2HE       LYS  44  -1.809 -16.855  -4.096
  306   2HE   LYS  44          1HE       LYS  44  -2.640 -16.491  -2.570
  307   1HZ   LYS  44          1HZ       LYS  44  -3.030 -18.793  -3.431
  308   2HZ   LYS  44          2HZ       LYS  44  -3.851 -18.104  -4.749
  309   3HZ   LYS  44          3HZ       LYS  44  -4.443 -17.892  -3.171
  310    H    LEU  45           H        LEU  45  -3.210 -10.406  -2.324
  311    HA   LEU  45           HA       LEU  45  -0.515 -11.599  -2.787
  312   1HB   LEU  45          2HB       LEU  45  -1.839  -8.922  -3.002
  313   2HB   LEU  45          1HB       LEU  45  -0.090  -8.974  -2.777
  314    HG   LEU  45           HG       LEU  45  -1.581 -10.494  -4.933
  315   1HD1  LEU  45          1HD1      LEU  45  -1.775  -8.164  -5.452
  316   2HD1  LEU  45          2HD1      LEU  45  -0.436  -8.772  -6.423
  317   3HD1  LEU  45          3HD1      LEU  45  -0.112  -7.850  -4.957
  318   1HD2  LEU  45          1HD2      LEU  45   1.319  -9.873  -5.097
  319   2HD2  LEU  45          2HD2      LEU  45   0.456 -11.333  -5.575
  320   3HD2  LEU  45          3HD2      LEU  45   0.858 -11.063  -3.880
  321    HA   PRO  46           HA       PRO  46   0.467 -11.141   1.466
  322   1HB   PRO  46          2HB       PRO  46   3.194 -11.101   1.275
  323   2HB   PRO  46          1HB       PRO  46   2.232 -12.573   1.056
  324   1HG   PRO  46          2HG       PRO  46   3.518 -10.839  -0.965
  325   2HG   PRO  46          1HG       PRO  46   3.275 -12.591  -0.966
  326   1HD   PRO  46          2HD       PRO  46   1.746 -10.784  -2.377
  327   2HD   PRO  46          1HD       PRO  46   1.232 -12.424  -1.944
  328    H    VAL  47           H        VAL  47   1.969  -9.619   2.853
  329    HA   VAL  47           HA       VAL  47   1.339  -6.879   2.216
  330    HB   VAL  47           HB       VAL  47   2.693  -8.492   4.346
  331   1HG1  VAL  47          1HG1      VAL  47   2.773  -5.469   4.392
  332   2HG1  VAL  47          2HG1      VAL  47   4.158  -6.454   3.923
  333   3HG1  VAL  47          3HG1      VAL  47   3.493  -6.584   5.549
  334   1HG2  VAL  47          1HG2      VAL  47   0.751  -8.093   5.411
  335   2HG2  VAL  47          2HG2      VAL  47   0.166  -7.381   3.907
  336   3HG2  VAL  47          3HG2      VAL  47   0.893  -6.356   5.144
  337    H    ASP  48           H        ASP  48   3.740  -8.915   1.058
  338    HA   ASP  48           HA       ASP  48   5.927  -6.966   1.030
  339   1HB   ASP  48          2HB       ASP  48   5.440  -9.718  -0.127
  340   2HB   ASP  48          1HB       ASP  48   6.922  -8.819  -0.443
  341    H    ILE  49           H        ILE  49   3.392  -8.146  -1.108
  342    HA   ILE  49           HA       ILE  49   4.426  -6.673  -3.438
  343    HB   ILE  49           HB       ILE  49   1.668  -7.854  -3.108
  344   1HG1  ILE  49          2HG1      ILE  49   3.164  -9.561  -2.238
  345   2HG1  ILE  49          1HG1      ILE  49   2.672 -10.032  -3.862
  346   1HG2  ILE  49          1HG2      ILE  49   2.839  -8.518  -5.568
  347   2HG2  ILE  49          2HG2      ILE  49   3.352  -6.860  -5.251
  348   3HG2  ILE  49          3HG2      ILE  49   1.635  -7.261  -5.278
  349   1HD1  ILE  49          1HD1      ILE  49   5.104 -10.328  -3.514
  350   2HD1  ILE  49          2HD1      ILE  49   5.251  -8.601  -3.177
  351   3HD1  ILE  49          3HD1      ILE  49   4.760  -9.148  -4.782
  352    H    LEU  50           H        LEU  50   1.913  -6.403  -0.993
  353    HA   LEU  50           HA       LEU  50   0.679  -4.013  -2.107
  354   1HB   LEU  50          2HB       LEU  50   0.629  -5.074   0.723
  355   2HB   LEU  50          1HB       LEU  50  -0.611  -4.120  -0.090
  356    HG   LEU  50           HG       LEU  50   0.204  -6.962  -0.734
  357   1HD1  LEU  50          1HD1      LEU  50  -1.267  -6.758   1.204
  358   2HD1  LEU  50          2HD1      LEU  50  -2.164  -7.434  -0.157
  359   3HD1  LEU  50          3HD1      LEU  50  -2.372  -5.737   0.280
  360   1HD2  LEU  50          1HD2      LEU  50  -0.525  -6.585  -2.826
  361   2HD2  LEU  50          2HD2      LEU  50  -0.932  -4.919  -2.418
  362   3HD2  LEU  50          3HD2      LEU  50  -2.113  -6.203  -2.162
  363    H    GLY  51           H        GLY  51   3.312  -4.757   0.086
  364   1HA   GLY  51          2HA       GLY  51   3.522  -2.060   1.184
  365   2HA   GLY  51          1HA       GLY  51   4.751  -3.328   1.314
  366    H    ARG  52           H        ARG  52   4.520  -3.747  -1.642
  367    HA   ARG  52           HA       ARG  52   6.367  -1.559  -2.448
  368   1HB   ARG  52          2HB       ARG  52   6.543  -4.268  -2.558
  369   2HB   ARG  52          1HB       ARG  52   5.845  -3.940  -4.142
  370   1HG   ARG  52          2HG       ARG  52   7.676  -2.170  -4.415
  371   2HG   ARG  52          1HG       ARG  52   8.445  -2.907  -3.009
  372   1HD   ARG  52          2HD       ARG  52   7.575  -4.742  -5.203
  373   2HD   ARG  52          1HD       ARG  52   9.017  -3.744  -5.478
  374    HE   ARG  52           HE       ARG  52   9.917  -4.671  -3.322
  375   1HH1  ARG  52          1HH2      ARG  52   8.176  -6.508  -5.544
  376   2HH1  ARG  52          2HH2      ARG  52   8.069  -7.923  -4.552
  377   1HH2  ARG  52          2HH1      ARG  52   9.412  -6.380  -1.751
  378   2HH2  ARG  52          1HH1      ARG  52   8.769  -7.851  -2.403
  379    H    VAL  53           H        VAL  53   3.307  -3.165  -3.336
  380    HA   VAL  53           HA       VAL  53   3.003  -1.766  -5.852
  381    HB   VAL  53           HB       VAL  53   1.149  -3.204  -3.942
  382   1HG1  VAL  53          1HG1      VAL  53   0.337  -1.253  -5.790
  383   2HG1  VAL  53          2HG1      VAL  53  -0.681  -2.496  -5.065
  384   3HG1  VAL  53          3HG1      VAL  53   0.092  -2.785  -6.623
  385   1HG2  VAL  53          1HG2      VAL  53   2.996  -4.158  -5.707
  386   2HG2  VAL  53          2HG2      VAL  53   1.576  -4.066  -6.754
  387   3HG2  VAL  53          3HG2      VAL  53   1.525  -5.028  -5.272
  388    H    TRP  54           H        TRP  54   1.782  -1.159  -2.546
  389    HA   TRP  54           HA       TRP  54   0.265   1.176  -3.174
  390   1HB   TRP  54          2HB       TRP  54  -0.072   0.254  -1.030
  391   2HB   TRP  54          1HB       TRP  54   1.660   0.086  -0.731
  392    HD1  TRP  54           HD1      TRP  54   3.046   2.406  -0.394
  393    HE1  TRP  54           HE1      TRP  54   2.331   4.631   0.643
  394    HE3  TRP  54           HE3      TRP  54  -2.020   1.824  -0.526
  395    HZ2  TRP  54           HZ2      TRP  54  -0.095   5.993   1.378
  396    HZ3  TRP  54           HZ3      TRP  54  -3.516   3.603   0.363
  397    HH2  TRP  54           HH2      TRP  54  -2.558   5.675   1.305
  398    H    GLU  55           H        GLU  55   3.694   0.803  -2.139
  399    HA   GLU  55           HA       GLU  55   4.333   3.564  -2.045
  400   1HB   GLU  55          2HB       GLU  55   5.931   1.090  -2.718
  401   2HB   GLU  55          1HB       GLU  55   6.664   2.672  -2.455
  402   1HG   GLU  55          2HG       GLU  55   4.753   1.724  -0.386
  403   2HG   GLU  55          1HG       GLU  55   6.316   0.911  -0.457
  404    H    LEU  56           H        LEU  56   4.917   1.293  -4.754
  405    HA   LEU  56           HA       LEU  56   5.715   3.326  -6.621
  406   1HB   LEU  56          2HB       LEU  56   4.388   0.628  -7.087
  407   2HB   LEU  56          1HB       LEU  56   5.315   1.537  -8.279
  408    HG   LEU  56           HG       LEU  56   6.691   1.029  -5.698
  409   1HD1  LEU  56          1HD1      LEU  56   5.326  -1.093  -6.477
  410   2HD1  LEU  56          2HD1      LEU  56   7.002  -1.265  -5.959
  411   3HD1  LEU  56          3HD1      LEU  56   6.609  -1.224  -7.677
  412   1HD2  LEU  56          1HD2      LEU  56   8.258   0.197  -7.861
  413   2HD2  LEU  56          2HD2      LEU  56   8.318   1.788  -7.103
  414   3HD2  LEU  56          3HD2      LEU  56   7.303   1.522  -8.519
  415    H    SER  57           H        SER  57   2.689   2.520  -5.240
  416    HA   SER  57           HA       SER  57   1.076   3.717  -7.432
  417   1HB   SER  57          2HB       SER  57  -0.010   1.857  -6.569
  418   2HB   SER  57          1HB       SER  57   0.656   2.094  -4.954
  419    HG   SER  57           HG       SER  57  -1.348   2.801  -4.681
  420    H    ASP  58           H        ASP  58   2.274   4.365  -4.186
  421    HA   ASP  58           HA       ASP  58   0.600   6.699  -3.688
  422   1HB   ASP  58          2HB       ASP  58   2.036   4.963  -2.187
  423   2HB   ASP  58          1HB       ASP  58   3.190   6.295  -2.289
  424    H    ILE  59           H        ILE  59   1.097   7.882  -5.738
  425    HA   ILE  59           HA       ILE  59   3.681   8.712  -6.560
  426    HB   ILE  59           HB       ILE  59   1.022  10.174  -6.703
  427   1HG1  ILE  59          2HG1      ILE  59   0.984   7.813  -7.564
  428   2HG1  ILE  59          1HG1      ILE  59   0.705   9.013  -8.823
  429   1HG2  ILE  59          1HG2      ILE  59   3.246  11.385  -7.292
  430   2HG2  ILE  59          2HG2      ILE  59   1.931  11.444  -8.466
  431   3HG2  ILE  59          3HG2      ILE  59   3.274  10.325  -8.701
  432   1HD1  ILE  59          1HD1      ILE  59   3.492   8.708  -8.734
  433   2HD1  ILE  59          2HD1      ILE  59   2.402   8.076  -9.968
  434   3HD1  ILE  59          3HD1      ILE  59   2.850   7.070  -8.591
  435    H    ASP  60           H        ASP  60   1.491  10.061  -4.114
  436    HA   ASP  60           HA       ASP  60   3.396  12.275  -3.548
  437   1HB   ASP  60          2HB       ASP  60   0.721  11.632  -2.282
  438   2HB   ASP  60          1HB       ASP  60   1.548  13.189  -2.308
  439    H    HIS  61           H        HIS  61   2.465   9.162  -2.343
  440    HA   HIS  61           HA       HIS  61   3.193   7.955  -0.443
  441   1HB   HIS  61          2HB       HIS  61   5.289  10.153  -0.549
  442   2HB   HIS  61          1HB       HIS  61   5.452   8.633   0.329
  443    HD1  HIS  61           HD1      HIS  61   5.820   6.476  -1.058
  444    HD2  HIS  61           HD2      HIS  61   5.525   9.922  -3.386
  445    HE1  HIS  61           HE1      HIS  61   6.574   5.832  -3.389
  446    H    ASP  62           H        ASP  62   1.090   9.705   0.097
  447    HA   ASP  62           HA       ASP  62   1.878  10.979   2.696
  448   1HB   ASP  62          2HB       ASP  62   0.034  12.511   2.268
  449   2HB   ASP  62          1HB       ASP  62   1.036  12.434   0.818
  450    H    GLY  63           H        GLY  63   1.007   8.117   2.007
  451   1HA   GLY  63          2HA       GLY  63  -0.221   6.491   3.185
  452   2HA   GLY  63          1HA       GLY  63  -0.756   7.765   4.283
  453    H    MET  64           H        MET  64  -1.188   8.063   0.824
  454    HA   MET  64           HA       MET  64  -4.021   7.210   0.984
  455   1HB   MET  64          2HB       MET  64  -3.058  10.022   0.405
  456   2HB   MET  64          1HB       MET  64  -4.695   9.465   0.087
  457   1HG   MET  64          2HG       MET  64  -5.091   9.043   2.413
  458   2HG   MET  64          1HG       MET  64  -3.396   9.334   2.811
  459   1HE   MET  64          1HE       MET  64  -6.424  10.190   3.290
  460   2HE   MET  64          2HE       MET  64  -6.944  11.391   2.110
  461   3HE   MET  64          3HE       MET  64  -6.459  11.905   3.725
  462    H    LEU  65           H        LEU  65  -5.017   7.157  -1.202
  463    HA   LEU  65           HA       LEU  65  -2.994   7.150  -3.419
  464   1HB   LEU  65          2HB       LEU  65  -5.118   5.189  -2.570
  465   2HB   LEU  65          1HB       LEU  65  -4.642   5.269  -4.265
  466    HG   LEU  65           HG       LEU  65  -2.901   4.605  -1.883
