*HEADER    TRANSCRIPTION REGULATOR                 07-MAY-09   2KIQ              
*TITLE     SOLUTION STRUCTURE OF THE FF DOMAIN 2 OF HUMAN TRANSCRIPTION          
*TITLE    2 ELONGATION FACTOR CA150                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRANSCRIPTION ELONGATION REGULATOR 1;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 724-782;                                      
*COMPND   5 SYNONYM: TATA BOX-BINDING PROTEIN-ASSOCIATED FACTOR 2S,              
*COMPND   6 TRANSCRIPTION FACTOR CA150;                                          
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: TCERG1, CA150, TAF2S;                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET15B-MODIFIED                           
*KEYWDS    HUMAN TRANSCRIPTION ELONGATION FACTOR CA150, RNA POLYMERASE           
*KEYWDS   2 II C-TERMINAL DOMAIN INTERACTING PROTEIN, FF DOMAIN,                 
*KEYWDS   3 RESIDUAL DIPOLAR COUPLING, ACTIVATOR, ALTERNATIVE SPLICING,          
*KEYWDS   4 COILED COIL, NUCLEUS, PHOSPHOPROTEIN, REPRESSOR,                     
*KEYWDS   5 TRANSCRIPTION, TRANSCRIPTION REGULATION, TRANSCRIPTION               
*KEYWDS   6 REGULATOR                                                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.ZENG, J.BOYLES, C.TRIPATHY, A.YAN, P.ZHOU, B.R.DONALD               
*REVDAT   1   28-JUL-09 2KIQ    0                                                


assign ( resid     5  and name       HN )   ( resid     5 and name     HA )      4.484   2.684  0.0
assign ( resid     5  and name       HN )   ( resid     5 and name     HG12 )      4.704   2.904  0.0
assign ( resid     5  and name       HN )   ( resid     5 and name     HG11 )      5.051   3.251  0.0
assign ( resid     5  and name       HN )   ( resid     5 and name     HG2# )      6.000   4.200  0.0
assign ( resid     5  and name       HA )   ( resid     5 and name     HB )      3.983   2.183  0.0
assign ( resid     5  and name       HA )   ( resid     5 and name     HG11 )      5.523   3.723  0.0
assign ( resid     5  and name       HA )   ( resid     5 and name     HG2# )      6.000   4.200  0.0
assign ( resid     5  and name       HB )   ( resid     5 and name     HG11 )      5.708   3.908  0.0
assign ( resid     5  and name       HB )   ( resid     5 and name     HG2# )      6.000   4.200  0.0
assign ( resid     5  and name       HG2# )   ( resid     5 and name     HG12 )      6.000   4.200  0.0
assign ( resid     5  and name       HD1# )   ( resid     5 and name     HA )      6.000   4.200  0.0
assign ( resid     5  and name       HD1# )   ( resid     5 and name     HB )      6.000   4.200  0.0
assign ( resid     5  and name       HD1# )   ( resid     5 and name     HG12 )      6.000   4.200  0.0
assign ( resid     5  and name       HD1# )   ( resid     5 and name     HG11 )      6.000   4.200  0.0
assign ( resid     5  and name       HN )   ( resid     6 and name     HN )      3.497   1.697  0.0
assign ( resid     5  and name       HB )   ( resid     6 and name     HN )      4.773   2.973  0.0
assign ( resid     5  and name       HG2# )   ( resid     6 and name     HN )      6.000   4.200  0.0
assign ( resid     5  and name       HA )   ( resid     6 and name     HN )      5.206   3.406  0.0
assign ( resid     5  and name       HA )   ( resid     7 and name     HN )      4.475   2.675  0.0
assign ( resid     5  and name       HB )   ( resid     7 and name     HN )      4.773   2.973  0.0
assign ( resid     5  and name       HB )   ( resid     7 and name     HA )      5.794   3.994  0.0
assign ( resid     5  and name       HG2# )   ( resid     7 and name     HA )      6.000   4.200  0.0
assign ( resid     6  and name       HN )   ( resid     6 and name     HA )      4.621   2.821  0.0
assign ( resid     6  and name       HA )   ( resid     6 and name     HG2 )      5.485   3.685  0.0
assign ( resid     6  and name       HA )   ( resid     7 and name     HN )      4.971   3.171  0.0
assign ( resid     6  and name       HA )   ( resid     9 and name     HN )      4.971   3.171  0.0
assign ( resid     6  and name       HE# )   ( resid     9 and name     HD# )      6.000   4.200  0.0
assign ( resid     7  and name       HN )   ( resid     7 and name     HG1 )      4.900   3.100  0.0
assign ( resid     7  and name       HN )   ( resid     7 and name     HB2 )      3.124   1.324  0.0
assign ( resid     7  and name       HN )   ( resid     7 and name     HG2 )      6.000   4.200  0.0
assign ( resid     7  and name       HE22 )   ( resid     7 and name     HE21 )      2.400   0.600  0.0
assign ( resid     7  and name       HE21 )   ( resid     7 and name     HA )      6.000   4.200  0.0
assign ( resid     7  and name       HE21 )   ( resid     7 and name     HG1 )      4.896   3.096  0.0
assign ( resid     7  and name       HE21 )   ( resid     7 and name     HG2 )      4.896   3.096  0.0
assign ( resid     7  and name       HE21 )   ( resid     7 and name     HB2 )      6.000   4.200  0.0
assign ( resid     7  and name       HE22 )   ( resid     7 and name     HB2 )      6.000   4.200  0.0
assign ( resid     7  and name       HE22 )   ( resid     7 and name     HG1 )      5.546   3.746  0.0
assign ( resid     7  and name       HE22 )   ( resid     7 and name     HG2 )      5.546   3.746  0.0
assign ( resid     7  and name       HN )   ( resid     7 and name     HA )      5.328   3.528  0.0
assign ( resid     7  and name       HA )   ( resid     7 and name     HB2 )      3.123   1.323  0.0
assign ( resid     7  and name       HA )   ( resid     7 and name     HB1 )      3.123   1.323  0.0
assign ( resid     7  and name       HG1 )   ( resid     7 and name     HA )      5.330   3.530  0.0
assign ( resid     7  and name       HG2 )   ( resid     7 and name     HA )      5.330   3.530  0.0
assign ( resid     7  and name       HB1 )   ( resid     7 and name     HN )      4.093   2.293  0.0
assign ( resid     7  and name       HG1 )   ( resid     8 and name     HA )      6.000   4.200  0.0
assign ( resid     7  and name       HG2 )   ( resid     8 and name     HA )      6.000   4.200  0.0
assign ( resid     7  and name       HB1 )   ( resid     8 and name     HA )      5.939   4.139  0.0
assign ( resid     7  and name       HB2 )   ( resid     8 and name     HA )      6.000   4.200  0.0
assign ( resid     7  and name       HA )   ( resid     8 and name     HN )      4.736   2.936  0.0
assign ( resid     7  and name       HG1 )   ( resid     8 and name     HN )      6.000   4.200  0.0
assign ( resid     7  and name       HG2 )   ( resid     8 and name     HN )      6.000   4.200  0.0
assign ( resid     7  and name       HN )   ( resid     8 and name     HB# )      6.000   4.200  0.0
assign ( resid     7  and name       HG2 )   ( resid     9 and name     HN )      6.000   4.200  0.0
assign ( resid     7  and name       HA )   ( resid     10 and name     HN )      4.080   2.280  0.0
assign ( resid     8  and name       HN )   ( resid     8 and name     HA )      4.283   2.483  0.0
assign ( resid     8  and name       HN )   ( resid     8 and name     HB# )      5.161   3.361  0.0
assign ( resid     8  and name       HA )   ( resid     8 and name     HB# )      5.476   3.676  0.0
assign ( resid     8  and name       HA )   ( resid     9 and name     HN )      4.465   2.665  0.0
assign ( resid     8  and name       HB# )   ( resid     9 and name     HN )      6.000   4.200  0.0
assign ( resid     8  and name       HB# )   ( resid     10 and name     HN )      6.000   4.200  0.0
assign ( resid     8  and name       HA )   ( resid     11 and name     HN )      4.592   2.792  0.0
assign ( resid     8  and name       HA )   ( resid     11 and name     HB2 )      5.258   3.458  0.0
assign ( resid     8  and name       HB# )   ( resid     11 and name     HN )      6.000   4.200  0.0
assign ( resid     8  and name       HA )   ( resid     12 and name     HN )      6.000   4.200  0.0
assign ( resid     8  and name       HA )   ( resid     39 and name     HG2 )      5.443   3.643  0.0
assign ( resid     8  and name       HB# )   ( resid     43 and name     HG12 )      5.724   3.924  0.0
assign ( resid     9  and name       HN )   ( resid     9 and name     HA )      4.343   2.543  0.0
assign ( resid     9  and name       HN )   ( resid     9 and name     HB1 )      2.836   1.036  0.0
assign ( resid     9  and name       HN )   ( resid     9 and name     HD# )      5.542   3.742  0.0
assign ( resid     9  and name       HA )   ( resid     9 and name     HB1 )      4.169   2.369  0.0
assign ( resid     9  and name       HA )   ( resid     9 and name     HD# )      5.206   3.406  0.0
assign ( resid     9  and name       HA )   ( resid     9 and name     HB2 )      4.140   2.340  0.0
assign ( resid     9  and name       HA )   ( resid     9 and name     HG# )      5.161   3.361  0.0
assign ( resid     9  and name       HB2 )   ( resid     9 and name     HN )      4.426   2.626  0.0
assign ( resid     9  and name       HB1 )   ( resid     9 and name     HD# )      5.796   3.996  0.0
assign ( resid     9  and name       HG# )   ( resid     9 and name     HD# )      3.732   1.932  0.0
assign ( resid     9  and name       HD# )   ( resid     9 and name     HB# )      6.000   4.200  0.0
assign ( resid     9  and name       HD# )   ( resid     9 and name     HB2 )      4.704   2.904  0.0
assign ( resid     9  and name       HN )   ( resid     10 and name     HN )      3.056   1.256  0.0
assign ( resid     9  and name       HB1 )   ( resid     10 and name     HN )      4.021   2.221  0.0
assign ( resid     9  and name       HB2 )   ( resid     10 and name     HN )      4.562   2.762  0.0
assign ( resid     9  and name       HG# )   ( resid     10 and name     HN )      4.778   2.978  0.0
assign ( resid     9  and name       HD# )   ( resid     10 and name     HN )      6.000   4.200  0.0
assign ( resid     9  and name       HA )   ( resid     12 and name     HB1 )      3.825   2.025  0.0
assign ( resid     9  and name       HA )   ( resid     12 and name     HN )      4.176   2.376  0.0
assign ( resid     9  and name       HA )   ( resid     12 and name     HB2 )      5.462   3.662  0.0
assign ( resid     9  and name       HA )   ( resid     12 and name     HD# )      6.000   4.200  0.0
assign ( resid     9  and name       HG# )   ( resid     13 and name     HB# )      6.000   4.200  0.0
assign ( resid     9  and name       HA )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     9  and name       HA )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     9  and name       HG# )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     9  and name       HG# )   ( resid     52 and name     HD2# )      6.000   4.200  0.0
assign ( resid     10  and name       HN )   ( resid     10 and name     HA )      3.122   1.322  0.0
assign ( resid     10  and name       HN )   ( resid     10 and name     HG# )      3.429   1.629  0.0
assign ( resid     10  and name       HA )   ( resid     10 and name     HG# )      3.521   1.721  0.0
assign ( resid     10  and name       HA )   ( resid     10 and name     HB# )      2.823   1.023  0.0
assign ( resid     10  and name       HN )   ( resid     11 and name     HN )      2.959   1.159  0.0
assign ( resid     10  and name       HA )   ( resid     11 and name     HN )      5.748   3.948  0.0
assign ( resid     10  and name       HB# )   ( resid     11 and name     HN )      4.382   2.582  0.0
assign ( resid     10  and name       HA )   ( resid     13 and name     HN )      4.680   2.880  0.0
assign ( resid     10  and name       HA )   ( resid     14 and name     HG# )      6.000   4.200  0.0
assign ( resid     10  and name       HA )   ( resid     14 and name     HD2 )      6.000   4.200  0.0
assign ( resid     11  and name       HN )   ( resid     11 and name     HA )      4.309   2.509  0.0
assign ( resid     11  and name       HN )   ( resid     11 and name     HB2 )      3.531   1.731  0.0
assign ( resid     11  and name       HA )   ( resid     11 and name     HB1 )      3.886   2.086  0.0
assign ( resid     11  and name       HA )   ( resid     11 and name     HB2 )      3.546   1.746  0.0
assign ( resid     11  and name       HB1 )   ( resid     11 and name     HB2 )      3.015   1.215  0.0
assign ( resid     11  and name       HN )   ( resid     12 and name     HN )      3.245   1.445  0.0
assign ( resid     11  and name       HN )   ( resid     12 and name     HB1 )      5.560   3.760  0.0
assign ( resid     11  and name       HB1 )   ( resid     12 and name     HN )      5.067   3.267  0.0
assign ( resid     11  and name       HB2 )   ( resid     12 and name     HN )      5.555   3.755  0.0
assign ( resid     11  and name       HA )   ( resid     12 and name     HN )      6.000   4.200  0.0
assign ( resid     11  and name       HB2 )   ( resid     13 and name     HN )      5.555   3.755  0.0
assign ( resid     11  and name       HA )   ( resid     13 and name     HN )      6.000   4.200  0.0
assign ( resid     11  and name       HN )   ( resid     14 and name     HG# )      6.000   4.200  0.0
assign ( resid     11  and name       HN )   ( resid     14 and name     HD2 )      6.000   4.200  0.0
assign ( resid     11  and name       HA )   ( resid     14 and name     HN )      4.038   2.238  0.0
assign ( resid     11  and name       HA )   ( resid     14 and name     HB# )      6.000   4.200  0.0
assign ( resid     11  and name       HA )   ( resid     14 and name     HG# )      6.000   4.200  0.0
assign ( resid     11  and name       HA )   ( resid     14 and name     HD1 )      6.000   4.200  0.0
assign ( resid     11  and name       HA )   ( resid     15 and name     HN )      6.000   4.200  0.0
assign ( resid     11  and name       HB1 )   ( resid     15 and name     HN )      5.366   3.566  0.0
assign ( resid     11  and name       HB1 )   ( resid     39 and name     HG2 )      6.000   4.200  0.0
assign ( resid     11  and name       HB1 )   ( resid     39 and name     HG1 )      6.000   4.200  0.0
assign ( resid     11  and name       HB2 )   ( resid     39 and name     HD1 )      6.000   4.200  0.0
assign ( resid     11  and name       HB2 )   ( resid     39 and name     HB1 )      5.899   4.099  0.0
assign ( resid     11  and name       HB2 )   ( resid     39 and name     HG2 )      4.637   2.837  0.0
assign ( resid     12  and name       HN )   ( resid     12 and name     HD# )      6.000   4.200  0.0
assign ( resid     12  and name       HN )   ( resid     12 and name     HA )      4.176   2.376  0.0
assign ( resid     12  and name       HN )   ( resid     12 and name     HB1 )      3.196   1.396  0.0
assign ( resid     12  and name       HN )   ( resid     12 and name     HB2 )      3.096   1.296  0.0
assign ( resid     12  and name       HA )   ( resid     12 and name     HD# )      5.644   3.844  0.0
assign ( resid     12  and name       HA )   ( resid     12 and name     HE# )      5.644   3.844  0.0
assign ( resid     12  and name       HA )   ( resid     12 and name     HB2 )      3.578   1.778  0.0
assign ( resid     12  and name       HA )   ( resid     12 and name     HB1 )      3.825   2.025  0.0
assign ( resid     12  and name       HB1 )   ( resid     12 and name     HD# )      4.985   3.185  0.0
assign ( resid     12  and name       HB1 )   ( resid     12 and name     HE# )      4.985   3.185  0.0
assign ( resid     12  and name       HB2 )   ( resid     12 and name     HD# )      4.327   2.527  0.0
assign ( resid     12  and name       HB1 )   ( resid     12 and name     HB2 )      2.848   1.048  0.0
assign ( resid     12  and name       HD# )   ( resid     13 and name     HA )      6.000   4.200  0.0
assign ( resid     12  and name       HD# )   ( resid     13 and name     HN )      6.000   4.200  0.0
assign ( resid     12  and name       HB1 )   ( resid     13 and name     HN )      3.474   1.674  0.0
assign ( resid     12  and name       HB2 )   ( resid     13 and name     HN )      4.286   2.486  0.0
assign ( resid     12  and name       HE# )   ( resid     13 and name     HA )      6.000   4.200  0.0
assign ( resid     12  and name       HN )   ( resid     13 and name     HG1 )      6.000   4.200  0.0
assign ( resid     12  and name       HN )   ( resid     14 and name     HB# )      6.000   4.200  0.0
assign ( resid     12  and name       HA )   ( resid     15 and name     HG2 )      5.817   4.017  0.0
assign ( resid     12  and name       HD# )   ( resid     15 and name     HB2 )      6.000   4.200  0.0
assign ( resid     12  and name       HA )   ( resid     16 and name     HG2 )      5.817   4.017  0.0
assign ( resid     12  and name       HD# )   ( resid     16 and name     HG2 )      6.000   4.200  0.0
assign ( resid     12  and name       HD# )   ( resid     16 and name     HB2 )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     16 and name     HE# )      6.000   4.200  0.0
assign ( resid     12  and name       HZ )   ( resid     16 and name     HE# )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     16 and name     HG2 )      6.000   4.200  0.0
assign ( resid     12  and name       HZ )   ( resid     30 and name     HE# )      6.000   4.200  0.0
assign ( resid     12  and name       HN )   ( resid     39 and name     HB1 )      5.581   3.781  0.0
assign ( resid     12  and name       HE# )   ( resid     40 and name     HA )      6.000   4.200  0.0
assign ( resid     12  and name       HD# )   ( resid     43 and name     HG11 )      6.000   4.200  0.0
assign ( resid     12  and name       HB2 )   ( resid     43 and name     HG11 )      6.000   4.200  0.0
assign ( resid     12  and name       HB2 )   ( resid     43 and name     HG12 )      6.000   4.200  0.0
assign ( resid     12  and name       HD# )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HA )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HB1 )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HB2 )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     49 and name     HB1 )      6.000   4.200  0.0
assign ( resid     12  and name       HZ )   ( resid     49 and name     HB1 )      6.000   4.200  0.0
assign ( resid     12  and name       HZ )   ( resid     49 and name     HA )      5.081   3.281  0.0
assign ( resid     12  and name       HE# )   ( resid     49 and name     HD1 )      5.983   4.183  0.0
assign ( resid     12  and name       HZ )   ( resid     49 and name     HG2 )      5.678   3.878  0.0
assign ( resid     12  and name       HD# )   ( resid     52 and name     HB1 )      6.000   4.200  0.0
assign ( resid     12  and name       HD# )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     52 and name     HB1 )      6.000   4.200  0.0
assign ( resid     12  and name       HD# )   ( resid     52 and name     HB2 )      5.616   3.816  0.0
assign ( resid     12  and name       HE# )   ( resid     52 and name     HB2 )      5.616   3.816  0.0
assign ( resid     12  and name       HE# )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HB1 )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HB2 )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     53 and name     HA )      6.000   4.200  0.0
assign ( resid     12  and name       HE# )   ( resid     53 and name     HB2 )      6.000   4.200  0.0
assign ( resid     13  and name       HN )   ( resid     13 and name     HA )      3.936   2.136  0.0
assign ( resid     13  and name       HN )   ( resid     13 and name     HG1 )      3.648   1.848  0.0
assign ( resid     13  and name       HN )   ( resid     13 and name     HG2 )      5.603   3.803  0.0
assign ( resid     13  and name       HA )   ( resid     13 and name     HG2 )      6.000   4.200  0.0
assign ( resid     13  and name       HB2 )   ( resid     13 and name     HN )      4.154   2.354  0.0
assign ( resid     13  and name       HD# )   ( resid     13 and name     HN )      5.417   3.617  0.0
assign ( resid     13  and name       HD# )   ( resid     13 and name     HB# )      6.000   4.200  0.0
assign ( resid     13  and name       HG1 )   ( resid     13 and name     HA )      6.000   4.200  0.0
assign ( resid     13  and name       HB2 )   ( resid     14 and name     HB# )      6.000   4.200  0.0
assign ( resid     13  and name       HA )   ( resid     14 and name     HN )      5.139   3.339  0.0
assign ( resid     13  and name       HB# )   ( resid     15 and name     HN )      6.000   4.200  0.0
assign ( resid     13  and name       HN )   ( resid     16 and name     HG2 )      6.000   4.200  0.0
assign ( resid     13  and name       HA )   ( resid     16 and name     HN )      5.622   3.822  0.0
assign ( resid     13  and name       HA )   ( resid     16 and name     HG1 )      4.419   2.619  0.0
assign ( resid     13  and name       HA )   ( resid     16 and name     HG2 )      6.000   4.200  0.0