  467   1HD1  LEU  65          1HD1      LEU  65  -4.357   2.876  -3.155
  468   2HD1  LEU  65          2HD1      LEU  65  -2.649   2.497  -2.928
  469   3HD1  LEU  65          3HD1      LEU  65  -3.219   3.104  -4.482
  470   1HD2  LEU  65          1HD2      LEU  65  -2.144   5.400  -4.705
  471   2HD2  LEU  65          2HD2      LEU  65  -1.083   4.421  -3.692
  472   3HD2  LEU  65          3HD2      LEU  65  -1.522   6.051  -3.189
  473    H    ASP  66           H        ASP  66  -3.578   8.933  -4.662
  474    HA   ASP  66           HA       ASP  66  -6.280   9.958  -4.797
  475   1HB   ASP  66          2HB       ASP  66  -3.986  11.089  -5.234
  476   2HB   ASP  66          1HB       ASP  66  -4.121  10.397  -6.849
  477    H    ARG  67           H        ARG  67  -7.445  10.095  -6.968
  478    HA   ARG  67           HA       ARG  67  -8.222   7.581  -7.929
  479   1HB   ARG  67          2HB       ARG  67  -9.264   8.835  -9.711
  480   2HB   ARG  67          1HB       ARG  67  -9.295   9.839  -8.264
  481   1HG   ARG  67          2HG       ARG  67  -7.092  10.846  -9.106
  482   2HG   ARG  67          1HG       ARG  67  -7.454  10.067 -10.647
  483   1HD   ARG  67          2HD       ARG  67  -9.113  11.565 -11.145
  484   2HD   ARG  67          1HD       ARG  67  -9.710  11.594  -9.474
  485    HE   ARG  67           HE       ARG  67  -7.198  12.816  -9.364
  486   1HH1  ARG  67          1HH2      ARG  67 -10.193  13.908  -9.158
  487   2HH1  ARG  67          2HH2      ARG  67 -10.010  15.343 -10.110
  488   1HH2  ARG  67          2HH1      ARG  67  -6.940  14.404 -11.417
  489   2HH2  ARG  67          1HH1      ARG  67  -8.168  15.625 -11.389
  490    H    ASP  68           H        ASP  68  -5.635   9.682  -9.167
  491    HA   ASP  68           HA       ASP  68  -4.983   7.875 -11.375
  492   1HB   ASP  68          2HB       ASP  68  -3.734  10.332 -10.121
  493   2HB   ASP  68          1HB       ASP  68  -3.007   9.505 -11.501
  494    H    GLU  69           H        GLU  69  -3.797   8.475  -8.098
  495    HA   GLU  69           HA       GLU  69  -1.403   6.838  -8.356
  496   1HB   GLU  69          2HB       GLU  69  -3.015   7.682  -5.926
  497   2HB   GLU  69          1HB       GLU  69  -1.330   7.157  -5.923
  498   1HG   GLU  69          2HG       GLU  69  -0.822   9.066  -7.487
  499   2HG   GLU  69          1HG       GLU  69  -2.470   9.636  -7.226
  500    H    PHE  70           H        PHE  70  -4.676   6.353  -7.055
  501    HA   PHE  70           HA       PHE  70  -4.363   3.700  -6.089
  502   1HB   PHE  70          2HB       PHE  70  -6.268   5.336  -5.765
  503   2HB   PHE  70          1HB       PHE  70  -6.778   4.982  -7.415
  504    HD1  PHE  70           HD1      PHE  70  -6.749   3.839  -3.968
  505    HD2  PHE  70           HD2      PHE  70  -7.445   2.633  -8.032
  506    HE1  PHE  70           HE1      PHE  70  -7.970   1.843  -3.165
  507    HE2  PHE  70           HE2      PHE  70  -8.670   0.633  -7.225
  508    HZ   PHE  70           HZ       PHE  70  -8.931   0.243  -4.792
  509    H    ALA  71           H        ALA  71  -4.724   5.002  -9.332
  510    HA   ALA  71           HA       ALA  71  -5.501   2.573 -10.678
  511   1HB   ALA  71          1HB       ALA  71  -5.559   5.015 -11.462
  512   2HB   ALA  71          2HB       ALA  71  -4.986   3.840 -12.646
  513   3HB   ALA  71          3HB       ALA  71  -3.829   4.847 -11.770
  514    H    VAL  72           H        VAL  72  -2.353   4.116 -10.154
  515    HA   VAL  72           HA       VAL  72  -0.724   2.234 -11.508
  516    HB   VAL  72           HB       VAL  72  -0.198   3.879  -9.008
  517   1HG1  VAL  72          1HG1      VAL  72   1.799   2.810  -9.091
  518   2HG1  VAL  72          2HG1      VAL  72   2.119   3.814 -10.505
  519   3HG1  VAL  72          3HG1      VAL  72   1.491   2.179 -10.709
  520   1HG2  VAL  72          1HG2      VAL  72  -1.070   5.263 -10.827
  521   2HG2  VAL  72          2HG2      VAL  72   0.079   4.549 -11.958
  522   3HG2  VAL  72          3HG2      VAL  72   0.658   5.568 -10.638
  523    H    ALA  73           H        ALA  73  -2.312   2.099  -8.393
  524    HA   ALA  73           HA       ALA  73  -0.727  -0.200  -7.443
  525   1HB   ALA  73          1HB       ALA  73  -1.429   0.636  -5.477
  526   2HB   ALA  73          2HB       ALA  73  -3.121   0.443  -5.950
  527   3HB   ALA  73          3HB       ALA  73  -2.240   1.914  -6.380
  528    H    MET  74           H        MET  74  -3.522   0.171  -9.420
  529    HA   MET  74           HA       MET  74  -4.833  -2.280  -8.442
  530   1HB   MET  74          2HB       MET  74  -5.352  -0.583 -10.902
  531   2HB   MET  74          1HB       MET  74  -6.450  -1.770 -10.213
  532   1HG   MET  74          2HG       MET  74  -5.942   1.013  -9.400
  533   2HG   MET  74          1HG       MET  74  -7.366   0.017  -9.152
  534   1HE   MET  74          1HE       MET  74  -5.952  -2.509  -6.774
  535   2HE   MET  74          2HE       MET  74  -7.162  -2.057  -7.974
  536   3HE   MET  74          3HE       MET  74  -7.409  -1.634  -6.283
  537    H    PHE  75           H        PHE  75  -3.025  -1.283 -11.360
  538    HA   PHE  75           HA       PHE  75  -3.163  -3.976 -12.485
  539   1HB   PHE  75          2HB       PHE  75  -2.081  -2.993 -14.310
  540   2HB   PHE  75          1HB       PHE  75  -2.867  -1.590 -13.590
  541    HD1  PHE  75           HD1      PHE  75   0.338  -3.359 -14.056
  542    HD2  PHE  75           HD2      PHE  75  -1.602   0.101 -12.417
  543    HE1  PHE  75           HE1      PHE  75   2.545  -2.268 -13.745
  544    HE2  PHE  75           HE2      PHE  75   0.596   1.184 -12.109
  545    HZ   PHE  75           HZ       PHE  75   2.674   0.006 -12.768
  546    H    LEU  76           H        LEU  76  -1.059  -2.167 -10.363
  547    HA   LEU  76           HA       LEU  76   1.249  -3.906 -10.532
  548   1HB   LEU  76          2HB       LEU  76   0.202  -1.696  -8.847
  549   2HB   LEU  76          1HB       LEU  76   1.379  -2.759  -8.073
  550    HG   LEU  76           HG       LEU  76   1.753  -1.290 -10.699
  551   1HD1  LEU  76          1HD1      LEU  76   3.768  -0.778  -8.735
  552   2HD1  LEU  76          2HD1      LEU  76   2.191  -0.528  -7.985
  553   3HD1  LEU  76          3HD1      LEU  76   2.624   0.360  -9.446
  554   1HD2  LEU  76          1HD2      LEU  76   4.204  -2.264  -9.967
  555   2HD2  LEU  76          2HD2      LEU  76   3.132  -3.057 -11.120
  556   3HD2  LEU  76          3HD2      LEU  76   3.146  -3.570  -9.433
  557    H    VAL  77           H        VAL  77  -1.825  -4.005  -8.937
  558    HA   VAL  77           HA       VAL  77  -1.035  -6.187  -7.099
  559    HB   VAL  77           HB       VAL  77  -3.579  -4.619  -7.659
  560   1HG1  VAL  77          1HG1      VAL  77  -3.543  -6.110  -5.162
  561   2HG1  VAL  77          2HG1      VAL  77  -3.394  -7.195  -6.545
  562   3HG1  VAL  77          3HG1      VAL  77  -4.769  -6.096  -6.432
  563   1HG2  VAL  77          1HG2      VAL  77  -1.862  -4.701  -5.167
  564   2HG2  VAL  77          2HG2      VAL  77  -3.116  -3.530  -5.581
  565   3HG2  VAL  77          3HG2      VAL  77  -1.594  -3.543  -6.469
  566    H    TYR  78           H        TYR  78  -3.266  -5.625  -9.825
  567    HA   TYR  78           HA       TYR  78  -4.236  -8.315 -10.007
  568   1HB   TYR  78          2HB       TYR  78  -4.240  -5.801 -11.562
  569   2HB   TYR  78          1HB       TYR  78  -4.480  -7.264 -12.517
  570    HD1  TYR  78           HD1      TYR  78  -6.278  -4.784 -11.070
  571    HD2  TYR  78           HD2      TYR  78  -5.975  -9.066 -10.928
  572    HE1  TYR  78           HE1      TYR  78  -8.623  -4.923 -10.278
  573    HE2  TYR  78           HE2      TYR  78  -8.322  -9.206 -10.135
  574    HH   TYR  78           HH       TYR  78 -10.427  -6.444 -10.140
  575    H    CYS  79           H        CYS  79  -1.359  -6.736 -11.288
  576    HA   CYS  79           HA       CYS  79  -0.749  -8.882 -13.181
  577   1HB   CYS  79          2HB       CYS  79  -0.151  -6.344 -13.204
  578   2HB   CYS  79          1HB       CYS  79   1.151  -6.798 -12.105
  579    HG   CYS  79           HG       CYS  79   1.075  -7.384 -15.096
  580    H    ALA  80           H        ALA  80  -0.327  -8.369  -9.812
  581    HA   ALA  80           HA       ALA  80   2.020 -10.157  -9.650
  582   1HB   ALA  80          1HB       ALA  80   1.128  -9.650  -7.090
  583   2HB   ALA  80          2HB       ALA  80   0.566  -8.227  -7.967
  584   3HB   ALA  80          3HB       ALA  80   2.280  -8.642  -7.966
  585    H    LEU  81           H        LEU  81  -1.332 -10.407  -9.853
  586    HA   LEU  81           HA       LEU  81  -1.588 -12.817  -8.163
  587   1HB   LEU  81          2HB       LEU  81  -3.663 -11.756 -10.058
  588   2HB   LEU  81          1HB       LEU  81  -3.893 -12.490  -8.473
  589    HG   LEU  81           HG       LEU  81  -3.047  -9.696  -9.166
  590   1HD1  LEU  81          1HD1      LEU  81  -4.933  -9.082  -7.991
  591   2HD1  LEU  81          2HD1      LEU  81  -4.833 -10.466  -6.903
  592   3HD1  LEU  81          3HD1      LEU  81  -5.444 -10.676  -8.544
  593   1HD2  LEU  81          1HD2      LEU  81  -2.752  -9.729  -6.469
  594   2HD2  LEU  81          2HD2      LEU  81  -1.401  -9.941  -7.586
  595   3HD2  LEU  81          3HD2      LEU  81  -2.173 -11.350  -6.858
  596    H    GLU  82           H        GLU  82  -1.834 -11.898 -11.580
  597    HA   GLU  82           HA       GLU  82  -2.302 -14.614 -12.467
  598   1HB   GLU  82          2HB       GLU  82  -1.520 -13.437 -14.723
  599   2HB   GLU  82          1HB       GLU  82  -3.086 -13.077 -14.007
  600   1HG   GLU  82          2HG       GLU  82  -2.475 -10.954 -13.415
  601   2HG   GLU  82          1HG       GLU  82  -0.816 -11.416 -13.051
  602    H    LYS  83           H        LYS  83   0.574 -12.505 -12.740
  603    HA   LYS  83           HA       LYS  83   2.448 -14.505 -12.012
  604   1HB   LYS  83          2HB       LYS  83   1.242 -14.803 -14.609
  605   2HB   LYS  83          1HB       LYS  83   2.981 -14.562 -14.774
  606   1HG   LYS  83          2HG       LYS  83   2.453 -16.348 -12.574
  607   2HG   LYS  83          1HG       LYS  83   1.649 -16.941 -14.026
  608   1HD   LYS  83          2HD       LYS  83   3.666 -17.783 -14.614
  609   2HD   LYS  83          1HD       LYS  83   4.121 -16.117 -14.972
  610   1HE   LYS  83          2HE       LYS  83   5.322 -15.876 -12.999
  611   2HE   LYS  83          1HE       LYS  83   4.334 -17.070 -12.134
  612   1HZ   LYS  83          1HZ       LYS  83   6.216 -17.667 -14.357
  613   2HZ   LYS  83          2HZ       LYS  83   5.253 -18.806 -13.544
  614   3HZ   LYS  83          3HZ       LYS  83   6.498 -17.995 -12.718
  615    H    GLU  84           H        GLU  84   3.140 -12.259 -11.163
  616    HA   GLU  84           HA       GLU  84   5.326 -11.266 -12.782
  617   1HB   GLU  84          2HB       GLU  84   2.700 -10.310 -13.326
  618   2HB   GLU  84          1HB       GLU  84   3.602  -8.983 -12.590
  619   1HG   GLU  84          2HG       GLU  84   5.426 -10.137 -14.352
  620   2HG   GLU  84          1HG       GLU  84   3.899 -10.179 -15.234
  621    HA   PRO  85           HA       PRO  85   6.115 -10.056  -8.544
  622   1HB   PRO  85          2HB       PRO  85   8.748  -9.422  -8.938
  623   2HB   PRO  85          1HB       PRO  85   8.174 -11.091  -8.755
  624   1HG   PRO  85          2HG       PRO  85   8.914  -9.602 -11.218
  625   2HG   PRO  85          1HG       PRO  85   9.170 -11.303 -10.805
  626   1HD   PRO  85          2HD       PRO  85   7.189 -10.414 -12.476
  627   2HD   PRO  85          1HD       PRO  85   7.106 -11.927 -11.550
  628    H    VAL  86           H        VAL  86   7.005  -7.966  -7.544
  629    HA   VAL  86           HA       VAL  86   6.582  -5.649  -9.408
  630    HB   VAL  86           HB       VAL  86   5.709  -6.141  -6.551
  631   1HG1  VAL  86          1HG1      VAL  86   6.450  -3.830  -6.731
  632   2HG1  VAL  86          2HG1      VAL  86   4.687  -3.859  -6.727
  633   3HG1  VAL  86          3HG1      VAL  86   5.562  -3.628  -8.241
  634   1HG2  VAL  86          1HG2      VAL  86   3.896  -5.271  -8.760
  635   2HG2  VAL  86          2HG2      VAL  86   3.573  -6.348  -7.400
  636   3HG2  VAL  86          3HG2      VAL  86   4.477  -6.936  -8.796
  637    HA   PRO  87           HA       PRO  87  10.558  -4.513  -7.699
  638   1HB   PRO  87          2HB       PRO  87  11.034  -2.486  -9.464
  639   2HB   PRO  87          1HB       PRO  87  11.217  -4.197  -9.900
  640   1HG   PRO  87          2HG       PRO  87   9.126  -2.281 -10.663
  641   2HG   PRO  87          1HG       PRO  87   9.658  -3.758 -11.474
  642   1HD   PRO  87          2HD       PRO  87   7.348  -3.410  -9.857
  643   2HD   PRO  87          1HD       PRO  87   7.952  -4.920 -10.569
  644    H    MET  88           H        MET  88  11.369  -2.587  -6.527
  645    HA   MET  88           HA       MET  88   9.193  -0.951  -5.402
  646   1HB   MET  88          2HB       MET  88  12.188  -1.063  -4.966
  647   2HB   MET  88          1HB       MET  88  11.086  -0.061  -4.025
  648   1HG   MET  88          2HG       MET  88  10.075  -2.753  -4.122
  649   2HG   MET  88          1HG       MET  88  11.749  -2.784  -3.578
  650   1HE   MET  88          1HE       MET  88  10.187  -3.094  -0.209
  651   2HE   MET  88          2HE       MET  88  11.822  -3.044  -0.862
  652   3HE   MET  88          3HE       MET  88  10.568  -3.937  -1.715
  653    H    SER  89           H        SER  89  10.566  -0.641  -8.282
  654    HA   SER  89           HA       SER  89  11.172   2.265  -7.953
  655   1HB   SER  89          2HB       SER  89  11.861   0.406 -10.228
  656   2HB   SER  89          1HB       SER  89  12.535   2.001  -9.912
  657    HG   SER  89           HG       SER  89  13.669   1.205  -8.246
  658    H    LEU  90           H        LEU  90   9.250   3.275  -8.285
  659    HA   LEU  90           HA       LEU  90   7.238   2.412 -10.151
  660   1HB   LEU  90          2HB       LEU  90   6.265   3.873  -8.703
  661   2HB   LEU  90          1HB       LEU  90   7.819   4.570  -8.264
  662    HG   LEU  90           HG       LEU  90   7.753   5.969 -10.290
  663   1HD1  LEU  90          1HD1      LEU  90   6.185   4.234 -11.457
  664   2HD1  LEU  90          2HD1      LEU  90   5.947   5.944 -11.808
  665   3HD1  LEU  90          3HD1      LEU  90   4.884   5.121 -10.664
  666   1HD2  LEU  90          1HD2      LEU  90   5.194   6.202  -8.684
  667   2HD2  LEU  90          2HD2      LEU  90   6.043   7.505  -9.515
  668   3HD2  LEU  90          3HD2      LEU  90   6.773   6.736  -8.108
  669    HA   PRO  91           HA       PRO  91   9.832   3.558 -13.647
  670   1HB   PRO  91          2HB       PRO  91   8.085   2.592 -15.535
  671   2HB   PRO  91          1HB       PRO  91   9.215   1.566 -14.628
  672   1HG   PRO  91          2HG       PRO  91   6.317   2.095 -14.108
  673   2HG   PRO  91          1HG       PRO  91   7.199   0.556 -14.088
  674   1HD   PRO  91          2HD       PRO  91   6.606   1.829 -11.812
  675   2HD   PRO  91          1HD       PRO  91   8.154   0.976 -12.011
  676    HA   PRO  92           HA       PRO  92   7.974   7.391 -14.726
  677   1HB   PRO  92          2HB       PRO  92   9.392   7.921 -17.003
  678   2HB   PRO  92          1HB       PRO  92  10.090   8.054 -15.376
  679   1HG   PRO  92          2HG       PRO  92  10.362   5.872 -17.380
  680   2HG   PRO  92          1HG       PRO  92  11.570   6.549 -16.276
  681   1HD   PRO  92          2HD       PRO  92  10.278   4.191 -15.828
  682   2HD   PRO  92          1HD       PRO  92  10.900   5.231 -14.528
  683    H    ALA  93           H        ALA  93   7.681   4.577 -16.611
  684    HA   ALA  93           HA       ALA  93   6.001   5.839 -18.717
  685   1HB   ALA  93          1HB       ALA  93   7.737   3.689 -18.612
  686   2HB   ALA  93          2HB       ALA  93   6.525   3.931 -19.870
  687   3HB   ALA  93          3HB       ALA  93   6.163   2.899 -18.482
  688    H    LEU  94           H        LEU  94   5.423   5.547 -15.701
  689    HA   LEU  94           HA       LEU  94   2.696   4.372 -15.986
  690   1HB   LEU  94          2HB       LEU  94   3.733   2.618 -14.941
  691   2HB   LEU  94          1HB       LEU  94   5.066   3.616 -14.393
  692    HG   LEU  94           HG       LEU  94   3.265   4.579 -12.718
  693   1HD1  LEU  94          1HD1      LEU  94   1.375   3.322 -12.392
  694   2HD1  LEU  94          2HD1      LEU  94   2.204   1.816 -12.773
  695   3HD1  LEU  94          3HD1      LEU  94   1.641   2.865 -14.073
  696   1HD2  LEU  94          1HD2      LEU  94   4.115   1.790 -12.112
  697   2HD2  LEU  94          2HD2      LEU  94   4.298   3.254 -11.144
  698   3HD2  LEU  94          3HD2      LEU  94   5.368   2.962 -12.518
  699    H    VAL  95           H        VAL  95   4.466   7.068 -15.308
  700    HA   VAL  95           HA       VAL  95   2.926   7.990 -12.951
  701    HB   VAL  95           HB       VAL  95   5.025   9.390 -14.628
  702   1HG1  VAL  95          1HG1      VAL  95   3.693   9.877 -11.995
  703   2HG1  VAL  95          2HG1      VAL  95   4.192  11.035 -13.229
  704   3HG1  VAL  95          3HG1      VAL  95   5.393  10.316 -12.155
  705   1HG2  VAL  95          1HG2      VAL  95   5.662   7.086 -13.671
  706   2HG2  VAL  95          2HG2      VAL  95   5.512   7.835 -12.082
  707   3HG2  VAL  95          3HG2      VAL  95   6.702   8.441 -13.234
  708    HA   PRO  96           HA       PRO  96   0.135   9.931 -15.883
  709   1HB   PRO  96          2HB       PRO  96  -1.788  10.537 -14.037
  710   2HB   PRO  96          1HB       PRO  96  -1.605   8.918 -14.741
  711   1HG   PRO  96          2HG       PRO  96  -0.806   9.922 -12.073
  712   2HG   PRO  96          1HG       PRO  96  -1.359   8.314 -12.559
  713   1HD   PRO  96          2HD       PRO  96   1.279   9.027 -12.080
  714   2HD   PRO  96          1HD       PRO  96   0.749   7.604 -13.001
  715    HA   PRO  97           HA       PRO  97   0.886  14.209 -15.178
  716   1HB   PRO  97          2HB       PRO  97  -1.497  15.404 -15.810
  717   2HB   PRO  97          1HB       PRO  97  -0.424  14.685 -17.027
  718   1HG   PRO  97          2HG       PRO  97  -2.897  13.574 -15.796
  719   2HG   PRO  97          1HG       PRO  97  -2.325  13.475 -17.469
  720   1HD   PRO  97          2HD       PRO  97  -2.088  11.433 -15.682
  721   2HD   PRO  97          1HD       PRO  97  -0.966  11.683 -17.036
  722    H    SER  98           H        SER  98   1.186  14.171 -12.908
  723    HA   SER  98           HA       SER  98  -0.863  15.635 -11.391
  724   1HB   SER  98          2HB       SER  98  -1.103  12.983 -11.306
  725   2HB   SER  98          1HB       SER  98   0.221  13.126 -10.154
  726    HG   SER  98           HG       SER  98  -1.264  13.657  -8.776
  727    H    LYS  99           H        LYS  99   2.229  13.938 -11.382
  728    HA   LYS  99           HA       LYS  99   3.332  15.775  -9.340
  729   1HB   LYS  99          2HB       LYS  99   3.856  13.141 -10.454
  730   2HB   LYS  99          1HB       LYS  99   5.320  14.124 -10.485
  731   1HG   LYS  99          2HG       LYS  99   4.943  14.675  -8.073
  732   2HG   LYS  99          1HG       LYS  99   3.575  13.561  -8.070
  733   1HD   LYS  99          2HD       LYS  99   5.806  12.608  -7.249
  734   2HD   LYS  99          1HD       LYS  99   4.976  11.680  -8.499
  735   1HE   LYS  99          2HE       LYS  99   6.503  12.299 -10.161
  736   2HE   LYS  99          1HE       LYS  99   6.983  13.779  -9.305
  737   1HZ   LYS  99          1HZ       LYS  99   7.447  11.059  -8.218
  738   2HZ   LYS  99          2HZ       LYS  99   8.091  12.528  -7.655
  739   3HZ   LYS  99          3HZ       LYS  99   8.604  11.886  -9.143
  740    H    ARG 100           H        ARG 100   2.602  16.040 -12.535
  741    HA   ARG 100           HA       ARG 100   5.097  16.953 -13.692
  742   1HB   ARG 100          2HB       ARG 100   2.243  17.677 -14.423
  743   2HB   ARG 100          1HB       ARG 100   3.643  17.670 -15.497
  744   1HG   ARG 100          2HG       ARG 100   2.239  15.303 -14.247
  745   2HG   ARG 100          1HG       ARG 100   2.523  15.625 -15.959
  746   1HD   ARG 100          2HD       ARG 100   5.093  15.614 -15.032
  747   2HD   ARG 100          1HD       ARG 100   4.342  14.431 -13.945
  748    HE   ARG 100           HE       ARG 100   4.085  12.996 -15.797
  749   1HH1  ARG 100          1HH2      ARG 100   5.178  16.076 -16.816
  750   2HH1  ARG 100          2HH2      ARG 100   4.883  15.781 -18.496
  751   1HH2  ARG 100          2HH1      ARG 100   3.404  12.691 -17.972
  752   2HH2  ARG 100          1HH1      ARG 100   3.881  13.868 -19.151
  753    H    SER 107           1H       SER 107   5.608   7.584   8.598
  754    HA   SER 107           HA       SER 107   5.863   5.236   7.748
  755   1HB   SER 107          2HB       SER 107   3.340   4.876   9.377
  756   2HB   SER 107          1HB       SER 107   4.289   3.633   8.570
  757    HG   SER 107           HG       SER 107   4.506   4.268  11.025
  758    H    THR 108           H        THR 108   4.719   4.906   5.791
  759    HA   THR 108           HA       THR 108   2.266   6.553   5.343
  760    HB   THR 108           HB       THR 108   4.143   7.887   4.583
  761    HG1  THR 108           HG1      THR 108   3.669   7.915   2.325
  762   1HG2  THR 108          1HG2      THR 108   5.147   6.081   2.526
  763   2HG2  THR 108          2HG2      THR 108   5.368   5.423   4.146
  764   3HG2  THR 108          3HG2      THR 108   6.038   7.002   3.738
  765    H    ASN 109           H        ASN 109   3.531   3.556   5.336
  766    HA   ASN 109           HA       ASN 109   1.943   2.678   2.945
  767   1HB   ASN 109          2HB       ASN 109   4.496   2.494   2.912
  768   2HB   ASN 109          1HB       ASN 109   4.327   1.288   4.190
  769   1HD2  ASN 109          1HD2      ASN 109   5.258   0.868   1.363
  770   2HD2  ASN 109          2HD2      ASN 109   4.197  -0.277   0.700
  771    HA   PRO 110           HA       PRO 110  -0.296   0.564   6.158
  772   1HB   PRO 110          2HB       PRO 110  -2.113  -0.665   4.525
  773   2HB   PRO 110          1HB       PRO 110  -2.202   1.056   4.957
  774   1HG   PRO 110          2HG       PRO 110  -1.256  -0.218   2.452
  775   2HG   PRO 110          1HG       PRO 110  -2.118   1.309   2.692
  776   1HD   PRO 110          2HD       PRO 110   0.591   1.085   2.213
  777   2HD   PRO 110          1HD       PRO 110  -0.193   2.484   2.978
  778    H    PHE 111           H        PHE 111   1.983  -0.766   4.220
  779    HA   PHE 111           HA       PHE 111   1.383  -3.538   5.204
  780   1HB   PHE 111          2HB       PHE 111   2.465  -2.663   2.511
  781   2HB   PHE 111          1HB       PHE 111   2.356  -4.342   3.036
  782    HD1  PHE 111           HD1      PHE 111   0.531  -1.454   1.769
  783    HD2  PHE 111           HD2      PHE 111   0.143  -5.360   3.506
  784    HE1  PHE 111           HE1      PHE 111  -1.837  -1.545   1.037
  785    HE2  PHE 111           HE2      PHE 111  -2.218  -5.446   2.776
  786    HZ   PHE 111           HZ       PHE 111  -3.203  -3.544   1.544
  787    H    LEU 112           HN       LEU 112   3.061  -1.615   6.520
  788    HA   LEU 112           HA       LEU 112   5.670  -3.041   6.305