assign ( resid     13  and name       HA )   ( resid     16 and name     HB1 )      6.000   4.200  0.0
assign ( resid     13  and name       HA )   ( resid     17 and name     HN )      6.000   4.200  0.0
assign ( resid     13  and name       HA )   ( resid     17 and name     HG2 )      6.000   4.200  0.0
assign ( resid     13  and name       HD# )   ( resid     52 and name     HD2# )      6.000   4.200  0.0
assign ( resid     14  and name       HN )   ( resid     14 and name     HA )      3.862   2.062  0.0
assign ( resid     14  and name       HN )   ( resid     14 and name     HB# )      5.094   3.294  0.0
assign ( resid     14  and name       HA )   ( resid     14 and name     HG# )      3.073   1.273  0.0
assign ( resid     14  and name       HA )   ( resid     14 and name     HB# )      5.324   3.524  0.0
assign ( resid     14  and name       HD2 )   ( resid     14 and name     HN )      6.000   4.200  0.0
assign ( resid     14  and name       HD2 )   ( resid     14 and name     HA )      6.000   4.200  0.0
assign ( resid     14  and name       HD1 )   ( resid     14 and name     HB# )      6.000   4.200  0.0
assign ( resid     14  and name       HD2 )   ( resid     14 and name     HB# )      6.000   4.200  0.0
assign ( resid     14  and name       HB# )   ( resid     15 and name     HN )      6.000   4.200  0.0
assign ( resid     14  and name       HN )   ( resid     15 and name     HN )      2.853   1.053  0.0
assign ( resid     14  and name       HN )   ( resid     16 and name     HG2 )      6.000   4.200  0.0
assign ( resid     14  and name       HA )   ( resid     16 and name     HN )      5.628   3.828  0.0
assign ( resid     14  and name       HB# )   ( resid     16 and name     HN )      6.000   4.200  0.0
assign ( resid     14  and name       HA )   ( resid     17 and name     HG1 )      6.000   4.200  0.0
assign ( resid     14  and name       HA )   ( resid     17 and name     HG2 )      3.926   2.126  0.0
assign ( resid     14  and name       HA )   ( resid     18 and name     HG1 )      6.000   4.200  0.0
assign ( resid     15  and name       HN )   ( resid     15 and name     HA )      4.086   2.286  0.0
assign ( resid     15  and name       HA )   ( resid     15 and name     HB1 )      4.086   2.286  0.0
assign ( resid     15  and name       HA )   ( resid     15 and name     HG1 )      4.536   2.736  0.0
assign ( resid     15  and name       HG2 )   ( resid     15 and name     HB2 )      3.152   1.352  0.0
assign ( resid     15  and name       HG2 )   ( resid     15 and name     HE# )      6.000   4.200  0.0
assign ( resid     15  and name       HG1 )   ( resid     15 and name     HG2 )      3.900   2.100  0.0
assign ( resid     15  and name       HE# )   ( resid     15 and name     HA )      6.000   4.200  0.0
assign ( resid     15  and name       HE# )   ( resid     15 and name     HB2 )      5.904   4.104  0.0
assign ( resid     15  and name       HN )   ( resid     16 and name     HN )      3.395   1.595  0.0
assign ( resid     15  and name       HA )   ( resid     16 and name     HN )      5.662   3.862  0.0
assign ( resid     15  and name       HG2 )   ( resid     16 and name     HN )      6.000   4.200  0.0
assign ( resid     15  and name       HG2 )   ( resid     16 and name     HA )      6.000   4.200  0.0
assign ( resid     15  and name       HG1 )   ( resid     16 and name     HA )      4.558   2.758  0.0
assign ( resid     15  and name       HA )   ( resid     17 and name     HN )      5.320   3.520  0.0
assign ( resid     15  and name       HB1 )   ( resid     17 and name     HN )      5.326   3.526  0.0
assign ( resid     15  and name       HA )   ( resid     18 and name     HN )      5.320   3.520  0.0
assign ( resid     15  and name       HA )   ( resid     18 and name     HB1 )      4.375   2.575  0.0
assign ( resid     15  and name       HG2 )   ( resid     30 and name     HZ )      6.000   4.200  0.0
assign ( resid     15  and name       HG1 )   ( resid     34 and name     HB1 )      6.000   4.200  0.0
assign ( resid     15  and name       HE# )   ( resid     34 and name     HB1 )      6.000   4.200  0.0
assign ( resid     15  and name       HN )   ( resid     39 and name     HD1 )      6.000   4.200  0.0
assign ( resid     15  and name       HG1 )   ( resid     39 and name     HD2 )      6.000   4.200  0.0
assign ( resid     15  and name       HE# )   ( resid     39 and name     HD2 )      6.000   4.200  0.0
assign ( resid     15  and name       HG2 )   ( resid     39 and name     HD1 )      6.000   4.200  0.0
assign ( resid     15  and name       HG1 )   ( resid     39 and name     HD1 )      6.000   4.200  0.0
assign ( resid     15  and name       HG2 )   ( resid     39 and name     HD2 )      5.236   3.436  0.0
assign ( resid     15  and name       HG2 )   ( resid     39 and name     HB1 )      6.000   4.200  0.0
assign ( resid     16  and name       HN )   ( resid     16 and name     HA )      4.282   2.482  0.0
assign ( resid     16  and name       HN )   ( resid     16 and name     HG2 )      3.054   1.254  0.0
assign ( resid     16  and name       HN )   ( resid     16 and name     HB2 )      3.784   1.984  0.0
assign ( resid     16  and name       HA )   ( resid     16 and name     HG2 )      6.000   4.200  0.0
assign ( resid     16  and name       HA )   ( resid     16 and name     HG1 )      4.184   2.384  0.0
assign ( resid     16  and name       HA )   ( resid     16 and name     HE# )      5.679   3.879  0.0
assign ( resid     16  and name       HA )   ( resid     16 and name     HB2 )      4.028   2.228  0.0
assign ( resid     16  and name       HG2 )   ( resid     16 and name     HG1 )      3.152   1.352  0.0
assign ( resid     16  and name       HG2 )   ( resid     16 and name     HE# )      4.900   3.100  0.0
assign ( resid     16  and name       HB1 )   ( resid     16 and name     HA )      6.000   4.200  0.0
assign ( resid     16  and name       HG1 )   ( resid     16 and name     HB2 )      6.000   4.200  0.0
assign ( resid     16  and name       HB1 )   ( resid     16 and name     HB2 )      3.910   2.110  0.0
assign ( resid     16  and name       HE# )   ( resid     16 and name     HB2 )      6.000   4.200  0.0
assign ( resid     16  and name       HN )   ( resid     17 and name     HN )      3.051   1.251  0.0
assign ( resid     16  and name       HA )   ( resid     17 and name     HN )      4.953   3.153  0.0
assign ( resid     16  and name       HB1 )   ( resid     17 and name     HN )      5.873   4.073  0.0
assign ( resid     16  and name       HB2 )   ( resid     17 and name     HN )      4.220   2.420  0.0
assign ( resid     16  and name       HA )   ( resid     18 and name     HN )      4.953   3.153  0.0
assign ( resid     16  and name       HB1 )   ( resid     18 and name     HN )      5.873   4.073  0.0
assign ( resid     16  and name       HA )   ( resid     19 and name     HN )      4.722   2.922  0.0
assign ( resid     16  and name       HA )   ( resid     19 and name     HB# )      6.000   4.200  0.0
assign ( resid     16  and name       HA )   ( resid     21 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HB1 )   ( resid     21 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     21 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HB1 )   ( resid     21 and name     HZ )      6.000   4.200  0.0
assign ( resid     16  and name       HA )   ( resid     30 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HG2 )   ( resid     30 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HG2 )   ( resid     30 and name     HZ )      6.000   4.200  0.0
assign ( resid     16  and name       HG1 )   ( resid     30 and name     HZ )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     30 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     52 and name     HB1 )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     53 and name     HD# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     53 and name     HA )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     53 and name     HB1 )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     53 and name     HB2 )      6.000   4.200  0.0
assign ( resid     16  and name       HA )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HB2 )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     56 and name     HN )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     56 and name     HD# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     56 and name     HA )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     56 and name     HB2 )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     56 and name     HB1 )      6.000   4.200  0.0
assign ( resid     16  and name       HG1 )   ( resid     56 and name     HD# )      6.000   4.200  0.0
assign ( resid     16  and name       HB1 )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HG1 )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     16  and name       HE# )   ( resid     57 and name     HN )      6.000   4.200  0.0
assign ( resid     17  and name       HN )   ( resid     17 and name     HA )      3.461   1.661  0.0
assign ( resid     17  and name       HN )   ( resid     17 and name     HG1 )      3.806   2.006  0.0
assign ( resid     17  and name       HN )   ( resid     17 and name     HG2 )      2.724   0.924  0.0
assign ( resid     17  and name       HA )   ( resid     17 and name     HG1 )      6.000   4.200  0.0
assign ( resid     17  and name       HA )   ( resid     17 and name     HB# )      2.823   1.023  0.0
assign ( resid     17  and name       HA )   ( resid     17 and name     HG2 )      3.926   2.126  0.0
assign ( resid     17  and name       HB# )   ( resid     17 and name     HN )      3.668   1.868  0.0
assign ( resid     17  and name       HG1 )   ( resid     17 and name     HB# )      3.495   1.695  0.0
assign ( resid     17  and name       HA )   ( resid     18 and name     HG1 )      6.000   4.200  0.0
assign ( resid     17  and name       HA )   ( resid     18 and name     HN )      3.638   1.838  0.0
assign ( resid     17  and name       HG1 )   ( resid     18 and name     HN )      4.377   2.577  0.0
assign ( resid     17  and name       HG1 )   ( resid     18 and name     HA )      4.865   3.065  0.0
assign ( resid     17  and name       HG2 )   ( resid     18 and name     HN )      3.014   1.214  0.0
assign ( resid     17  and name       HA )   ( resid     19 and name     HN )      4.231   2.431  0.0