  789   1HB   LEU 112          2HB       LEU 112   5.019  -0.283   5.539
  790   2HB   LEU 112          1HB       LEU 112   6.369  -0.380   6.671
  791    HG   LEU 112           HG       LEU 112   6.518  -2.421   4.577
  792   1HD1  LEU 112          1HD1      LEU 112   6.984   0.402   3.640
  793   2HD1  LEU 112          2HD1      LEU 112   5.392  -0.340   3.471
  794   3HD1  LEU 112          3HD1      LEU 112   6.791  -1.067   2.681
  795   1HD2  LEU 112          1HD2      LEU 112   8.289  -0.294   5.776
  796   2HD2  LEU 112          2HD2      LEU 112   8.806  -1.197   4.352
  797   3HD2  LEU 112          3HD2      LEU 112   8.462  -2.047   5.859
  Start of MODEL   20
    1    HA   PRO   6           HA       PRO   6   1.381   7.597 -22.933
    2   1HB   PRO   6          2HB       PRO   6   0.213   5.140 -23.240
    3   2HB   PRO   6          1HB       PRO   6   0.435   6.280 -24.582
    4   1HG   PRO   6          2HG       PRO   6   2.044   3.886 -23.847
    5   2HG   PRO   6          1HG       PRO   6   1.573   4.481 -25.447
    6   1HD   PRO   6          2HD       PRO   6   4.052   4.853 -24.386
    7   2HD   PRO   6          1HD       PRO   6   3.309   5.974 -25.548
    8    H    TRP   7           H        TRP   7   0.040   6.822 -21.052
    9    HA   TRP   7           HA       TRP   7   1.719   6.005 -18.827
   10   1HB   TRP   7          2HB       TRP   7  -0.132   7.602 -18.619
   11   2HB   TRP   7          1HB       TRP   7  -1.279   6.373 -19.155
   12    HD1  TRP   7           HD1      TRP   7   1.517   5.337 -16.837
   13    HE1  TRP   7           HE1      TRP   7   0.540   4.750 -14.524
   14    HE3  TRP   7           HE3      TRP   7  -3.278   6.962 -17.478
   15    HZ2  TRP   7           HZ2      TRP   7  -1.955   4.951 -13.130
   16    HZ3  TRP   7           HZ3      TRP   7  -4.934   6.754 -15.645
   17    HH2  TRP   7           HH2      TRP   7  -4.279   5.753 -13.474
   18    H    ALA   8           H        ALA   8   2.161   3.928 -18.275
   19    HA   ALA   8           HA       ALA   8   1.581   1.576 -19.536
   20   1HB   ALA   8          1HB       ALA   8   3.035   1.738 -17.611
   21   2HB   ALA   8          2HB       ALA   8   1.783   0.557 -17.226
   22   3HB   ALA   8          3HB       ALA   8   1.684   2.192 -16.572
   23    H    VAL   9           H        VAL   9  -0.618   3.361 -17.446
   24    HA   VAL   9           HA       VAL   9  -2.651   1.197 -17.665
   25    HB   VAL   9           HB       VAL   9  -2.538   3.752 -16.030
   26   1HG1  VAL   9          1HG1      VAL   9  -4.288   1.296 -15.712
   27   2HG1  VAL   9          2HG1      VAL   9  -4.825   2.816 -16.426
   28   3HG1  VAL   9          3HG1      VAL   9  -4.343   2.761 -14.731
   29   1HG2  VAL   9          1HG2      VAL   9  -1.865   2.284 -14.179
   30   2HG2  VAL   9          2HG2      VAL   9  -0.714   2.121 -15.510
   31   3HG2  VAL   9          3HG2      VAL   9  -1.942   0.878 -15.243
   32    H    LYS  10           H        LYS  10  -4.459   1.476 -18.944
   33    HA   LYS  10           HA       LYS  10  -4.614   3.910 -20.626
   34   1HB   LYS  10          2HB       LYS  10  -5.282   1.093 -20.747
   35   2HB   LYS  10          1HB       LYS  10  -6.676   2.068 -21.208
   36   1HG   LYS  10          2HG       LYS  10  -5.731   2.613 -23.179
   37   2HG   LYS  10          1HG       LYS  10  -4.243   3.130 -22.382
   38   1HD   LYS  10          2HD       LYS  10  -3.777   1.270 -23.914
   39   2HD   LYS  10          1HD       LYS  10  -3.514   0.762 -22.243
   40   1HE   LYS  10          2HE       LYS  10  -6.196   0.186 -22.616
   41   2HE   LYS  10          1HE       LYS  10  -5.485  -0.218 -24.191
   42   1HZ   LYS  10          1HZ       LYS  10  -5.308  -2.063 -22.597
   43   2HZ   LYS  10          2HZ       LYS  10  -4.393  -1.074 -21.562
   44   3HZ   LYS  10          3HZ       LYS  10  -3.786  -1.501 -23.091
   45    HA   PRO  11           HA       PRO  11  -8.218   5.644 -18.801
   46   1HB   PRO  11          2HB       PRO  11 -10.104   5.744 -20.789
   47   2HB   PRO  11          1HB       PRO  11  -8.689   6.814 -20.741
   48   1HG   PRO  11          2HG       PRO  11  -9.131   4.328 -22.324
   49   2HG   PRO  11          1HG       PRO  11  -8.361   5.850 -22.805
   50   1HD   PRO  11          2HD       PRO  11  -6.948   3.642 -22.143
   51   2HD   PRO  11          1HD       PRO  11  -6.346   5.288 -21.853
   52    H    GLU  12           H        GLU  12  -8.933   2.732 -20.698
   53    HA   GLU  12           HA       GLU  12 -11.405   2.097 -19.311
   54   1HB   GLU  12          2HB       GLU  12 -11.335   0.157 -20.688
   55   2HB   GLU  12          1HB       GLU  12 -10.531   1.403 -21.643
   56   1HG   GLU  12          2HG       GLU  12  -8.362   0.514 -20.435
   57   2HG   GLU  12          1HG       GLU  12  -9.334  -0.939 -20.200
   58    H    ASP  13           H        ASP  13  -7.998   1.452 -18.766
   59    HA   ASP  13           HA       ASP  13  -8.463  -0.671 -16.802
   60   1HB   ASP  13          2HB       ASP  13  -6.144   0.905 -17.900
   61   2HB   ASP  13          1HB       ASP  13  -5.919  -0.070 -16.448
   62    H    LYS  14           H        LYS  14  -7.719   2.789 -16.814
   63    HA   LYS  14           HA       LYS  14  -7.531   2.971 -13.911
   64   1HB   LYS  14          2HB       LYS  14  -6.423   4.469 -15.648
   65   2HB   LYS  14          1HB       LYS  14  -8.019   5.156 -15.955
   66   1HG   LYS  14          2HG       LYS  14  -7.710   5.155 -13.151
   67   2HG   LYS  14          1HG       LYS  14  -6.181   5.744 -13.804
   68   1HD   LYS  14          2HD       LYS  14  -8.090   7.024 -15.369
   69   2HD   LYS  14          1HD       LYS  14  -8.796   7.047 -13.752
   70   1HE   LYS  14          2HE       LYS  14  -6.632   7.967 -12.870
   71   2HE   LYS  14          1HE       LYS  14  -6.051   8.079 -14.545
   72   1HZ   LYS  14          1HZ       LYS  14  -7.084  10.152 -13.932
   73   2HZ   LYS  14          2HZ       LYS  14  -8.496   9.353 -13.431
   74   3HZ   LYS  14          3HZ       LYS  14  -8.063   9.368 -15.074
   75    H    ALA  15           H        ALA  15 -10.028   3.009 -16.295
   76    HA   ALA  15           HA       ALA  15 -12.054   4.482 -14.867
   77   1HB   ALA  15          1HB       ALA  15 -12.054   2.340 -17.013
   78   2HB   ALA  15          2HB       ALA  15 -12.265   4.077 -17.229
   79   3HB   ALA  15          3HB       ALA  15 -13.535   3.123 -16.462
   80    H    LYS  16           H        LYS  16 -11.109   1.065 -14.994
   81    HA   LYS  16           HA       LYS  16 -13.223   0.174 -13.206
   82   1HB   LYS  16          2HB       LYS  16 -12.374  -1.905 -13.746
   83   2HB   LYS  16          1HB       LYS  16 -11.614  -0.988 -15.045
   84   1HG   LYS  16          2HG       LYS  16  -9.567  -0.772 -13.772
   85   2HG   LYS  16          1HG       LYS  16 -10.322  -1.517 -12.364
   86   1HD   LYS  16          2HD       LYS  16  -9.619  -3.517 -13.133
   87   2HD   LYS  16          1HD       LYS  16 -10.745  -3.327 -14.477
   88   1HE   LYS  16          2HE       LYS  16  -8.431  -1.725 -15.032
   89   2HE   LYS  16          1HE       LYS  16  -7.894  -3.359 -14.596
   90   1HZ   LYS  16          1HZ       LYS  16 -10.254  -3.088 -16.310
   91   2HZ   LYS  16          2HZ       LYS  16  -9.073  -4.309 -16.282
   92   3HZ   LYS  16          3HZ       LYS  16  -8.736  -2.814 -17.014
   93    H    TYR  17           H        TYR  17 -10.040   1.522 -12.901
   94    HA   TYR  17           HA       TYR  17  -9.573   0.703 -10.137
   95   1HB   TYR  17          2HB       TYR  17  -8.392   2.917 -11.856
   96   2HB   TYR  17          1HB       TYR  17  -7.692   2.295 -10.363
   97    HD1  TYR  17           HD1      TYR  17  -6.022   2.270 -12.717
   98    HD2  TYR  17           HD2      TYR  17  -8.983  -0.583 -11.480
   99    HE1  TYR  17           HE1      TYR  17  -4.836   0.501 -13.989
  100    HE2  TYR  17           HE2      TYR  17  -7.809  -2.353 -12.760
  101    HH   TYR  17           HH       TYR  17  -4.781  -1.658 -14.517
  102    H    ASP  18           H        ASP  18 -11.000   3.444 -11.829
  103    HA   ASP  18           HA       ASP  18 -11.186   5.194  -9.518
  104   1HB   ASP  18          2HB       ASP  18 -11.922   5.096 -12.351
  105   2HB   ASP  18          1HB       ASP  18 -13.122   5.937 -11.369
  106    H    ALA  19           H        ALA  19 -12.889   2.395 -10.478
  107    HA   ALA  19           HA       ALA  19 -15.422   3.176  -9.135
  108   1HB   ALA  19          1HB       ALA  19 -16.222   1.552 -10.511
  109   2HB   ALA  19          2HB       ALA  19 -15.103   0.371  -9.829
  110   3HB   ALA  19          3HB       ALA  19 -14.596   1.395 -11.174
  111    H    ILE  20           H        ILE  20 -12.525   1.300  -8.710
  112    HA   ILE  20           HA       ILE  20 -13.338   0.047  -6.189
  113    HB   ILE  20           HB       ILE  20 -10.883   0.283  -7.934
  114   1HG1  ILE  20          2HG1      ILE  20 -12.279  -2.200  -6.921
  115   2HG1  ILE  20          1HG1      ILE  20 -12.817  -1.351  -8.371
  116   1HG2  ILE  20          1HG2      ILE  20 -10.171   0.397  -5.569
  117   2HG2  ILE  20          2HG2      ILE  20  -9.644  -1.089  -6.357
  118   3HG2  ILE  20          3HG2      ILE  20 -11.022  -1.113  -5.257
  119   1HD1  ILE  20          1HD1      ILE  20 -10.090  -2.580  -7.883
  120   2HD1  ILE  20          2HD1      ILE  20 -10.462  -1.544  -9.263
  121   3HD1  ILE  20          3HD1      ILE  20 -11.290  -3.091  -9.071
  122    H    PHE  21           H        PHE  21 -11.397   2.757  -7.353
  123    HA   PHE  21           HA       PHE  21 -10.318   3.582  -4.816
  124   1HB   PHE  21          2HB       PHE  21  -9.148   4.491  -6.573
  125   2HB   PHE  21          1HB       PHE  21 -10.564   4.526  -7.617
  126    HD1  PHE  21           HD1      PHE  21  -8.354   6.472  -5.599
  127    HD2  PHE  21           HD2      PHE  21 -12.385   6.308  -7.073
  128    HE1  PHE  21           HE1      PHE  21  -8.603   8.902  -5.182
  129    HE2  PHE  21           HE2      PHE  21 -12.637   8.738  -6.653
  130    HZ   PHE  21           HZ       PHE  21 -10.749  10.036  -5.709
  131    H    ASP  22           H        ASP  22 -13.263   4.302  -6.610
  132    HA   ASP  22           HA       ASP  22 -14.155   6.311  -4.637
  133   1HB   ASP  22          2HB       ASP  22 -14.587   6.796  -6.935
  134   2HB   ASP  22          1HB       ASP  22 -15.201   5.167  -7.236
  135    H    SER  23           H        SER  23 -14.212   2.953  -4.871
  136    HA   SER  23           HA       SER  23 -16.910   2.550  -3.739
  137   1HB   SER  23          2HB       SER  23 -16.030   0.916  -5.285
  138   2HB   SER  23          1HB       SER  23 -14.529   0.782  -4.374
  139    HG   SER  23           HG       SER  23 -17.039   0.230  -3.205
  140    H    LEU  24           H        LEU  24 -13.930   3.523  -2.600
  141    HA   LEU  24           HA       LEU  24 -14.311   2.326   0.118
  142   1HB   LEU  24          2HB       LEU  24 -11.894   3.841  -0.846
  143   2HB   LEU  24          1HB       LEU  24 -11.973   2.530   0.327
  144    HG   LEU  24           HG       LEU  24 -12.757   1.959  -2.504
  145   1HD1  LEU  24          1HD1      LEU  24 -10.758   2.623  -3.288
  146   2HD1  LEU  24          2HD1      LEU  24 -10.047   1.325  -2.331
  147   3HD1  LEU  24          3HD1      LEU  24 -10.163   2.952  -1.662
  148   1HD2  LEU  24          1HD2      LEU  24 -11.045   0.314  -0.652
  149   2HD2  LEU  24          2HD2      LEU  24 -12.116  -0.236  -1.941
  150   3HD2  LEU  24          3HD2      LEU  24 -12.794   0.367  -0.428
  151    H    SER  25           H        SER  25 -14.530   5.145  -1.770
  152    HA   SER  25           HA       SER  25 -15.533   7.231  -1.110