assign ( resid     17  and name       HG1 )   ( resid     19 and name     HN )      6.000   4.200  0.0
assign ( resid     17  and name       HG2 )   ( resid     19 and name     HN )      5.015   3.215  0.0
assign ( resid     17  and name       HA )   ( resid     56 and name     HZ )      5.224   3.424  0.0
assign ( resid     18  and name       HN )   ( resid     18 and name     HA )      3.696   1.896  0.0
assign ( resid     18  and name       HN )   ( resid     18 and name     HG1 )      3.426   1.626  0.0
assign ( resid     18  and name       HA )   ( resid     18 and name     HG1 )      5.782   3.982  0.0
assign ( resid     18  and name       HA )   ( resid     18 and name     HG2 )      4.704   2.904  0.0
assign ( resid     18  and name       HB1 )   ( resid     18 and name     HA )      4.265   2.465  0.0
assign ( resid     18  and name       HG2 )   ( resid     18 and name     HG1 )      2.400   0.600  0.0
assign ( resid     18  and name       HG1 )   ( resid     18 and name     HB1 )      3.495   1.695  0.0
assign ( resid     18  and name       HA )   ( resid     18 and name     HB2 )      3.444   1.644  0.0
assign ( resid     18  and name       HN )   ( resid     19 and name     HN )      3.140   1.340  0.0
assign ( resid     18  and name       HN )   ( resid     19 and name     HB# )      6.000   4.200  0.0
assign ( resid     18  and name       HA )   ( resid     19 and name     HN )      4.790   2.990  0.0
assign ( resid     18  and name       HB1 )   ( resid     19 and name     HN )      4.994   3.194  0.0
assign ( resid     19  and name       HN )   ( resid     19 and name     HA )      3.453   1.653  0.0
assign ( resid     19  and name       HN )   ( resid     19 and name     HB# )      4.900   3.100  0.0
assign ( resid     19  and name       HA )   ( resid     19 and name     HB# )      5.481   3.681  0.0
assign ( resid     19  and name       HA )   ( resid     20 and name     HN )      4.986   3.186  0.0
assign ( resid     19  and name       HB# )   ( resid     20 and name     HN )      6.000   4.200  0.0
assign ( resid     19  and name       HB# )   ( resid     21 and name     HB1 )      6.000   4.200  0.0
assign ( resid     19  and name       HB# )   ( resid     21 and name     HD# )      6.000   4.200  0.0
assign ( resid     19  and name       HB# )   ( resid     21 and name     HN )      6.000   4.200  0.0
assign ( resid     19  and name       HB# )   ( resid     30 and name     HE# )      6.000   4.200  0.0
assign ( resid     19  and name       HB# )   ( resid     34 and name     HE1 )      6.000   4.200  0.0
assign ( resid     20  and name       HN )   ( resid     20 and name     HA )      3.396   1.596  0.0
assign ( resid     20  and name       HA )   ( resid     20 and name     HB2 )      3.722   1.922  0.0
assign ( resid     20  and name       HA )   ( resid     20 and name     HG2 )      4.845   3.045  0.0
assign ( resid     20  and name       HB1 )   ( resid     20 and name     HA )      5.206   3.406  0.0
assign ( resid     20  and name       HD2 )   ( resid     20 and name     HA )      6.000   4.200  0.0
assign ( resid     20  and name       HD1 )   ( resid     20 and name     HA )      6.000   4.200  0.0
assign ( resid     20  and name       HD1 )   ( resid     20 and name     HB# )      5.742   3.942  0.0
assign ( resid     20  and name       HG2 )   ( resid     20 and name     HB# )      6.000   4.200  0.0
assign ( resid     20  and name       HA )   ( resid     21 and name     HN )      3.695   1.895  0.0
assign ( resid     20  and name       HG1 )   ( resid     21 and name     HN )      5.687   3.887  0.0
assign ( resid     20  and name       HG2 )   ( resid     21 and name     HN )      6.000   4.200  0.0
assign ( resid     20  and name       HD2 )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     20  and name       HD1 )   ( resid     56 and name     HE# )      6.000   4.200  0.0
assign ( resid     20  and name       HA )   ( resid     56 and name     HZ )      6.000   4.200  0.0
assign ( resid     21  and name       HN )   ( resid     21 and name     HD# )      4.985   3.185  0.0
assign ( resid     21  and name       HN )   ( resid     21 and name     HB1 )      3.364   1.564  0.0
assign ( resid     21  and name       HA )   ( resid     21 and name     HN )      5.207   3.407  0.0
assign ( resid     21  and name       HA )   ( resid     21 and name     HD# )      5.390   3.590  0.0
assign ( resid     21  and name       HA )   ( resid     21 and name     HB1 )      4.090   2.290  0.0
assign ( resid     21  and name       HA )   ( resid     21 and name     HB2 )      3.875   2.075  0.0
assign ( resid     21  and name       HB1 )   ( resid     21 and name     HD# )      5.316   3.516  0.0
assign ( resid     21  and name       HB2 )   ( resid     21 and name     HD# )      4.327   2.527  0.0
assign ( resid     21  and name       HB1 )   ( resid     21 and name     HB2 )      2.400   0.600  0.0
assign ( resid     21  and name       HZ )   ( resid     21 and name     HE# )      5.414   3.614  0.0
assign ( resid     21  and name       HE# )   ( resid     23 and name     HA )      5.551   3.751  0.0
assign ( resid     21  and name       HZ )   ( resid     23 and name     HA )      6.000   4.200  0.0
assign ( resid     21  and name       HE# )   ( resid     25 and name     HB# )      6.000   4.200  0.0
assign ( resid     21  and name       HD# )   ( resid     25 and name     HB# )      6.000   4.200  0.0
assign ( resid     21  and name       HB2 )   ( resid     25 and name     HB# )      6.000   4.200  0.0
assign ( resid     21  and name       HZ )   ( resid     30 and name     HB1 )      5.524   3.724  0.0
assign ( resid     21  and name       HB2 )   ( resid     30 and name     HB2 )      6.000   4.200  0.0
assign ( resid     21  and name       HB2 )   ( resid     30 and name     HE# )      6.000   4.200  0.0
assign ( resid     21  and name       HB2 )   ( resid     30 and name     HD# )      6.000   4.200  0.0
assign ( resid     21  and name       HB2 )   ( resid     34 and name     HE1 )      6.000   4.200  0.0
assign ( resid     21  and name       HE# )   ( resid     57 and name     HA )      6.000   4.200  0.0
assign ( resid     21  and name       HZ )   ( resid     57 and name     HG2# )      6.000   4.200  0.0
assign ( resid     22  and name       HD22 )   ( resid     22 and name     HD21 )      3.075   1.275  0.0
assign ( resid     22  and name       HD21 )   ( resid     22 and name     HB# )      6.000   4.200  0.0
assign ( resid     22  and name       HD22 )   ( resid     22 and name     HB# )      6.000   4.200  0.0
assign ( resid     22  and name       HB# )   ( resid     22 and name     HA )      4.915   3.115  0.0
assign ( resid     22  and name       HB# )   ( resid     23 and name     HD2 )      5.501   3.701  0.0
assign ( resid     22  and name       HB# )   ( resid     23 and name     HD1 )      5.501   3.701  0.0
assign ( resid     22  and name       HA )   ( resid     23 and name     HD1 )      4.220   2.420  0.0
assign ( resid     22  and name       HA )   ( resid     23 and name     HD2 )      4.272   2.472  0.0
assign ( resid     22  and name       HB# )   ( resid     24 and name     HN )      6.000   4.200  0.0
assign ( resid     22  and name       HB# )   ( resid     25 and name     HN )      4.739   2.939  0.0
assign ( resid     22  and name       HB# )   ( resid     25 and name     HB# )      6.000   4.200  0.0
assign ( resid     23  and name       HA )   ( resid     23 and name     HD1 )      5.514   3.714  0.0
assign ( resid     23  and name       HA )   ( resid     23 and name     HB2 )      3.668   1.868  0.0
assign ( resid     23  and name       HA )   ( resid     23 and name     HB1 )      3.888   2.088  0.0
assign ( resid     23  and name       HA )   ( resid     23 and name     HG2 )      4.949   3.149  0.0
assign ( resid     23  and name       HD2 )   ( resid     23 and name     HA )      6.000   4.200  0.0
assign ( resid     23  and name       HD1 )   ( resid     23 and name     HB2 )      6.000   4.200  0.0
assign ( resid     23  and name       HD2 )   ( resid     23 and name     HB2 )      6.000   4.200  0.0
assign ( resid     23  and name       HD2 )   ( resid     23 and name     HB1 )      4.275   2.475  0.0
assign ( resid     23  and name       HD2 )   ( resid     23 and name     HG2 )      4.275   2.475  0.0
assign ( resid     23  and name       HD1 )   ( resid     23 and name     HB1 )      4.342   2.542  0.0
assign ( resid     23  and name       HD1 )   ( resid     23 and name     HG2 )      4.342   2.542  0.0
assign ( resid     23  and name       HG1 )   ( resid     23 and name     HA )      6.000   4.200  0.0
assign ( resid     23  and name       HG1 )   ( resid     23 and name     HD1 )      4.844   3.044  0.0
assign ( resid     23  and name       HB2 )   ( resid     23 and name     HB1 )      3.103   1.303  0.0
assign ( resid     23  and name       HB2 )   ( resid     23 and name     HG2 )      3.103   1.303  0.0
assign ( resid     23  and name       HA )   ( resid     24 and name     HN )      4.977   3.177  0.0
assign ( resid     23  and name       HA )   ( resid     24 and name     HG1 )      6.000   4.200  0.0
assign ( resid     23  and name       HD1 )   ( resid     24 and name     HN )      6.000   4.200  0.0
assign ( resid     23  and name       HD2 )   ( resid     24 and name     HN )      6.000   4.200  0.0
assign ( resid     23  and name       HD2 )   ( resid     24 and name     HA )      6.000   4.200  0.0
assign ( resid     23  and name       HB2 )   ( resid     24 and name     HA )      5.359   3.559  0.0
assign ( resid     23  and name       HG2 )   ( resid     24 and name     HN )      4.070   2.270  0.0
assign ( resid     23  and name       HB2 )   ( resid     24 and name     HN )      5.359   3.559  0.0
assign ( resid     23  and name       HA )   ( resid     25 and name     HN )      5.070   3.270  0.0
assign ( resid     23  and name       HA )   ( resid     25 and name     HB# )      6.000   4.200  0.0
assign ( resid     23  and name       HG2 )   ( resid     25 and name     HN )      6.000   4.200  0.0
assign ( resid     23  and name       HA )   ( resid     57 and name     HG1# )      6.000   4.200  0.0
assign ( resid     23  and name       HB2 )   ( resid     57 and name     HG1# )      6.000   4.200  0.0