  153   1HB   SER  25          2HB       SER  25 -16.035   5.975   1.085
  154   2HB   SER  25          1HB       SER  25 -14.551   6.706   1.686
  155    HG   SER  25           HG       SER  25 -16.436   8.314   0.382
  156    HA   PRO  26           HA       PRO  26 -11.327   8.767  -1.608
  157   1HB   PRO  26          2HB       PRO  26 -12.029  10.668  -3.431
  158   2HB   PRO  26          1HB       PRO  26 -11.775   8.966  -3.864
  159   1HG   PRO  26          2HG       PRO  26 -14.309  10.455  -3.467
  160   2HG   PRO  26          1HG       PRO  26 -13.923   9.170  -4.620
  161   1HD   PRO  26          2HD       PRO  26 -15.350   8.802  -2.289
  162   2HD   PRO  26          1HD       PRO  26 -14.469   7.520  -3.146
  163    H    VAL  27           H        VAL  27 -10.380  10.767  -0.931
  164    HA   VAL  27           HA       VAL  27 -12.263  12.637   0.468
  165    HB   VAL  27           HB       VAL  27  -9.498  11.628   1.219
  166   1HG1  VAL  27          1HG1      VAL  27 -10.042  14.072   1.783
  167   2HG1  VAL  27          2HG1      VAL  27  -9.592  13.038   3.138
  168   3HG1  VAL  27          3HG1      VAL  27 -11.287  13.435   2.858
  169   1HG2  VAL  27          1HG2      VAL  27 -11.890  10.372   1.541
  170   2HG2  VAL  27          2HG2      VAL  27 -11.847  11.344   3.012
  171   3HG2  VAL  27          3HG2      VAL  27 -10.547  10.202   2.672
  172    H    ASN  28           H        ASN  28 -12.294  14.317  -1.035
  173    HA   ASN  28           HA       ASN  28 -11.482  16.147  -2.282
  174   1HB   ASN  28          2HB       ASN  28 -10.509  16.816  -0.188
  175   2HB   ASN  28          1HB       ASN  28  -9.237  15.604  -0.320
  176   1HD2  ASN  28          1HD2      ASN  28  -7.304  16.278  -1.284
  177   2HD2  ASN  28          2HD2      ASN  28  -7.118  17.714  -2.171
  178    H    GLY  29           H        GLY  29 -10.748  13.179  -2.905
  179   1HA   GLY  29          2HA       GLY  29  -9.905  12.489  -5.078
  180   2HA   GLY  29          1HA       GLY  29  -8.813  13.874  -5.054
  181    H    PHE  30           H        PHE  30  -9.308  11.604  -2.375
  182    HA   PHE  30           HA       PHE  30  -6.712  10.307  -2.944
  183   1HB   PHE  30          2HB       PHE  30  -7.272  12.098  -0.571
  184   2HB   PHE  30          1HB       PHE  30  -5.867  11.030  -0.687
  185    HD1  PHE  30           HD1      PHE  30  -7.274  14.194  -1.634
  186    HD2  PHE  30           HD2      PHE  30  -4.354  11.244  -2.713
  187    HE1  PHE  30           HE1      PHE  30  -6.121  15.866  -3.040
  188    HE2  PHE  30           HE2      PHE  30  -3.180  12.924  -4.121
  189    HZ   PHE  30           HZ       PHE  30  -4.066  15.239  -4.286
  190    H    LEU  31           H        LEU  31  -6.466   8.343  -1.915
  191    HA   LEU  31           HA       LEU  31  -8.751   7.448  -0.177
  192   1HB   LEU  31          2HB       LEU  31  -7.026   6.085  -2.241
  193   2HB   LEU  31          1HB       LEU  31  -7.785   5.135  -0.970
  194    HG   LEU  31           HG       LEU  31  -9.138   6.805  -3.093
  195   1HD1  LEU  31          1HD1      LEU  31  -8.803   3.928  -2.398
  196   2HD1  LEU  31          2HD1      LEU  31  -8.898   4.695  -3.986
  197   3HD1  LEU  31          3HD1      LEU  31 -10.367   4.419  -3.052
  198   1HD2  LEU  31          1HD2      LEU  31 -11.271   6.060  -1.920
  199   2HD2  LEU  31          2HD2      LEU  31 -10.353   7.299  -1.066
  200   3HD2  LEU  31          3HD2      LEU  31 -10.267   5.619  -0.538
  201    H    SER  32           H        SER  32  -8.146   6.650   1.845
  202    HA   SER  32           HA       SER  32  -5.315   7.033   2.581
  203   1HB   SER  32          2HB       SER  32  -6.192   6.800   4.849
  204   2HB   SER  32          1HB       SER  32  -7.251   7.868   3.933
  205    HG   SER  32           HG       SER  32  -8.498   6.344   4.999
  206    H    GLY  33           H        GLY  33  -3.967   5.399   3.333
  207   1HA   GLY  33          2HA       GLY  33  -3.961   2.895   2.164
  208   2HA   GLY  33          1HA       GLY  33  -3.257   3.174   3.759
  209    H    ASP  34           H        ASP  34  -5.952   3.985   4.808
  210    HA   ASP  34           HA       ASP  34  -6.797   1.466   5.864
  211   1HB   ASP  34          2HB       ASP  34  -7.901   4.264   5.715
  212   2HB   ASP  34          1HB       ASP  34  -8.841   2.971   6.459
  213    H    LYS  35           H        LYS  35  -7.682   3.237   2.960
  214    HA   LYS  35           HA       LYS  35 -10.000   1.447   2.461
  215   1HB   LYS  35          2HB       LYS  35  -8.833   3.927   1.163
  216   2HB   LYS  35          1HB       LYS  35 -10.191   3.043   0.469
  217   1HG   LYS  35          2HG       LYS  35 -11.612   3.558   2.262
  218   2HG   LYS  35          1HG       LYS  35 -10.265   3.916   3.346
  219   1HD   LYS  35          2HD       LYS  35  -9.806   5.779   1.446
  220   2HD   LYS  35          1HD       LYS  35 -11.559   5.645   1.300
  221   1HE   LYS  35          2HE       LYS  35 -11.936   6.496   3.417
  222   2HE   LYS  35          1HE       LYS  35 -10.418   5.842   4.061
  223   1HZ   LYS  35          1HZ       LYS  35 -10.312   7.844   1.916
  224   2HZ   LYS  35          2HZ       LYS  35  -9.185   7.523   3.147
  225   3HZ   LYS  35          3HZ       LYS  35 -10.614   8.372   3.500
  226    H    VAL  36           H        VAL  36  -6.785   2.297   1.279
  227    HA   VAL  36           HA       VAL  36  -6.881   0.483  -1.015
  228    HB   VAL  36           HB       VAL  36  -4.628   1.901   0.426
  229   1HG1  VAL  36          1HG1      VAL  36  -4.767   0.705  -2.355
  230   2HG1  VAL  36          2HG1      VAL  36  -3.847   0.052  -0.996
  231   3HG1  VAL  36          3HG1      VAL  36  -3.407   1.611  -1.695
  232   1HG2  VAL  36          1HG2      VAL  36  -5.710   2.846  -2.179
  233   2HG2  VAL  36          2HG2      VAL  36  -5.101   3.775  -0.809
  234   3HG2  VAL  36          3HG2      VAL  36  -6.730   3.100  -0.761
  235    H    LYS  37           H        LYS  37  -5.418   0.448   2.239
  236    HA   LYS  37           HA       LYS  37  -3.818  -1.775   2.213
  237   1HB   LYS  37          2HB       LYS  37  -4.074  -0.601   4.241
  238   2HB   LYS  37          1HB       LYS  37  -5.830  -0.741   4.204
  239   1HG   LYS  37          2HG       LYS  37  -5.816  -2.877   5.058
  240   2HG   LYS  37          1HG       LYS  37  -4.283  -3.285   4.289
  241   1HD   LYS  37          2HD       LYS  37  -3.206  -2.857   6.215
  242   2HD   LYS  37          1HD       LYS  37  -3.785  -1.191   6.166
  243   1HE   LYS  37          2HE       LYS  37  -6.044  -2.468   7.014
  244   2HE   LYS  37          1HE       LYS  37  -4.790  -3.481   7.755
  245   1HZ   LYS  37          1HZ       LYS  37  -4.848  -0.513   7.870
  246   2HZ   LYS  37          2HZ       LYS  37  -3.731  -1.532   8.644
  247   3HZ   LYS  37          3HZ       LYS  37  -5.361  -1.529   9.128
  248    HA   PRO  38           HA       PRO  38  -7.539  -4.788   2.704
  249   1HB   PRO  38          2HB       PRO  38 -10.027  -3.780   2.144
  250   2HB   PRO  38          1HB       PRO  38  -9.331  -3.786   3.778
  251   1HG   PRO  38          2HG       PRO  38  -9.448  -1.568   1.780
  252   2HG   PRO  38          1HG       PRO  38  -9.743  -1.526   3.527
  253   1HD   PRO  38          2HD       PRO  38  -7.422  -0.694   2.458
  254   2HD   PRO  38          1HD       PRO  38  -7.497  -1.493   4.044
  255    H    VAL  39           H        VAL  39  -7.844  -2.214   0.309
  256    HA   VAL  39           HA       VAL  39  -8.976  -3.681  -1.848
  257    HB   VAL  39           HB       VAL  39  -7.219  -1.271  -1.477
  258   1HG1  VAL  39          1HG1      VAL  39  -7.001  -0.833  -3.757
  259   2HG1  VAL  39          2HG1      VAL  39  -8.276  -1.967  -4.201
  260   3HG1  VAL  39          3HG1      VAL  39  -6.697  -2.564  -3.698
  261   1HG2  VAL  39          1HG2      VAL  39  -9.741  -1.119  -2.979
  262   2HG2  VAL  39          2HG2      VAL  39  -9.179  -0.148  -1.619
  263   3HG2  VAL  39          3HG2      VAL  39  -9.924  -1.719  -1.331
  264    H    LEU  40           H        LEU  40  -5.639  -3.416  -0.683
  265    HA   LEU  40           HA       LEU  40  -4.586  -4.987  -2.954
  266   1HB   LEU  40          2HB       LEU  40  -3.212  -4.095  -0.409
  267   2HB   LEU  40          1HB       LEU  40  -2.464  -4.458  -1.961
  268    HG   LEU  40           HG       LEU  40  -4.460  -2.222  -1.560
  269   1HD1  LEU  40          1HD1      LEU  40  -2.676  -1.397  -0.330
  270   2HD1  LEU  40          2HD1      LEU  40  -2.188  -0.897  -1.950
  271   3HD1  LEU  40          3HD1      LEU  40  -1.486  -2.343  -1.225
  272   1HD2  LEU  40          1HD2      LEU  40  -2.427  -2.578  -3.762
  273   2HD2  LEU  40          2HD2      LEU  40  -3.875  -1.571  -3.763
  274   3HD2  LEU  40          3HD2      LEU  40  -4.020  -3.329  -3.856
  275    H    LEU  41           H        LEU  41  -5.556  -5.440   0.390
  276    HA   LEU  41           HA       LEU  41  -4.235  -7.986   0.795
  277   1HB   LEU  41          2HB       LEU  41  -6.564  -6.530   2.074
  278   2HB   LEU  41          1HB       LEU  41  -5.940  -8.062   2.689
  279    HG   LEU  41           HG       LEU  41  -4.145  -5.680   2.230
  280   1HD1  LEU  41          1HD1      LEU  41  -5.867  -6.389   4.603
  281   2HD1  LEU  41          2HD1      LEU  41  -5.676  -4.824   3.814
  282   3HD1  LEU  41          3HD1      LEU  41  -4.371  -5.477   4.803
  283   1HD2  LEU  41          1HD2      LEU  41  -3.460  -7.461   4.394
  284   2HD2  LEU  41          2HD2      LEU  41  -2.546  -7.117   2.922
  285   3HD2  LEU  41          3HD2      LEU  41  -3.760  -8.401   2.930
  286    H    ASN  42           H        ASN  42  -6.925  -6.968  -1.043
  287    HA   ASN  42           HA       ASN  42  -8.355  -9.527  -0.839
  288   1HB   ASN  42          2HB       ASN  42  -8.706  -6.986  -2.452
  289   2HB   ASN  42          1HB       ASN  42  -9.812  -8.357  -2.565
  290   1HD2  ASN  42          1HD2      ASN  42 -11.063  -6.142  -1.683
  291   2HD2  ASN  42          2HD2      ASN  42 -11.294  -6.160  -0.002
  292    H    SER  43           H        SER  43  -5.663  -8.422  -2.488
  293    HA   SER  43           HA       SER  43  -6.145  -9.789  -5.049
  294   1HB   SER  43          2HB       SER  43  -3.512  -8.775  -4.022
  295   2HB   SER  43          1HB       SER  43  -4.155  -8.718  -5.661
  296    HG   SER  43           HG       SER  43  -5.616  -7.149  -4.985
  297    H    LYS  44           H        LYS  44  -5.643 -11.014  -2.077
  298    HA   LYS  44           HA       LYS  44  -4.766 -13.072  -1.304
  299   1HB   LYS  44          2HB       LYS  44  -5.598 -13.355  -3.961
  300   2HB   LYS  44          1HB       LYS  44  -3.981 -14.058  -3.937
  301   1HG   LYS  44          2HG       LYS  44  -5.301 -14.926  -1.573
  302   2HG   LYS  44          1HG       LYS  44  -6.422 -15.169  -2.912
  303   1HD   LYS  44          2HD       LYS  44  -5.219 -17.140  -3.056
  304   2HD   LYS  44          1HD       LYS  44  -4.236 -16.116  -4.104
  305   1HE   LYS  44          2HE       LYS  44  -2.462 -16.306  -2.706
  306   2HE   LYS  44          1HE       LYS  44  -3.446 -15.794  -1.321
  307   1HZ   LYS  44          1HZ       LYS  44  -2.693 -18.091  -1.065
  308   2HZ   LYS  44          2HZ       LYS  44  -3.451 -18.513  -2.525
  309   3HZ   LYS  44          3HZ       LYS  44  -4.382 -18.012  -1.194
  310    H    LEU  45           H        LEU  45  -3.017 -10.637  -2.393
  311    HA   LEU  45           HA       LEU  45  -0.409 -12.029  -2.713
  312   1HB   LEU  45          2HB       LEU  45  -1.540  -9.278  -3.125
  313   2HB   LEU  45          1HB       LEU  45   0.206  -9.468  -2.956