assign ( resid     23  and name       HB2 )   ( resid     57 and name     HA )      6.000   4.200  0.0
assign ( resid     23  and name       HA )   ( resid     57 and name     HG2# )      6.000   4.200  0.0
assign ( resid     23  and name       HB1 )   ( resid     60 and name     HB# )      6.000   4.200  0.0
assign ( resid     23  and name       HB2 )   ( resid     60 and name     HB# )      6.000   4.200  0.0
assign ( resid     23  and name       HB2 )   ( resid     61 and name     HB2 )      4.255   2.455  0.0
assign ( resid     24  and name       HN )   ( resid     24 and name     HA )      4.087   2.287  0.0
assign ( resid     24  and name       HN )   ( resid     24 and name     HD# )      6.000   4.200  0.0
assign ( resid     24  and name       HN )   ( resid     24 and name     HB2 )      2.899   1.099  0.0
assign ( resid     24  and name       HA )   ( resid     24 and name     HD# )      6.000   4.200  0.0
assign ( resid     24  and name       HA )   ( resid     24 and name     HB1 )      3.300   1.500  0.0
assign ( resid     24  and name       HA )   ( resid     24 and name     HG1 )      4.423   2.623  0.0
assign ( resid     24  and name       HD# )   ( resid     24 and name     HB1 )      5.823   4.023  0.0
assign ( resid     24  and name       HD# )   ( resid     24 and name     HG1 )      4.094   2.294  0.0
assign ( resid     24  and name       HB2 )   ( resid     24 and name     HA )      5.876   4.076  0.0
assign ( resid     24  and name       HB2 )   ( resid     24 and name     HD# )      6.000   4.200  0.0
assign ( resid     24  and name       HG2 )   ( resid     24 and name     HN )      6.000   4.200  0.0
assign ( resid     24  and name       HG2 )   ( resid     24 and name     HA )      5.970   4.170  0.0
assign ( resid     24  and name       HG2 )   ( resid     24 and name     HD# )      4.563   2.763  0.0
assign ( resid     24  and name       HN )   ( resid     25 and name     HN )      2.960   1.160  0.0
assign ( resid     24  and name       HA )   ( resid     25 and name     HN )      4.700   2.900  0.0
assign ( resid     24  and name       HB1 )   ( resid     25 and name     HN )      4.443   2.643  0.0
assign ( resid     24  and name       HA )   ( resid     57 and name     HG1# )      6.000   4.200  0.0
assign ( resid     25  and name       HN )   ( resid     25 and name     HA )      3.392   1.592  0.0
assign ( resid     25  and name       HN )   ( resid     25 and name     HB# )      4.900   3.100  0.0
assign ( resid     25  and name       HA )   ( resid     25 and name     HB# )      5.421   3.621  0.0
assign ( resid     25  and name       HA )   ( resid     26 and name     HN )      3.646   1.846  0.0
assign ( resid     25  and name       HA )   ( resid     26 and name     HG2# )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     26 and name     HN )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     26 and name     HA )      6.000   4.200  0.0
assign ( resid     25  and name       HA )   ( resid     29 and name     HG2 )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     29 and name     HB1 )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     30 and name     HN )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     30 and name     HB1 )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     53 and name     HZ )      6.000   4.200  0.0
assign ( resid     25  and name       HB# )   ( resid     53 and name     HE# )      6.000   4.200  0.0
assign ( resid     25  and name       HN )   ( resid     57 and name     HG2# )      6.000   4.200  0.0
assign ( resid     26  and name       HN )   ( resid     26 and name     HG2# )      5.668   3.868  0.0
assign ( resid     26  and name       HG2# )   ( resid     26 and name     HA )      6.000   4.200  0.0
assign ( resid     26  and name       HG2# )   ( resid     26 and name     HB )      6.000   4.200  0.0
assign ( resid     26  and name       HG2# )   ( resid     27 and name     HN )      6.000   4.200  0.0
assign ( resid     26  and name       HA )   ( resid     27 and name     HB1 )      6.000   4.200  0.0
assign ( resid     26  and name       HB )   ( resid     27 and name     HB1 )      6.000   4.200  0.0
assign ( resid     26  and name       HG2# )   ( resid     28 and name     HN )      6.000   4.200  0.0
assign ( resid     26  and name       HN )   ( resid     29 and name     HN )      4.824   3.024  0.0
assign ( resid     26  and name       HG2# )   ( resid     29 and name     HN )      6.000   4.200  0.0
assign ( resid     26  and name       HG2# )   ( resid     29 and name     HG2 )      6.000   4.200  0.0
assign ( resid     26  and name       HN )   ( resid     30 and name     HB1 )      6.000   4.200  0.0
assign ( resid     27  and name       HN )   ( resid     27 and name     HA )      3.620   1.820  0.0
assign ( resid     27  and name       HN )   ( resid     27 and name     HB1 )      3.157   1.357  0.0
assign ( resid     27  and name       HN )   ( resid     27 and name     HB2 )      3.327   1.527  0.0
assign ( resid     27  and name       HN )   ( resid     27 and name     HD# )      6.000   4.200  0.0
assign ( resid     27  and name       HA )   ( resid     27 and name     HD# )      4.042   2.242  0.0
assign ( resid     27  and name       HB1 )   ( resid     27 and name     HD# )      4.982   3.182  0.0
assign ( resid     27  and name       HB2 )   ( resid     27 and name     HD# )      4.515   2.715  0.0
assign ( resid     27  and name       HA )   ( resid     27 and name     HB2 )      3.507   1.707  0.0
assign ( resid     27  and name       HB1 )   ( resid     27 and name     HB2 )      3.410   1.610  0.0
assign ( resid     27  and name       HD# )   ( resid     27 and name     HE# )      4.626   2.826  0.0
assign ( resid     27  and name       HD# )   ( resid     27 and name     HZ )      4.626   2.826  0.0
assign ( resid     27  and name       HE# )   ( resid     27 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     27 and name     HB1 )      6.000   4.200  0.0
assign ( resid     27  and name       HN )   ( resid     28 and name     HN )      3.918   2.118  0.0
assign ( resid     27  and name       HB1 )   ( resid     28 and name     HN )      5.435   3.635  0.0
assign ( resid     27  and name       HD# )   ( resid     28 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HD# )   ( resid     28 and name     HN )      6.000   4.200  0.0
assign ( resid     27  and name       HA )   ( resid     28 and name     HN )      4.954   3.154  0.0
assign ( resid     27  and name       HE# )   ( resid     28 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HN )   ( resid     29 and name     HN )      4.639   2.839  0.0
assign ( resid     27  and name       HA )   ( resid     29 and name     HN )      6.000   4.200  0.0
assign ( resid     27  and name       HB1 )   ( resid     29 and name     HN )      5.898   4.098  0.0
assign ( resid     27  and name       HA )   ( resid     30 and name     HN )      4.873   3.073  0.0
assign ( resid     27  and name       HA )   ( resid     30 and name     HB2 )      3.785   1.985  0.0
assign ( resid     27  and name       HA )   ( resid     30 and name     HB1 )      3.507   1.707  0.0
assign ( resid     27  and name       HE# )   ( resid     31 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     27  and name       HA )   ( resid     31 and name     HN )      3.743   1.943  0.0
assign ( resid     27  and name       HZ )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     27  and name       HB1 )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     46 and name     HG2 )      6.000   4.200  0.0
assign ( resid     27  and name       HZ )   ( resid     46 and name     HG2 )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     49 and name     HB2 )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     49 and name     HG2 )      6.000   4.200  0.0
assign ( resid     27  and name       HZ )   ( resid     49 and name     HB1 )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     49 and name     HD2 )      5.724   3.924  0.0
assign ( resid     27  and name       HZ )   ( resid     49 and name     HD2 )      5.724   3.924  0.0
assign ( resid     27  and name       HE# )   ( resid     49 and name     HD1 )      5.983   4.183  0.0
assign ( resid     27  and name       HZ )   ( resid     49 and name     HD1 )      5.983   4.183  0.0
assign ( resid     27  and name       HB1 )   ( resid     50 and name     HG2 )      6.000   4.200  0.0
assign ( resid     27  and name       HB2 )   ( resid     50 and name     HG2 )      6.000   4.200  0.0
assign ( resid     27  and name       HD# )   ( resid     50 and name     HG2 )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     50 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HE# )   ( resid     50 and name     HG1 )      6.000   4.200  0.0
assign ( resid     27  and name       HD# )   ( resid     50 and name     HN )      6.000   4.200  0.0
assign ( resid     27  and name       HZ )   ( resid     50 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HD# )   ( resid     50 and name     HA )      6.000   4.200  0.0
assign ( resid     27  and name       HN )   ( resid     53 and name     HE# )      6.000   4.200  0.0
assign ( resid     27  and name       HD# )   ( resid     53 and name     HB1 )      6.000   4.200  0.0
assign ( resid     27  and name       HD# )   ( resid     53 and name     HB2 )      4.468   2.668  0.0
assign ( resid     27  and name       HE# )   ( resid     53 and name     HB2 )      6.000   4.200  0.0
assign ( resid     27  and name       HB2 )   ( resid     54 and name     HD22 )      5.632   3.832  0.0
assign ( resid     28  and name       HN )   ( resid     28 and name     HA )      3.149   1.349  0.0
assign ( resid     28  and name       HN )   ( resid     29 and name     HN )      3.523   1.723  0.0
assign ( resid     28  and name       HN )   ( resid     29 and name     HG2 )      6.000   4.200  0.0
assign ( resid     28  and name       HA )   ( resid     29 and name     HG2 )      6.000   4.200  0.0
assign ( resid     28  and name       HA )   ( resid     30 and name     HN )      6.000   4.200  0.0
assign ( resid     28  and name       HN )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     28  and name       HA )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     28  and name       HA )   ( resid     31 and name     HN )      4.617   2.817  0.0
assign ( resid     28  and name       HA )   ( resid     32 and name     HN )      4.802   3.002  0.0
assign ( resid     29  and name       HN )   ( resid     29 and name     HA )      3.733   1.933  0.0
assign ( resid     29  and name       HN )   ( resid     29 and name     HG2 )      2.897   1.097  0.0
assign ( resid     29  and name       HA )   ( resid     29 and name     HG2 )      3.458   1.658  0.0
assign ( resid     29  and name       HA )   ( resid     29 and name     HB1 )      2.902   1.102  0.0
assign ( resid     29  and name       HB2 )   ( resid     29 and name     HN )      4.294   2.494  0.0
assign ( resid     29  and name       HN )   ( resid     30 and name     HB1 )      5.405   3.605  0.0
assign ( resid     29  and name       HN )   ( resid     30 and name     HN )      3.070   1.270  0.0
assign ( resid     29  and name       HB2 )   ( resid     30 and name     HN )      4.966   3.166  0.0
assign ( resid     29  and name       HA )   ( resid     30 and name     HN )      5.344   3.544  0.0
assign ( resid     29  and name       HB1 )   ( resid     30 and name     HN )      3.672   1.872  0.0
assign ( resid     29  and name       HA )   ( resid     30 and name     HB2 )      6.000   4.200  0.0
assign ( resid     29  and name       HN )   ( resid     31 and name     HN )      4.406   2.606  0.0
assign ( resid     29  and name       HN )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     29  and name       HA )   ( resid     31 and name     HN )      5.334   3.534  0.0
assign ( resid     29  and name       HA )   ( resid     32 and name     HN )      4.690   2.890  0.0
assign ( resid     29  and name       HA )   ( resid     33 and name     HN )      5.147   3.347  0.0
assign ( resid     30  and name       HN )   ( resid     30 and name     HD# )      6.000   4.200  0.0
assign ( resid     30  and name       HN )   ( resid     30 and name     HA )      4.107   2.307  0.0
assign ( resid     30  and name       HN )   ( resid     30 and name     HB1 )      3.110   1.310  0.0
assign ( resid     30  and name       HN )   ( resid     30 and name     HB2 )      3.011   1.211  0.0
assign ( resid     30  and name       HA )   ( resid     30 and name     HD# )      5.990   4.190  0.0
assign ( resid     30  and name       HA )   ( resid     30 and name     HB1 )      3.766   1.966  0.0
assign ( resid     30  and name       HA )   ( resid     30 and name     HB2 )      4.284   2.484  0.0
assign ( resid     30  and name       HB1 )   ( resid     30 and name     HB2 )      2.928   1.128  0.0
assign ( resid     30  and name       HD# )   ( resid     30 and name     HB1 )      5.892   4.092  0.0
assign ( resid     30  and name       HD# )   ( resid     30 and name     HB2 )      5.645   3.845  0.0
assign ( resid     30  and name       HN )   ( resid     31 and name     HN )      3.347   1.547  0.0
assign ( resid     30  and name       HN )   ( resid     31 and name     HB# )      6.000   4.200  0.0
assign ( resid     30  and name       HA )   ( resid     31 and name     HN )      5.655   3.855  0.0
assign ( resid     30  and name       HB1 )   ( resid     31 and name     HN )      4.653   2.853  0.0
assign ( resid     30  and name       HB2 )   ( resid     31 and name     HN )      4.031   2.231  0.0
assign ( resid     30  and name       HB2 )   ( resid     31 and name     HA )      6.000   4.200  0.0
assign ( resid     30  and name       HE# )   ( resid     31 and name     HA )      6.000   4.200  0.0
assign ( resid     30  and name       HD# )   ( resid     31 and name     HA )      6.000   4.200  0.0
assign ( resid     30  and name       HD# )   ( resid     31 and name     HN )      4.641   2.841  0.0
assign ( resid     30  and name       HN )   ( resid     32 and name     HN )      4.818   3.018  0.0
assign ( resid     30  and name       HA )   ( resid     33 and name     HN )      4.881   3.081  0.0
assign ( resid     30  and name       HA )   ( resid     33 and name     HD# )      6.000   4.200  0.0
assign ( resid     30  and name       HA )   ( resid     33 and name     HB1 )      4.458   2.658  0.0
assign ( resid     30  and name       HA )   ( resid     33 and name     HB2 )      5.071   3.271  0.0
assign ( resid     30  and name       HD# )   ( resid     33 and name     HB1 )      6.000   4.200  0.0
assign ( resid     30  and name       HA )   ( resid     34 and name     HN )      4.881   3.081  0.0
assign ( resid     30  and name       HE# )   ( resid     34 and name     HB1 )      6.000   4.200  0.0
assign ( resid     30  and name       HB1 )   ( resid     53 and name     HZ )      6.000   4.200  0.0
assign ( resid     30  and name       HB1 )   ( resid     53 and name     HE# )      5.524   3.724  0.0
assign ( resid     31  and name       HN )   ( resid     31 and name     HA )      3.743   1.943  0.0
assign ( resid     31  and name       HN )   ( resid     31 and name     HB# )      4.900   3.100  0.0
assign ( resid     31  and name       HA )   ( resid     31 and name     HB# )      5.325   3.525  0.0
assign ( resid     31  and name       HN )   ( resid     32 and name     HN )      3.222   1.422  0.0
assign ( resid     31  and name       HN )   ( resid     32 and name     HB# )      6.000   4.200  0.0
assign ( resid     31  and name       HA )   ( resid     32 and name     HN )      3.676   1.876  0.0
assign ( resid     31  and name       HB# )   ( resid     32 and name     HN )      6.000   4.200  0.0
assign ( resid     31  and name       HB# )   ( resid     32 and name     HA )      6.000   4.200  0.0
assign ( resid     31  and name       HN )   ( resid     33 and name     HN )      4.789   2.989  0.0
assign ( resid     31  and name       HA )   ( resid     33 and name     HN )      6.000   4.200  0.0
assign ( resid     31  and name       HA )   ( resid     34 and name     HN )      4.302   2.502  0.0
assign ( resid     31  and name       HB# )   ( resid     34 and name     HN )      6.000   4.200  0.0
assign ( resid     31  and name       HA )   ( resid     34 and name     HB2 )      3.188   1.388  0.0
assign ( resid     31  and name       HA )   ( resid     40 and name     HE# )      4.550   2.750  0.0
assign ( resid     31  and name       HB# )   ( resid     40 and name     HE# )      6.000   4.200  0.0
assign ( resid     31  and name       HB# )   ( resid     40 and name     HZ )      6.000   4.200  0.0
assign ( resid     32  and name       HN )   ( resid     32 and name     HA )      3.997   2.197  0.0
assign ( resid     32  and name       HN )   ( resid     32 and name     HB# )      4.900   3.100  0.0
assign ( resid     32  and name       HA )   ( resid     32 and name     HB# )      5.280   3.480  0.0
assign ( resid     32  and name       HN )   ( resid     33 and name     HN )      2.927   1.127  0.0
assign ( resid     32  and name       HA )   ( resid     33 and name     HN )      4.695   2.895  0.0
assign ( resid     32  and name       HB# )   ( resid     33 and name     HN )      6.000   4.200  0.0
assign ( resid     32  and name       HB# )   ( resid     33 and name     HA )      5.192   3.392  0.0
assign ( resid     32  and name       HA )   ( resid     35 and name     HN )      5.470   3.670  0.0
assign ( resid     32  and name       HA )   ( resid     35 and name     HB# )      6.000   4.200  0.0
assign ( resid     32  and name       HN )   ( resid     35 and name     HB# )      6.000   4.200  0.0
assign ( resid     33  and name       HN )   ( resid     33 and name     HA )      3.867   2.067  0.0
assign ( resid     33  and name       HN )   ( resid     33 and name     HB1 )      2.854   1.054  0.0
assign ( resid     33  and name       HN )   ( resid     33 and name     HB2 )      2.979   1.179  0.0
assign ( resid     33  and name       HN )   ( resid     33 and name     HG1 )      5.169   3.369  0.0
assign ( resid     33  and name       HN )   ( resid     33 and name     HG2 )      6.000   4.200  0.0
assign ( resid     33  and name       HA )   ( resid     33 and name     HB1 )      3.453   1.653  0.0
assign ( resid     33  and name       HA )   ( resid     33 and name     HB2 )      3.675   1.875  0.0
assign ( resid     33  and name       HA )   ( resid     33 and name     HG1 )      6.000   4.200  0.0
assign ( resid     33  and name       HA )   ( resid     33 and name     HG2 )      6.000   4.200  0.0
assign ( resid     33  and name       HB1 )   ( resid     33 and name     HG1 )      5.964   4.164  0.0
assign ( resid     33  and name       HB1 )   ( resid     33 and name     HG2 )      6.000   4.200  0.0
assign ( resid     33  and name       HB2 )   ( resid     33 and name     HG2 )      6.000   4.200  0.0
assign ( resid     33  and name       HD# )   ( resid     33 and name     HG2 )      3.109   1.309  0.0
assign ( resid     33  and name       HG1 )   ( resid     33 and name     HB# )      6.000   4.200  0.0
assign ( resid     33  and name       HG1 )   ( resid     33 and name     HD# )      6.000   4.200  0.0
assign ( resid     33  and name       HG2 )   ( resid     33 and name     HB# )      6.000   4.200  0.0
assign ( resid     33  and name       HB1 )   ( resid     33 and name     HB2 )      3.237   1.437  0.0
assign ( resid     33  and name       HG1 )   ( resid     33 and name     HG2 )      3.277   1.477  0.0
assign ( resid     33  and name       HA )   ( resid     34 and name     HN )      3.942   2.142  0.0
assign ( resid     33  and name       HB1 )   ( resid     34 and name     HN )      4.064   2.264  0.0
assign ( resid     33  and name       HG1 )   ( resid     34 and name     HN )      6.000   4.200  0.0
assign ( resid     33  and name       HG2 )   ( resid     34 and name     HN )      6.000   4.200  0.0
assign ( resid     33  and name       HB# )   ( resid     34 and name     HB2 )      6.000   4.200  0.0
assign ( resid     33  and name       HD# )   ( resid     34 and name     HE1 )      6.000   4.200  0.0
assign ( resid     33  and name       HB1 )   ( resid     34 and name     HE1 )      6.000   4.200  0.0
assign ( resid     33  and name       HN )   ( resid     35 and name     HB# )      6.000   4.200  0.0
assign ( resid     33  and name       HA )   ( resid     35 and name     HB# )      6.000   4.200  0.0
assign ( resid     33  and name       HA )   ( resid     35 and name     HN )      5.864   4.064  0.0
assign ( resid     34  and name       HN )   ( resid     34 and name     HA )      4.453   2.653  0.0