  314    HG   LEU  45           HG       LEU  45  -1.505 -10.992  -4.940
  315   1HD1  LEU  45          1HD1      LEU  45  -0.909  -9.447  -6.572
  316   2HD1  LEU  45          2HD1      LEU  45   0.523  -8.925  -5.695
  317   3HD1  LEU  45          3HD1      LEU  45  -1.069  -8.388  -5.172
  318   1HD2  LEU  45          1HD2      LEU  45   1.421 -10.728  -5.291
  319   2HD2  LEU  45          2HD2      LEU  45   0.385 -12.137  -5.516
  320   3HD2  LEU  45          3HD2      LEU  45   0.934 -11.695  -3.898
  321    HA   PRO  46           HA       PRO  46   0.750 -11.280   1.436
  322   1HB   PRO  46          2HB       PRO  46   3.459 -11.005   1.155
  323   2HB   PRO  46          1HB       PRO  46   2.624 -12.564   1.021
  324   1HG   PRO  46          2HG       PRO  46   3.666 -10.789  -1.110
  325   2HG   PRO  46          1HG       PRO  46   3.614 -12.555  -1.033
  326   1HD   PRO  46          2HD       PRO  46   1.858 -11.020  -2.477
  327   2HD   PRO  46          1HD       PRO  46   1.509 -12.659  -1.891
  328    H    VAL  47           H        VAL  47   1.894  -9.575   2.806
  329    HA   VAL  47           HA       VAL  47   1.087  -6.937   2.067
  330    HB   VAL  47           HB       VAL  47   2.256  -8.433   4.276
  331   1HG1  VAL  47          1HG1      VAL  47   3.371  -5.669   3.751
  332   2HG1  VAL  47          2HG1      VAL  47   4.270  -7.158   4.041
  333   3HG1  VAL  47          3HG1      VAL  47   3.356  -6.411   5.352
  334   1HG2  VAL  47          1HG2      VAL  47   0.983  -5.721   4.473
  335   2HG2  VAL  47          2HG2      VAL  47   0.806  -7.113   5.541
  336   3HG2  VAL  47          3HG2      VAL  47   0.026  -7.111   3.960
  337    H    ASP  48           H        ASP  48   3.771  -8.802   1.117
  338    HA   ASP  48           HA       ASP  48   5.724  -6.675   0.929
  339   1HB   ASP  48          2HB       ASP  48   5.455  -9.451  -0.256
  340   2HB   ASP  48          1HB       ASP  48   6.888  -8.445  -0.472
  341    H    ILE  49           H        ILE  49   3.227  -8.046  -1.120
  342    HA   ILE  49           HA       ILE  49   4.118  -6.569  -3.497
  343    HB   ILE  49           HB       ILE  49   1.455  -7.910  -3.027
  344   1HG1  ILE  49          2HG1      ILE  49   3.129  -9.502  -2.274
  345   2HG1  ILE  49          1HG1      ILE  49   2.552 -10.003  -3.864
  346   1HG2  ILE  49          1HG2      ILE  49   2.985  -6.853  -5.285
  347   2HG2  ILE  49          2HG2      ILE  49   1.263  -7.214  -5.163
  348   3HG2  ILE  49          3HG2      ILE  49   2.408  -8.497  -5.557
  349   1HD1  ILE  49          1HD1      ILE  49   5.032  -8.325  -3.441
  350   2HD1  ILE  49          2HD1      ILE  49   4.499  -9.087  -4.944
  351   3HD1  ILE  49          3HD1      ILE  49   5.055 -10.083  -3.598
  352    H    LEU  50           H        LEU  50   1.620  -6.438  -1.043
  353    HA   LEU  50           HA       LEU  50   0.273  -4.094  -2.138
  354   1HB   LEU  50          2HB       LEU  50   0.160  -5.153   0.679
  355   2HB   LEU  50          1HB       LEU  50  -1.126  -4.393  -0.252
  356    HG   LEU  50           HG       LEU  50   0.048  -7.153  -0.671
  357   1HD1  LEU  50          1HD1      LEU  50  -1.560  -7.141   1.094
  358   2HD1  LEU  50          2HD1      LEU  50  -2.382  -7.777  -0.333
  359   3HD1  LEU  50          3HD1      LEU  50  -2.655  -6.109   0.172
  360   1HD2  LEU  50          1HD2      LEU  50  -2.282  -6.332  -2.278
  361   2HD2  LEU  50          2HD2      LEU  50  -0.862  -7.261  -2.754
  362   3HD2  LEU  50          3HD2      LEU  50  -0.787  -5.502  -2.700
  363    H    GLY  51           H        GLY  51   2.862  -4.780   0.110
  364   1HA   GLY  51          2HA       GLY  51   2.859  -2.070   1.251
  365   2HA   GLY  51          1HA       GLY  51   4.068  -3.321   1.557
  366    H    ARG  52           H        ARG  52   4.211  -3.805  -1.378
  367    HA   ARG  52           HA       ARG  52   6.166  -1.672  -2.026
  368   1HB   ARG  52          2HB       ARG  52   6.885  -4.006  -1.941
  369   2HB   ARG  52          1HB       ARG  52   5.612  -4.459  -3.072
  370   1HG   ARG  52          2HG       ARG  52   6.725  -2.714  -4.656
  371   2HG   ARG  52          1HG       ARG  52   8.122  -2.884  -3.594
  372   1HD   ARG  52          2HD       ARG  52   8.653  -4.872  -4.508
  373   2HD   ARG  52          1HD       ARG  52   7.024  -5.495  -4.201
  374    HE   ARG  52           HE       ARG  52   7.893  -4.922  -6.736
  375   1HH1  ARG  52          1HH2      ARG  52   5.223  -4.023  -4.743
  376   2HH1  ARG  52          2HH2      ARG  52   4.366  -3.260  -6.023
  377   1HH2  ARG  52          2HH1      ARG  52   6.811  -3.813  -8.385
  378   2HH2  ARG  52          1HH1      ARG  52   5.246  -3.157  -8.068
  379    H    VAL  53           H        VAL  53   3.092  -3.095  -3.084
  380    HA   VAL  53           HA       VAL  53   3.185  -1.823  -5.729
  381    HB   VAL  53           HB       VAL  53   1.102  -3.207  -4.029
  382   1HG1  VAL  53          1HG1      VAL  53  -0.572  -2.196  -5.139
  383   2HG1  VAL  53          2HG1      VAL  53   0.100  -2.787  -6.658
  384   3HG1  VAL  53          3HG1      VAL  53   0.589  -1.214  -6.032
  385   1HG2  VAL  53          1HG2      VAL  53   2.946  -4.363  -5.451
  386   2HG2  VAL  53          2HG2      VAL  53   1.989  -3.853  -6.848
  387   3HG2  VAL  53          3HG2      VAL  53   1.286  -4.930  -5.638
  388    H    TRP  54           H        TRP  54   1.679  -1.148  -2.576
  389    HA   TRP  54           HA       TRP  54   0.284   1.228  -3.242
  390   1HB   TRP  54          2HB       TRP  54  -0.060   0.366  -1.078
  391   2HB   TRP  54          1HB       TRP  54   1.664   0.126  -0.797
  392    HD1  TRP  54           HD1      TRP  54   3.147   2.442  -0.548
  393    HE1  TRP  54           HE1      TRP  54   2.500   4.668   0.545
  394    HE3  TRP  54           HE3      TRP  54  -1.922   1.930  -0.504
  395    HZ2  TRP  54           HZ2      TRP  54   0.123   6.049   1.367
  396    HZ3  TRP  54           HZ3      TRP  54  -3.357   3.724   0.459
  397    HH2  TRP  54           HH2      TRP  54  -2.341   5.756   1.383
  398    H    GLU  55           H        GLU  55   3.646   0.769  -2.099
  399    HA   GLU  55           HA       GLU  55   4.479   3.452  -2.103
  400   1HB   GLU  55          2HB       GLU  55   5.969   0.923  -2.857
  401   2HB   GLU  55          1HB       GLU  55   6.726   2.441  -2.367
  402   1HG   GLU  55          2HG       GLU  55   4.642   1.356  -0.553
  403   2HG   GLU  55          1HG       GLU  55   6.165   0.470  -0.617
  404    H    LEU  56           H        LEU  56   4.843   1.106  -4.788
  405    HA   LEU  56           HA       LEU  56   5.772   3.011  -6.707
  406   1HB   LEU  56          2HB       LEU  56   4.129   0.483  -7.086
  407   2HB   LEU  56          1HB       LEU  56   5.122   1.256  -8.319
  408    HG   LEU  56           HG       LEU  56   6.413   0.492  -5.730
  409   1HD1  LEU  56          1HD1      LEU  56   5.932  -1.446  -7.979
  410   2HD1  LEU  56          2HD1      LEU  56   5.035  -1.454  -6.459
  411   3HD1  LEU  56          3HD1      LEU  56   6.775  -1.753  -6.462
  412   1HD2  LEU  56          1HD2      LEU  56   8.056  -0.219  -7.819
  413   2HD2  LEU  56          2HD2      LEU  56   8.084   1.368  -7.050
  414   3HD2  LEU  56          3HD2      LEU  56   7.153   1.115  -8.524
  415    H    SER  57           H        SER  57   2.706   2.497  -5.263
  416    HA   SER  57           HA       SER  57   1.166   3.784  -7.447
  417   1HB   SER  57          2HB       SER  57   0.369   2.723  -4.721
  418   2HB   SER  57          1HB       SER  57  -0.730   3.166  -6.020
  419    HG   SER  57           HG       SER  57   1.283   1.388  -6.693
  420    H    ASP  58           H        ASP  58   2.170   4.379  -4.077
  421    HA   ASP  58           HA       ASP  58   0.744   6.805  -3.642
  422   1HB   ASP  58          2HB       ASP  58   2.379   5.144  -2.231
  423   2HB   ASP  58          1HB       ASP  58   3.463   6.510  -2.493
  424    H    ILE  59           H        ILE  59   0.891   8.316  -5.336
  425    HA   ILE  59           HA       ILE  59   3.481   8.980  -6.552
  426    HB   ILE  59           HB       ILE  59   0.689  10.148  -6.764
  427   1HG1  ILE  59          2HG1      ILE  59   0.778   7.841  -7.544
  428   2HG1  ILE  59          1HG1      ILE  59   0.705   8.904  -8.948
  429   1HG2  ILE  59          1HG2      ILE  59   3.078  10.537  -8.588
  430   2HG2  ILE  59          2HG2      ILE  59   2.537  11.719  -7.396
  431   3HG2  ILE  59          3HG2      ILE  59   1.491  11.289  -8.750
  432   1HD1  ILE  59          1HD1      ILE  59   3.100   7.434  -7.844
  433   2HD1  ILE  59          2HD1      ILE  59   3.276   8.796  -8.950
  434   3HD1  ILE  59          3HD1      ILE  59   2.414   7.344  -9.467
  435    H    ASP  60           H        ASP  60   1.530  10.137  -3.907
  436    HA   ASP  60           HA       ASP  60   3.083  12.690  -3.788
  437   1HB   ASP  60          2HB       ASP  60   0.652  11.811  -2.206
  438   2HB   ASP  60          1HB       ASP  60   1.256  13.456  -2.409
  439    H    HIS  61           H        HIS  61   2.790   9.588  -2.302
  440    HA   HIS  61           HA       HIS  61   3.919   8.649  -0.444
  441   1HB   HIS  61          2HB       HIS  61   5.518  11.220  -0.511
  442   2HB   HIS  61          1HB       HIS  61   6.061   9.626   0.009
  443    HD1  HIS  61           HD1      HIS  61   7.293  11.398  -2.396
  444    HD2  HIS  61           HD2      HIS  61   4.779   8.095  -2.779
  445    HE1  HIS  61           HE1      HIS  61   7.678  10.472  -4.722
  446    H    ASP  62           H        ASP  62   1.523  10.087   0.105
  447    HA   ASP  62           HA       ASP  62   2.185  11.546   2.639
  448   1HB   ASP  62          2HB       ASP  62  -0.128  12.502   2.260
  449   2HB   ASP  62          1HB       ASP  62   1.034  12.894   0.992
  450    H    GLY  63           H        GLY  63   0.981   8.604   1.461
  451   1HA   GLY  63          2HA       GLY  63   0.394   6.812   3.009
  452   2HA   GLY  63          1HA       GLY  63  -0.227   8.030   4.122
  453    H    MET  64           H        MET  64  -1.008   8.313   0.746
  454    HA   MET  64           HA       MET  64  -3.660   7.009   1.087
  455   1HB   MET  64          2HB       MET  64  -3.316   9.909   0.240
  456   2HB   MET  64          1HB       MET  64  -4.836   9.046   0.410
  457   1HG   MET  64          2HG       MET  64  -3.291   8.933   2.870
  458   2HG   MET  64          1HG       MET  64  -3.568  10.590   2.364
  459   1HE   MET  64          1HE       MET  64  -5.740  11.112   1.148
  460   2HE   MET  64          2HE       MET  64  -7.322  10.796   1.854
  461   3HE   MET  64          3HE       MET  64  -6.628   9.646   0.714
  462    H    LEU  65           H        LEU  65  -4.767   6.810  -1.057
  463    HA   LEU  65           HA       LEU  65  -2.834   6.995  -3.350
  464   1HB   LEU  65          2HB       LEU  65  -4.633   4.866  -2.304
  465   2HB   LEU  65          1HB       LEU  65  -4.556   5.019  -4.058
  466    HG   LEU  65           HG       LEU  65  -2.242   4.552  -2.160
  467   1HD1  LEU  65          1HD1      LEU  65  -2.884   2.896  -4.571
  468   2HD1  LEU  65          2HD1      LEU  65  -3.887   2.699  -3.133
  469   3HD1  LEU  65          3HD1      LEU  65  -2.148   2.410  -3.044
  470   1HD2  LEU  65          1HD2      LEU  65  -1.081   4.375  -4.555
  471   2HD2  LEU  65          2HD2      LEU  65  -1.207   5.922  -3.715
  472   3HD2  LEU  65          3HD2      LEU  65  -2.354   5.517  -4.992
  473    H    ASP  66           H        ASP  66  -3.581   8.778  -4.523
  474    HA   ASP  66           HA       ASP  66  -6.355   9.593  -4.621
  475   1HB   ASP  66          2HB       ASP  66  -4.321  11.024  -4.988