assign ( resid     34  and name       HN )   ( resid     34 and name     HB2 )      2.868   1.068  0.0
assign ( resid     34  and name       HA )   ( resid     34 and name     HB1 )      3.918   2.118  0.0
assign ( resid     34  and name       HA )   ( resid     34 and name     HB2 )      4.235   2.435  0.0
assign ( resid     34  and name       HB1 )   ( resid     34 and name     HB2 )      2.886   1.086  0.0
assign ( resid     34  and name       HN )   ( resid     35 and name     HN )      3.051   1.251  0.0
assign ( resid     34  and name       HA )   ( resid     35 and name     HN )      5.163   3.363  0.0
assign ( resid     34  and name       HB2 )   ( resid     35 and name     HN )      4.319   2.519  0.0
assign ( resid     34  and name       HN )   ( resid     35 and name     HB# )      6.000   4.200  0.0
assign ( resid     34  and name       HA )   ( resid     36 and name     HN )      4.568   2.768  0.0
assign ( resid     34  and name       HA )   ( resid     37 and name     HB2 )      5.136   3.336  0.0
assign ( resid     34  and name       HB1 )   ( resid     37 and name     HB2 )      6.000   4.200  0.0
assign ( resid     34  and name       HA )   ( resid     37 and name     HN )      4.269   2.469  0.0
assign ( resid     34  and name       HB1 )   ( resid     39 and name     HB2 )      6.000   4.200  0.0
assign ( resid     34  and name       HB1 )   ( resid     40 and name     HB1 )      6.000   4.200  0.0
assign ( resid     34  and name       HB2 )   ( resid     40 and name     HB1 )      6.000   4.200  0.0
assign ( resid     34  and name       HB2 )   ( resid     40 and name     HB2 )      6.000   4.200  0.0
assign ( resid     34  and name       HB1 )   ( resid     40 and name     HD# )      6.000   4.200  0.0
assign ( resid     34  and name       HB2 )   ( resid     40 and name     HD# )      6.000   4.200  0.0
assign ( resid     35  and name       HN )   ( resid     35 and name     HA )      4.302   2.502  0.0
assign ( resid     35  and name       HN )   ( resid     35 and name     HB# )      5.210   3.410  0.0
assign ( resid     35  and name       HA )   ( resid     35 and name     HB# )      5.519   3.719  0.0
assign ( resid     35  and name       HN )   ( resid     36 and name     HN )      3.821   2.021  0.0
assign ( resid     35  and name       HN )   ( resid     36 and name     HG# )      5.793   3.993  0.0
assign ( resid     35  and name       HB# )   ( resid     36 and name     HN )      6.000   4.200  0.0
assign ( resid     35  and name       HB# )   ( resid     36 and name     HA )      6.000   4.200  0.0
assign ( resid     35  and name       HA )   ( resid     36 and name     HN )      6.000   4.200  0.0
assign ( resid     35  and name       HA )   ( resid     37 and name     HN )      5.089   3.289  0.0
assign ( resid     35  and name       HN )   ( resid     37 and name     HN )      6.000   4.200  0.0
assign ( resid     35  and name       HB# )   ( resid     37 and name     HN )      6.000   4.200  0.0
assign ( resid     35  and name       HA )   ( resid     40 and name     HD# )      5.413   3.613  0.0
assign ( resid     35  and name       HB# )   ( resid     40 and name     HE# )      6.000   4.200  0.0
assign ( resid     35  and name       HB# )   ( resid     40 and name     HZ )      6.000   4.200  0.0
assign ( resid     35  and name       HA )   ( resid     40 and name     HE# )      5.651   3.851  0.0
assign ( resid     35  and name       HA )   ( resid     40 and name     HZ )      5.651   3.851  0.0
assign ( resid     36  and name       HN )   ( resid     36 and name     HA )      4.568   2.768  0.0
assign ( resid     36  and name       HN )   ( resid     36 and name     HB2 )      4.022   2.222  0.0
assign ( resid     36  and name       HN )   ( resid     36 and name     HG# )      4.368   2.568  0.0
assign ( resid     36  and name       HA )   ( resid     36 and name     HB2 )      3.717   1.917  0.0
assign ( resid     36  and name       HA )   ( resid     36 and name     HG# )      5.285   3.485  0.0
assign ( resid     36  and name       HB2 )   ( resid     36 and name     HG# )      3.750   1.950  0.0
assign ( resid     36  and name       HB1 )   ( resid     36 and name     HA )      6.000   4.200  0.0
assign ( resid     36  and name       HD# )   ( resid     36 and name     HB# )      6.000   4.200  0.0
assign ( resid     36  and name       HG# )   ( resid     36 and name     HB# )      6.000   4.200  0.0
assign ( resid     36  and name       HA )   ( resid     37 and name     HN )      4.269   2.469  0.0
assign ( resid     36  and name       HB2 )   ( resid     37 and name     HN )      4.581   2.781  0.0
assign ( resid     36  and name       HG# )   ( resid     37 and name     HN )      5.721   3.921  0.0
assign ( resid     36  and name       HA )   ( resid     37 and name     HB2 )      6.000   4.200  0.0
assign ( resid     37  and name       HN )   ( resid     37 and name     HA )      4.387   2.587  0.0
assign ( resid     37  and name       HN )   ( resid     37 and name     HB1 )      3.048   1.248  0.0
assign ( resid     37  and name       HN )   ( resid     37 and name     HB2 )      2.798   0.998  0.0
assign ( resid     37  and name       HA )   ( resid     37 and name     HB1 )      4.650   2.850  0.0
assign ( resid     37  and name       HA )   ( resid     37 and name     HB2 )      3.594   1.794  0.0
assign ( resid     37  and name       HB1 )   ( resid     37 and name     HB2 )      3.130   1.330  0.0
assign ( resid     37  and name       HB1 )   ( resid     39 and name     HN )      5.800   4.000  0.0
assign ( resid     37  and name       HA )   ( resid     39 and name     HN )      6.000   4.200  0.0
assign ( resid     37  and name       HB2 )   ( resid     39 and name     HN )      6.000   4.200  0.0
assign ( resid     37  and name       HN )   ( resid     40 and name     HB1 )      4.090   2.290  0.0
assign ( resid     37  and name       HN )   ( resid     40 and name     HB2 )      4.755   2.955  0.0
assign ( resid     37  and name       HB1 )   ( resid     40 and name     HN )      4.560   2.760  0.0
assign ( resid     37  and name       HB1 )   ( resid     40 and name     HB1 )      6.000   4.200  0.0
assign ( resid     37  and name       HB2 )   ( resid     40 and name     HN )      5.721   3.921  0.0
assign ( resid     37  and name       HB2 )   ( resid     40 and name     HB1 )      6.000   4.200  0.0
assign ( resid     38  and name       HA )   ( resid     39 and name     HN )      5.489   3.689  0.0
assign ( resid     38  and name       HA )   ( resid     40 and name     HN )      4.788   2.988  0.0
assign ( resid     38  and name       HA )   ( resid     41 and name     HN )      4.878   3.078  0.0
assign ( resid     38  and name       HA )   ( resid     41 and name     HB# )      6.000   4.200  0.0
assign ( resid     38  and name       HA )   ( resid     41 and name     HD# )      4.899   3.099  0.0
assign ( resid     39  and name       HN )   ( resid     39 and name     HE )      5.335   3.535  0.0
assign ( resid     39  and name       HN )   ( resid     39 and name     HA )      4.409   2.609  0.0
assign ( resid     39  and name       HN )   ( resid     39 and name     HB2 )      3.209   1.409  0.0
assign ( resid     39  and name       HN )   ( resid     39 and name     HG1 )      3.446   1.646  0.0
assign ( resid     39  and name       HN )   ( resid     39 and name     HB1 )      3.855   2.055  0.0
assign ( resid     39  and name       HN )   ( resid     39 and name     HD2 )      6.000   4.200  0.0
assign ( resid     39  and name       HA )   ( resid     39 and name     HB2 )      4.095   2.295  0.0
assign ( resid     39  and name       HA )   ( resid     39 and name     HG2 )      3.599   1.799  0.0
assign ( resid     39  and name       HA )   ( resid     39 and name     HG1 )      3.599   1.799  0.0
assign ( resid     39  and name       HA )   ( resid     39 and name     HB1 )      3.311   1.511  0.0
assign ( resid     39  and name       HD1 )   ( resid     39 and name     HE )      6.000   4.200  0.0
assign ( resid     39  and name       HD1 )   ( resid     39 and name     HB2 )      6.000   4.200  0.0
assign ( resid     39  and name       HD1 )   ( resid     39 and name     HG2 )      4.572   2.772  0.0
assign ( resid     39  and name       HD1 )   ( resid     39 and name     HG1 )      4.572   2.772  0.0
assign ( resid     39  and name       HD1 )   ( resid     39 and name     HB1 )      6.000   4.200  0.0
assign ( resid     39  and name       HD2 )   ( resid     39 and name     HE )      6.000   4.200  0.0
assign ( resid     39  and name       HD2 )   ( resid     39 and name     HB2 )      6.000   4.200  0.0
assign ( resid     39  and name       HD2 )   ( resid     39 and name     HG2 )      4.356   2.556  0.0
assign ( resid     39  and name       HD2 )   ( resid     39 and name     HG1 )      4.356   2.556  0.0
assign ( resid     39  and name       HD2 )   ( resid     39 and name     HB1 )      4.904   3.104  0.0
assign ( resid     39  and name       HB2 )   ( resid     39 and name     HG2 )      4.477   2.677  0.0
assign ( resid     39  and name       HB2 )   ( resid     39 and name     HG1 )      4.477   2.677  0.0
assign ( resid     39  and name       HB2 )   ( resid     39 and name     HB1 )      2.992   1.192  0.0
assign ( resid     39  and name       HB1 )   ( resid     39 and name     HE )      6.000   4.200  0.0
assign ( resid     39  and name       HG2 )   ( resid     39 and name     HE )      5.761   3.961  0.0
assign ( resid     39  and name       HG1 )   ( resid     39 and name     HE )      5.761   3.961  0.0
assign ( resid     39  and name       HD1 )   ( resid     39 and name     HD2 )      2.907   1.107  0.0
assign ( resid     39  and name       HN )   ( resid     40 and name     HN )      3.257   1.457  0.0
assign ( resid     39  and name       HA )   ( resid     40 and name     HN )      5.219   3.419  0.0
assign ( resid     39  and name       HB2 )   ( resid     40 and name     HN )      5.600   3.800  0.0
assign ( resid     39  and name       HN )   ( resid     42 and name     HB# )      6.000   4.200  0.0
assign ( resid     39  and name       HA )   ( resid     42 and name     HN )      4.571   2.771  0.0
assign ( resid     39  and name       HA )   ( resid     42 and name     HB# )      5.455   3.655  0.0
assign ( resid     40  and name       HN )   ( resid     40 and name     HD# )      6.000   4.200  0.0