  476   2HB   ASP  66          1HB       ASP  66  -4.070  10.191  -6.517
  477    H    ARG  67           H        ARG  67  -7.523   9.737  -6.774
  478    HA   ARG  67           HA       ARG  67  -8.163   7.224  -7.852
  479   1HB   ARG  67          2HB       ARG  67  -9.147   8.558  -9.699
  480   2HB   ARG  67          1HB       ARG  67  -9.472   9.291  -8.129
  481   1HG   ARG  67          2HG       ARG  67  -7.470  10.767  -8.475
  482   2HG   ARG  67          1HG       ARG  67  -7.332  10.113 -10.108
  483   1HD   ARG  67          2HD       ARG  67  -9.299  11.150 -10.835
  484   2HD   ARG  67          1HD       ARG  67  -9.964  11.260  -9.193
  485    HE   ARG  67           HE       ARG  67  -7.491  12.794  -9.802
  486   1HH1  ARG  67          1HH2      ARG  67  -9.888  14.071 -11.060
  487   2HH1  ARG  67          2HH2      ARG  67 -10.448  15.119  -9.800
  488   1HH2  ARG  67          2HH1      ARG  67  -8.622  13.535  -7.312
  489   2HH2  ARG  67          1HH1      ARG  67  -9.730  14.815  -7.678
  490    H    ASP  68           H        ASP  68  -5.679   9.519  -8.918
  491    HA   ASP  68           HA       ASP  68  -4.905   7.908 -11.234
  492   1HB   ASP  68          2HB       ASP  68  -3.694  10.267  -9.758
  493   2HB   ASP  68          1HB       ASP  68  -3.023   9.605 -11.249
  494    H    GLU  69           H        GLU  69  -3.851   8.302  -7.889
  495    HA   GLU  69           HA       GLU  69  -1.421   6.707  -8.205
  496   1HB   GLU  69          2HB       GLU  69  -3.030   7.451  -5.737
  497   2HB   GLU  69          1HB       GLU  69  -1.333   6.964  -5.774
  498   1HG   GLU  69          2HG       GLU  69  -0.798   8.932  -7.159
  499   2HG   GLU  69          1HG       GLU  69  -2.489   9.424  -7.110
  500    H    PHE  70           H        PHE  70  -4.720   6.177  -6.986
  501    HA   PHE  70           HA       PHE  70  -4.400   3.476  -6.121
  502   1HB   PHE  70          2HB       PHE  70  -6.306   5.226  -5.847
  503   2HB   PHE  70          1HB       PHE  70  -6.874   4.635  -7.408
  504    HD1  PHE  70           HD1      PHE  70  -6.822   4.055  -3.868
  505    HD2  PHE  70           HD2      PHE  70  -7.213   2.092  -7.669
  506    HE1  PHE  70           HE1      PHE  70  -7.879   2.107  -2.754
  507    HE2  PHE  70           HE2      PHE  70  -8.265   0.145  -6.557
  508    HZ   PHE  70           HZ       PHE  70  -8.601   0.154  -4.101
  509    H    ALA  71           H        ALA  71  -4.723   4.934  -9.291
  510    HA   ALA  71           HA       ALA  71  -5.548   2.566 -10.732
  511   1HB   ALA  71          1HB       ALA  71  -5.229   3.955 -12.608
  512   2HB   ALA  71          2HB       ALA  71  -3.875   4.802 -11.861
  513   3HB   ALA  71          3HB       ALA  71  -5.523   5.124 -11.323
  514    H    VAL  72           H        VAL  72  -2.385   4.112 -10.195
  515    HA   VAL  72           HA       VAL  72  -0.807   2.240 -11.639
  516    HB   VAL  72           HB       VAL  72  -0.199   3.937  -9.200
  517   1HG1  VAL  72          1HG1      VAL  72   1.568   2.334  -9.430
  518   2HG1  VAL  72          2HG1      VAL  72   2.160   3.828 -10.158
  519   3HG1  VAL  72          3HG1      VAL  72   1.588   2.512 -11.184
  520   1HG2  VAL  72          1HG2      VAL  72   0.296   4.502 -12.138
  521   2HG2  VAL  72          2HG2      VAL  72   0.528   5.615 -10.787
  522   3HG2  VAL  72          3HG2      VAL  72  -1.100   5.112 -11.249
  523    H    ALA  73           H        ALA  73  -2.300   2.078  -8.517
  524    HA   ALA  73           HA       ALA  73  -0.676  -0.219  -7.611
  525   1HB   ALA  73          1HB       ALA  73  -1.989   1.888  -6.418
  526   2HB   ALA  73          2HB       ALA  73  -1.426   0.447  -5.572
  527   3HB   ALA  73          3HB       ALA  73  -3.097   0.547  -6.126
  528    H    MET  74           H        MET  74  -3.327   0.161  -9.649
  529    HA   MET  74           HA       MET  74  -4.776  -2.245  -8.716
  530   1HB   MET  74          2HB       MET  74  -5.100  -0.133 -10.841
  531   2HB   MET  74          1HB       MET  74  -6.063  -1.609 -10.906
  532   1HG   MET  74          2HG       MET  74  -5.897  -0.021  -8.360
  533   2HG   MET  74          1HG       MET  74  -7.028   0.447  -9.632
  534   1HE   MET  74          1HE       MET  74  -6.132  -1.179  -6.851
  535   2HE   MET  74          2HE       MET  74  -6.552  -2.889  -6.898
  536   3HE   MET  74          3HE       MET  74  -7.714  -1.720  -6.276
  537    H    PHE  75           H        PHE  75  -2.923  -1.192 -11.577
  538    HA   PHE  75           HA       PHE  75  -3.000  -3.874 -12.732
  539   1HB   PHE  75          2HB       PHE  75  -1.846  -2.858 -14.528
  540   2HB   PHE  75          1HB       PHE  75  -2.856  -1.568 -13.884
  541    HD1  PHE  75           HD1      PHE  75   0.579  -3.035 -13.461
  542    HD2  PHE  75           HD2      PHE  75  -1.900   0.471 -13.379
  543    HE1  PHE  75           HE1      PHE  75   2.587  -1.617 -13.123
  544    HE2  PHE  75           HE2      PHE  75   0.101   1.878 -13.053
  545    HZ   PHE  75           HZ       PHE  75   2.344   0.842 -12.915
  546    H    LEU  76           H        LEU  76  -1.134  -2.184 -10.403
  547    HA   LEU  76           HA       LEU  76   1.305  -3.789 -10.617
  548   1HB   LEU  76          2HB       LEU  76   0.114  -1.674  -8.884
  549   2HB   LEU  76          1HB       LEU  76   1.351  -2.692  -8.149
  550    HG   LEU  76           HG       LEU  76   1.635  -1.092 -10.708
  551   1HD1  LEU  76          1HD1      LEU  76   2.959   0.394  -9.503
  552   2HD1  LEU  76          2HD1      LEU  76   3.348  -0.798  -8.263
  553   3HD1  LEU  76          3HD1      LEU  76   1.757  -0.039  -8.287
  554   1HD2  LEU  76          1HD2      LEU  76   3.106  -3.383  -9.619
  555   2HD2  LEU  76          2HD2      LEU  76   4.140  -1.987  -9.922
  556   3HD2  LEU  76          3HD2      LEU  76   3.177  -2.670 -11.231
  557    H    VAL  77           H        VAL  77  -1.799  -3.947  -9.053
  558    HA   VAL  77           HA       VAL  77  -1.022  -6.188  -7.280
  559    HB   VAL  77           HB       VAL  77  -3.565  -4.594  -7.792
  560   1HG1  VAL  77          1HG1      VAL  77  -3.161  -7.153  -6.459
  561   2HG1  VAL  77          2HG1      VAL  77  -4.667  -6.300  -6.800
  562   3HG1  VAL  77          3HG1      VAL  77  -3.757  -5.932  -5.336
  563   1HG2  VAL  77          1HG2      VAL  77  -1.631  -3.471  -6.621
  564   2HG2  VAL  77          2HG2      VAL  77  -1.752  -4.699  -5.361
  565   3HG2  VAL  77          3HG2      VAL  77  -3.093  -3.589  -5.642
  566    H    TYR  78           H        TYR  78  -3.367  -5.532  -9.893
  567    HA   TYR  78           HA       TYR  78  -4.397  -8.147 -10.183
  568   1HB   TYR  78          2HB       TYR  78  -4.235  -5.625 -11.697
  569   2HB   TYR  78          1HB       TYR  78  -4.494  -7.055 -12.697
  570    HD1  TYR  78           HD1      TYR  78  -6.317  -4.560 -11.486
  571    HD2  TYR  78           HD2      TYR  78  -6.057  -8.819 -10.986
  572    HE1  TYR  78           HE1      TYR  78  -8.697  -4.623 -10.794
  573    HE2  TYR  78           HE2      TYR  78  -8.439  -8.883 -10.293
  574    HH   TYR  78           HH       TYR  78 -10.276  -5.924  -9.771
  575    H    CYS  79           H        CYS  79  -1.445  -6.718 -11.547
  576    HA   CYS  79           HA       CYS  79  -0.944  -8.956 -13.348
  577   1HB   CYS  79          2HB       CYS  79   0.601  -6.557 -12.337
  578   2HB   CYS  79          1HB       CYS  79   1.337  -7.739 -13.420
  579    HG   CYS  79           HG       CYS  79   0.180  -6.602 -15.279
  580    H    ALA  80           H        ALA  80  -0.523  -8.380 -10.000
  581    HA   ALA  80           HA       ALA  80   1.729 -10.260  -9.716
  582   1HB   ALA  80          1HB       ALA  80   1.772  -8.420  -8.232
  583   2HB   ALA  80          2HB       ALA  80   1.147  -9.733  -7.235
  584   3HB   ALA  80          3HB       ALA  80   0.044  -8.533  -7.908
  585    H    LEU  81           H        LEU  81  -1.652 -10.401  -9.979
  586    HA   LEU  81           HA       LEU  81  -1.985 -12.789  -8.264
  587   1HB   LEU  81          2HB       LEU  81  -3.939 -11.437 -10.148
  588   2HB   LEU  81          1HB       LEU  81  -4.326 -12.480  -8.779
  589    HG   LEU  81           HG       LEU  81  -3.311  -9.653  -8.773
  590   1HD1  LEU  81          1HD1      LEU  81  -5.077  -9.967  -6.716
  591   2HD1  LEU  81          2HD1      LEU  81  -5.666 -11.179  -7.856
  592   3HD1  LEU  81          3HD1      LEU  81  -5.540  -9.490  -8.351
  593   1HD2  LEU  81          1HD2      LEU  81  -3.095 -11.651  -6.501
  594   2HD2  LEU  81          2HD2      LEU  81  -2.797  -9.918  -6.360
  595   3HD2  LEU  81          3HD2      LEU  81  -1.740 -10.919  -7.361
  596    H    GLU  82           H        GLU  82  -2.099 -11.896 -11.700
  597    HA   GLU  82           HA       GLU  82  -2.760 -14.541 -12.634
  598   1HB   GLU  82          2HB       GLU  82  -1.820 -11.934 -13.734
  599   2HB   GLU  82          1HB       GLU  82  -1.613 -13.356 -14.758
  600   1HG   GLU  82          2HG       GLU  82  -4.251 -12.846 -13.404
  601   2HG   GLU  82          1HG       GLU  82  -3.852 -12.013 -14.905
  602    H    LYS  83           H        LYS  83   0.305 -12.718 -12.602
  603    HA   LYS  83           HA       LYS  83   1.933 -14.911 -11.794
  604   1HB   LYS  83          2HB       LYS  83   1.279 -16.048 -13.777
  605   2HB   LYS  83          1HB       LYS  83   1.431 -14.588 -14.756
  606   1HG   LYS  83          2HG       LYS  83   3.900 -15.397 -13.350
  607   2HG   LYS  83          1HG       LYS  83   3.352 -16.526 -14.591
  608   1HD   LYS  83          2HD       LYS  83   3.013 -14.064 -15.809
  609   2HD   LYS  83          1HD       LYS  83   4.498 -13.843 -14.884
  610   1HE   LYS  83          2HE       LYS  83   5.426 -14.799 -16.775
  611   2HE   LYS  83          1HE       LYS  83   4.986 -16.297 -15.933
  612   1HZ   LYS  83          1HZ       LYS  83   2.958 -16.423 -17.089
  613   2HZ   LYS  83          2HZ       LYS  83   4.116 -16.057 -18.278
  614   3HZ   LYS  83          3HZ       LYS  83   3.090 -14.840 -17.682
  615    H    GLU  84           H        GLU  84   1.638 -11.878 -13.525
  616    HA   GLU  84           HA       GLU  84   4.363 -11.253 -13.977
  617   1HB   GLU  84          2HB       GLU  84   1.920 -10.092 -14.362
  618   2HB   GLU  84          1HB       GLU  84   2.588  -9.066 -13.092
  619   1HG   GLU  84          2HG       GLU  84   4.382  -8.367 -14.409
  620   2HG   GLU  84          1HG       GLU  84   4.298  -9.787 -15.453
  621    HA   PRO  85           HA       PRO  85   5.733 -10.752  -9.782
  622   1HB   PRO  85          2HB       PRO  85   8.271  -9.936 -10.389
  623   2HB   PRO  85          1HB       PRO  85   7.753 -11.630 -10.502
  624   1HG   PRO  85          2HG       PRO  85   8.153  -9.628 -12.650
  625   2HG   PRO  85          1HG       PRO  85   8.420 -11.377 -12.667
  626   1HD   PRO  85          2HD       PRO  85   6.234 -10.095 -13.776
  627   2HD   PRO  85          1HD       PRO  85   6.290 -11.812 -13.321
  628    H    VAL  86           H        VAL  86   6.030  -8.933  -8.391
  629    HA   VAL  86           HA       VAL  86   5.490  -6.292  -9.655
  630    HB   VAL  86           HB       VAL  86   5.560  -6.759  -6.700
  631   1HG1  VAL  86          1HG1      VAL  86   3.110  -5.725  -7.905
  632   2HG1  VAL  86          2HG1      VAL  86   4.522  -4.805  -8.402
  633   3HG1  VAL  86          3HG1      VAL  86   4.148  -4.993  -6.690
  634   1HG2  VAL  86          1HG2      VAL  86   3.855  -8.303  -8.594
  635   2HG2  VAL  86          2HG2      VAL  86   3.069  -7.652  -7.156
  636   3HG2  VAL  86          3HG2      VAL  86   4.441  -8.746  -6.990
  637    HA   PRO  87           HA       PRO  87   9.842  -5.636  -8.655
  638   1HB   PRO  87          2HB       PRO  87  10.257  -3.633 -10.469
  639   2HB   PRO  87          1HB       PRO  87  10.249  -5.349 -10.915
  640   1HG   PRO  87          2HG       PRO  87   8.244  -3.274 -11.434
  641   2HG   PRO  87          1HG       PRO  87   8.538  -4.797 -12.279
  642   1HD   PRO  87          2HD       PRO  87   6.505  -4.228 -10.370
  643   2HD   PRO  87          1HD       PRO  87   6.854  -5.785 -11.150
  644    H    MET  88           H        MET  88  10.620  -4.204  -7.102
  645    HA   MET  88           HA       MET  88   8.909  -2.324  -5.810
  646   1HB   MET  88          2HB       MET  88  11.916  -2.223  -5.835
  647   2HB   MET  88          1HB       MET  88  10.825  -1.827  -4.512
  648   1HG   MET  88          2HG       MET  88  10.947  -3.953  -3.769
  649   2HG   MET  88          1HG       MET  88  10.290  -4.522  -5.304
  650   1HE   MET  88          1HE       MET  88  14.228  -2.886  -4.733
  651   2HE   MET  88          2HE       MET  88  14.375  -4.248  -3.623
  652   3HE   MET  88          3HE       MET  88  13.032  -3.120  -3.451
  653    H    SER  89           H        SER  89  10.386  -1.987  -8.818
  654    HA   SER  89           HA       SER  89  11.100   0.838  -8.457
  655   1HB   SER  89          2HB       SER  89  11.120  -1.051 -10.814
  656   2HB   SER  89          1HB       SER  89  11.795   0.576 -10.832
  657    HG   SER  89           HG       SER  89  12.631  -1.708  -9.405
  658    H    LEU  90           H        LEU  90   9.766   2.441  -8.800
  659    HA   LEU  90           HA       LEU  90   7.252   1.976 -10.341
  660   1HB   LEU  90          2HB       LEU  90   6.541   2.874  -8.364
  661   2HB   LEU  90          1HB       LEU  90   8.132   3.508  -7.974
  662    HG   LEU  90           HG       LEU  90   7.767   5.471  -9.271
  663   1HD1  LEU  90          1HD1      LEU  90   6.427   5.524 -11.097
  664   2HD1  LEU  90          2HD1      LEU  90   5.028   5.022 -10.148
  665   3HD1  LEU  90          3HD1      LEU  90   6.114   3.810 -10.828
  666   1HD2  LEU  90          1HD2      LEU  90   5.439   6.207  -8.346
  667   2HD2  LEU  90          2HD2      LEU  90   6.712   5.786  -7.199
  668   3HD2  LEU  90          3HD2      LEU  90   5.437   4.625  -7.567
  669    HA   PRO  91           HA       PRO  91  10.018   4.249 -13.226
  670   1HB   PRO  91          2HB       PRO  91   8.911   3.126 -15.473
  671   2HB   PRO  91          1HB       PRO  91  10.213   2.356 -14.542
  672   1HG   PRO  91          2HG       PRO  91   7.275   1.839 -14.465
  673   2HG   PRO  91          1HG       PRO  91   8.623   0.688 -14.451
  674   1HD   PRO  91          2HD       PRO  91   7.302   1.356 -12.199
  675   2HD   PRO  91          1HD       PRO  91   9.044   0.994 -12.208
  676    HA   PRO  92           HA       PRO  92   7.144   7.365 -14.318
  677   1HB   PRO  92          2HB       PRO  92   8.121   8.238 -16.720
  678   2HB   PRO  92          1HB       PRO  92   8.911   8.586 -15.170
  679   1HG   PRO  92          2HG       PRO  92   9.586   6.543 -17.226
  680   2HG   PRO  92          1HG       PRO  92  10.659   7.536 -16.226
  681   1HD   PRO  92          2HD       PRO  92  10.113   4.917 -15.705
  682   2HD   PRO  92          1HD       PRO  92  10.549   6.097 -14.451
  683    H    ALA  93           H        ALA  93   7.370   4.538 -16.137
  684    HA   ALA  93           HA       ALA  93   5.502   5.202 -18.269
  685   1HB   ALA  93          1HB       ALA  93   5.697   2.390 -17.600
  686   2HB   ALA  93          2HB       ALA  93   7.295   3.136 -17.547
  687   3HB   ALA  93          3HB       ALA  93   6.325   3.230 -19.017
  688    H    LEU  94           H        LEU  94   5.143   4.879 -14.980
  689    HA   LEU  94           HA       LEU  94   2.312   3.981 -15.278
  690   1HB   LEU  94          2HB       LEU  94   4.043   3.569 -12.836
  691   2HB   LEU  94          1HB       LEU  94   2.547   2.738 -13.256
  692    HG   LEU  94           HG       LEU  94   4.898   2.504 -15.110
  693   1HD1  LEU  94          1HD1      LEU  94   5.858   0.725 -13.840
  694   2HD1  LEU  94          2HD1      LEU  94   4.514   0.728 -12.697
  695   3HD1  LEU  94          3HD1      LEU  94   5.654   2.075 -12.721
  696   1HD2  LEU  94          1HD2      LEU  94   2.301   1.469 -15.008
  697   2HD2  LEU  94          2HD2      LEU  94   3.325   0.140 -14.448
  698   3HD2  LEU  94          3HD2      LEU  94   3.625   0.876 -16.018
  699    H    VAL  95           H        VAL  95   4.320   6.525 -14.572
  700    HA   VAL  95           HA       VAL  95   2.533   7.681 -12.477
  701    HB   VAL  95           HB       VAL  95   5.368   8.086 -13.418
  702   1HG1  VAL  95          1HG1      VAL  95   5.247  10.296 -13.014
  703   2HG1  VAL  95          2HG1      VAL  95   4.894   9.911 -11.330
  704   3HG1  VAL  95          3HG1      VAL  95   3.575  10.159 -12.474
  705   1HG2  VAL  95          1HG2      VAL  95   4.837   6.417 -11.652
  706   2HG2  VAL  95          2HG2      VAL  95   4.130   7.703 -10.675
  707   3HG2  VAL  95          3HG2      VAL  95   5.854   7.724 -11.046
  708    HA   PRO  96           HA       PRO  96   0.790  10.385 -15.496
  709   1HB   PRO  96          2HB       PRO  96   0.017  12.410 -13.808
  710   2HB   PRO  96          1HB       PRO  96  -0.856  10.870 -13.935
  711   1HG   PRO  96          2HG       PRO  96   1.155  11.741 -11.908
  712   2HG   PRO  96          1HG       PRO  96  -0.371  10.871 -11.675
  713   1HD   PRO  96          2HD       PRO  96   2.002   9.604 -11.659
  714   2HD   PRO  96          1HD       PRO  96   0.534   8.838 -12.312
  715    HA   PRO  97           HA       PRO  97   3.763  13.476 -16.433
  716   1HB   PRO  97          2HB       PRO  97   2.297  15.714 -17.048
  717   2HB   PRO  97          1HB       PRO  97   2.390  14.295 -18.113
  718   1HG   PRO  97          2HG       PRO  97   0.248  15.077 -16.189
  719   2HG   PRO  97          1HG       PRO  97   0.107  14.400 -17.820
  720   1HD   PRO  97          2HD       PRO  97  -0.208  12.900 -15.591
  721   2HD   PRO  97          1HD       PRO  97   0.458  12.241 -17.102
  722    H    SER  98           H        SER  98   4.577  15.718 -15.808
  723    HA   SER  98           HA       SER  98   5.019  17.394 -14.203
  724   1HB   SER  98          2HB       SER  98   3.172  18.109 -13.085
  725   2HB   SER  98          1HB       SER  98   2.326  16.788 -13.886
  726    HG   SER  98           HG       SER  98   3.640  16.725 -11.365
  727    H    LYS  99           H        LYS  99   4.072  14.255 -12.814
  728    HA   LYS  99           HA       LYS  99   6.154  14.510 -10.741
  729   1HB   LYS  99          2HB       LYS  99   3.702  13.069 -11.204
  730   2HB   LYS  99          1HB       LYS  99   4.988  11.913 -10.854
  731   1HG   LYS  99          2HG       LYS  99   5.252  14.149  -9.074
  732   2HG   LYS  99          1HG       LYS  99   3.588  13.567  -9.011
  733   1HD   LYS  99          2HD       LYS  99   4.405  12.016  -7.564
  734   2HD   LYS  99          1HD       LYS  99   4.998  11.211  -9.017
  735   1HE   LYS  99          2HE       LYS  99   6.574  13.255  -7.406
  736   2HE   LYS  99          1HE       LYS  99   6.824  11.498  -7.355
  737   1HZ   LYS  99          1HZ       LYS  99   8.279  12.134  -9.011
  738   2HZ   LYS  99          2HZ       LYS  99   7.265  13.370  -9.588
  739   3HZ   LYS  99          3HZ       LYS  99   6.899  11.744  -9.914
  740    H    ARG 100           H        ARG 100   6.330  13.973 -13.927
  741    HA   ARG 100           HA       ARG 100   7.514  11.541 -14.536
  742   1HB   ARG 100          2HB       ARG 100   8.539  14.309 -15.258
  743   2HB   ARG 100          1HB       ARG 100   8.811  12.835 -16.186
  744   1HG   ARG 100          2HG       ARG 100   5.982  13.237 -15.617
  745   2HG   ARG 100          1HG       ARG 100   6.672  14.601 -16.497
  746   1HD   ARG 100          2HD       ARG 100   6.695  13.383 -18.405
  747   2HD   ARG 100          1HD       ARG 100   7.673  12.129 -17.616
  748    HE   ARG 100           HE       ARG 100   5.293  11.536 -16.551
  749   1HH1  ARG 100          1HH2      ARG 100   4.968  13.343 -19.310
  750   2HH1  ARG 100          2HH2      ARG 100   4.146  12.134 -20.240
  751   1HH2  ARG 100          2HH1      ARG 100   4.712   9.600 -17.942
  752   2HH2  ARG 100          1HH1      ARG 100   4.003  10.017 -19.467
  753    H    SER 107           1H       SER 107   3.844   3.850   9.624
  754    HA   SER 107           HA       SER 107   4.784   5.877   8.256
  755   1HB   SER 107          2HB       SER 107   5.589   3.464   8.794
  756   2HB   SER 107          1HB       SER 107   4.984   3.059   7.190
  757    HG   SER 107           HG       SER 107   7.096   4.739   7.959
  758    H    THR 108           H        THR 108   5.243   5.951   5.766
  759    HA   THR 108           HA       THR 108   2.974   6.748   4.338
  760    HB   THR 108           HB       THR 108   4.521   6.245   2.334
  761    HG1  THR 108           HG1      THR 108   5.901   4.749   2.901
  762   1HG2  THR 108          1HG2      THR 108   6.268   7.735   4.103
  763   2HG2  THR 108          2HG2      THR 108   4.585   8.206   4.340
  764   3HG2  THR 108          3HG2      THR 108   5.313   8.313   2.736
  765    H    ASN 109           H        ASN 109   4.346   3.507   4.660
  766    HA   ASN 109           HA       ASN 109   2.241   2.429   2.839
  767   1HB   ASN 109          2HB       ASN 109   4.743   1.982   2.573
  768   2HB   ASN 109          1HB       ASN 109   4.633   1.020   4.047
  769   1HD2  ASN 109          1HD2      ASN 109   2.202   1.268   1.418
  770   2HD2  ASN 109          2HD2      ASN 109   2.250  -0.374   1.005
  771    HA   PRO 110           HA       PRO 110   0.175   1.082   6.544
  772   1HB   PRO 110          2HB       PRO 110  -1.872  -0.227   5.292
  773   2HB   PRO 110          1HB       PRO 110  -1.802   1.541   5.435
  774   1HG   PRO 110          2HG       PRO 110  -1.162  -0.198   3.114
  775   2HG   PRO 110          1HG       PRO 110  -1.922   1.399   3.154
  776   1HD   PRO 110          2HD       PRO 110   0.704   0.954   2.495
  777   2HD   PRO 110          1HD       PRO 110   0.079   2.490   3.132
  778    H    PHE 111           H        PHE 111   1.352  -0.960   3.960
  779    HA   PHE 111           HA       PHE 111   0.826  -3.481   5.384
  780   1HB   PHE 111          2HB       PHE 111   2.499  -2.807   2.937
  781   2HB   PHE 111          1HB       PHE 111   2.017  -4.430   3.434
  782    HD1  PHE 111           HD1      PHE 111   0.886  -1.246   1.990
  783    HD2  PHE 111           HD2      PHE 111  -0.318  -5.164   3.269
  784    HE1  PHE 111           HE1      PHE 111  -1.268  -0.973   0.802
  785    HE2  PHE 111           HE2      PHE 111  -2.472  -4.890   2.080
  786    HZ   PHE 111           HZ       PHE 111  -2.949  -2.792   0.851
  787    H    LEU 112           HN       LEU 112   3.182  -1.031   5.531
  788    HA   LEU 112           HA       LEU 112   5.090  -2.903   6.895
  789   1HB   LEU 112          2HB       LEU 112   5.580  -0.517   5.086
  790   2HB   LEU 112          1HB       LEU 112   6.853  -1.340   5.989
  791    HG   LEU 112           HG       LEU 112   5.003  -2.870   4.163
  792   1HD1  LEU 112          1HD1      LEU 112   6.470  -0.833   3.170
  793   2HD1  LEU 112          2HD1      LEU 112   6.209  -2.336   2.286
  794   3HD1  LEU 112          3HD1      LEU 112   7.704  -2.092   3.190
  795   1HD2  LEU 112          1HD2      LEU 112   7.319  -3.418   5.840
  796   2HD2  LEU 112          2HD2      LEU 112   7.604  -3.912   4.172
  797   3HD2  LEU 112          3HD2      LEU 112   6.218  -4.552   5.057