assign ( resid     40  and name       HN )   ( resid     40 and name     HA )      4.118   2.318  0.0
assign ( resid     40  and name       HN )   ( resid     40 and name     HB1 )      2.874   1.074  0.0
assign ( resid     40  and name       HN )   ( resid     40 and name     HB2 )      3.180   1.380  0.0
assign ( resid     40  and name       HA )   ( resid     40 and name     HD# )      6.000   4.200  0.0
assign ( resid     40  and name       HA )   ( resid     40 and name     HB1 )      4.955   3.155  0.0
assign ( resid     40  and name       HA )   ( resid     40 and name     HB2 )      4.332   2.532  0.0
assign ( resid     40  and name       HB1 )   ( resid     40 and name     HD# )      5.632   3.832  0.0
assign ( resid     40  and name       HB1 )   ( resid     40 and name     HB2 )      3.552   1.752  0.0
assign ( resid     40  and name       HB2 )   ( resid     40 and name     HD# )      6.000   4.200  0.0
assign ( resid     40  and name       HD# )   ( resid     40 and name     HE# )      3.375   1.575  0.0
assign ( resid     40  and name       HN )   ( resid     41 and name     HG2 )      4.518   2.718  0.0
assign ( resid     40  and name       HB1 )   ( resid     41 and name     HN )      4.175   2.375  0.0
assign ( resid     40  and name       HB1 )   ( resid     41 and name     HG1 )      6.000   4.200  0.0
assign ( resid     40  and name       HD# )   ( resid     41 and name     HA )      6.000   4.200  0.0
assign ( resid     40  and name       HD# )   ( resid     41 and name     HN )      6.000   4.200  0.0
assign ( resid     40  and name       HA )   ( resid     41 and name     HN )      6.000   4.200  0.0
assign ( resid     40  and name       HB2 )   ( resid     41 and name     HN )      4.240   2.440  0.0
assign ( resid     40  and name       HN )   ( resid     42 and name     HB# )      5.933   4.133  0.0
assign ( resid     40  and name       HE# )   ( resid     46 and name     HG2 )      6.000   4.200  0.0
assign ( resid     40  and name       HZ )   ( resid     46 and name     HG2 )      6.000   4.200  0.0
assign ( resid     40  and name       HE# )   ( resid     49 and name     HB2 )      6.000   4.200  0.0
assign ( resid     41  and name       HN )   ( resid     41 and name     HA )      4.200   2.400  0.0
assign ( resid     41  and name       HA )   ( resid     41 and name     HB# )      6.000   4.200  0.0
assign ( resid     41  and name       HA )   ( resid     41 and name     HG1 )      4.583   2.783  0.0
assign ( resid     41  and name       HB# )   ( resid     41 and name     HN )      6.000   4.200  0.0
assign ( resid     41  and name       HG1 )   ( resid     41 and name     HN )      6.000   4.200  0.0
assign ( resid     41  and name       HG2 )   ( resid     41 and name     HN )      6.000   4.200  0.0
assign ( resid     41  and name       HG2 )   ( resid     41 and name     HA )      6.000   4.200  0.0
assign ( resid     41  and name       HB# )   ( resid     42 and name     HN )      6.000   4.200  0.0
assign ( resid     41  and name       HA )   ( resid     43 and name     HN )      5.475   3.675  0.0
assign ( resid     42  and name       HN )   ( resid     42 and name     HA )      3.365   1.565  0.0
assign ( resid     42  and name       HN )   ( resid     42 and name     HB# )      4.900   3.100  0.0
assign ( resid     42  and name       HA )   ( resid     42 and name     HB# )      5.214   3.414  0.0
assign ( resid     42  and name       HN )   ( resid     43 and name     HN )      3.554   1.754  0.0
assign ( resid     42  and name       HA )   ( resid     43 and name     HN )      4.705   2.905  0.0
assign ( resid     42  and name       HB# )   ( resid     43 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HN )   ( resid     43 and name     HA )      3.669   1.869  0.0
assign ( resid     43  and name       HN )   ( resid     43 and name     HB )      2.851   1.051  0.0
assign ( resid     43  and name       HN )   ( resid     43 and name     HG11 )      3.407   1.607  0.0
assign ( resid     43  and name       HN )   ( resid     43 and name     HG12 )      5.137   3.337  0.0
assign ( resid     43  and name       HN )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     43  and name       HN )   ( resid     43 and name     HG2# )      6.000   4.200  0.0
assign ( resid     43  and name       HB )   ( resid     43 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HB )   ( resid     43 and name     HG12 )      5.399   3.599  0.0
assign ( resid     43  and name       HB )   ( resid     43 and name     HG2# )      6.000   4.200  0.0
assign ( resid     43  and name       HG11 )   ( resid     43 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HG11 )   ( resid     43 and name     HG12 )      3.356   1.556  0.0
assign ( resid     43  and name       HG11 )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     43  and name       HG12 )   ( resid     43 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HG12 )   ( resid     43 and name     HD1# )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     43 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     43 and name     HG11 )      6.000   4.200  0.0
assign ( resid     43  and name       HD1# )   ( resid     43 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HB )   ( resid     43 and name     HG11 )      5.124   3.324  0.0
assign ( resid     43  and name       HA )   ( resid     44 and name     HN )      3.110   1.310  0.0
assign ( resid     43  and name       HG11 )   ( resid     44 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     44 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HG12 )   ( resid     44 and name     HN )      5.998   4.198  0.0
assign ( resid     43  and name       HG2# )   ( resid     45 and name     HB# )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     45 and name     HD# )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     45 and name     HG1 )      6.000   4.200  0.0
assign ( resid     43  and name       HA )   ( resid     45 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     45 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     46 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     48 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     48 and name     HB1 )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     48 and name     HB2 )      6.000   4.200  0.0
assign ( resid     43  and name       HN )   ( resid     49 and name     HG2 )      6.000   4.200  0.0
assign ( resid     43  and name       HB )   ( resid     49 and name     HG2 )      5.556   3.756  0.0
assign ( resid     43  and name       HG2# )   ( resid     49 and name     HN )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     49 and name     HA )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     49 and name     HG1 )      6.000   4.200  0.0
assign ( resid     43  and name       HG2# )   ( resid     49 and name     HG2 )      6.000   4.200  0.0
assign ( resid     43  and name       HD1# )   ( resid     49 and name     HB1 )      6.000   4.200  0.0
assign ( resid     44  and name       HN )   ( resid     44 and name     HA )      4.441   2.641  0.0
assign ( resid     44  and name       HN )   ( resid     44 and name     HG2 )      4.648   2.848  0.0
assign ( resid     44  and name       HA )   ( resid     44 and name     HG2 )      6.000   4.200  0.0
assign ( resid     44  and name       HA )   ( resid     44 and name     HB# )      3.030   1.230  0.0
assign ( resid     44  and name       HG1 )   ( resid     44 and name     HN )      6.000   4.200  0.0
assign ( resid     44  and name       HG1 )   ( resid     44 and name     HA )      6.000   4.200  0.0
assign ( resid     44  and name       HG1 )   ( resid     44 and name     HG2 )      2.400   0.600  0.0
assign ( resid     44  and name       HN )   ( resid     45 and name     HG1 )      6.000   4.200  0.0
assign ( resid     44  and name       HA )   ( resid     45 and name     HN )      5.562   3.762  0.0
assign ( resid     44  and name       HB# )   ( resid     45 and name     HG1 )      4.945   3.145  0.0
assign ( resid     45  and name       HN )   ( resid     45 and name     HA )      4.531   2.731  0.0
assign ( resid     45  and name       HN )   ( resid     45 and name     HB# )      5.349   3.549  0.0
assign ( resid     45  and name       HN )   ( resid     45 and name     HG1 )      3.828   2.028  0.0
assign ( resid     45  and name       HA )   ( resid     45 and name     HB# )      6.000   4.200  0.0
assign ( resid     45  and name       HA )   ( resid     45 and name     HG2 )      4.837   3.037  0.0
assign ( resid     45  and name       HD# )   ( resid     45 and name     HA )      6.000   4.200  0.0
assign ( resid     45  and name       HD# )   ( resid     45 and name     HB# )      6.000   4.200  0.0
assign ( resid     45  and name       HG1 )   ( resid     45 and name     HA )      6.000   4.200  0.0
assign ( resid     45  and name       HG2 )   ( resid     45 and name     HN )      6.000   4.200  0.0
assign ( resid     45  and name       HB# )   ( resid     48 and name     HN )      6.000   4.200  0.0
assign ( resid     45  and name       HB# )   ( resid     48 and name     HB1 )      6.000   4.200  0.0
assign ( resid     45  and name       HG2 )   ( resid     48 and name     HN )      5.373   3.573  0.0
assign ( resid     45  and name       HD# )   ( resid     48 and name     HA )      6.000   4.200  0.0
assign ( resid     45  and name       HB# )   ( resid     48 and name     HB2 )      6.000   4.200  0.0
assign ( resid     46  and name       HA )   ( resid     46 and name     HG1 )      5.546   3.746  0.0
assign ( resid     46  and name       HA )   ( resid     46 and name     HE# )      5.867   4.067  0.0
assign ( resid     46  and name       HG2 )   ( resid     46 and name     HA )      6.000   4.200  0.0
assign ( resid     46  and name       HA )   ( resid     49 and name     HN )      4.820   3.020  0.0
assign ( resid     46  and name       HA )   ( resid     49 and name     HD2 )      5.339   3.539  0.0
assign ( resid     46  and name       HA )   ( resid     49 and name     HG1 )      5.998   4.198  0.0
assign ( resid     46  and name       HA )   ( resid     49 and name     HB2 )      6.000   4.200  0.0
assign ( resid     46  and name       HA )   ( resid     50 and name     HN )      6.000   4.200  0.0
assign ( resid     47  and name       HB2 )   ( resid     47 and name     HA )      5.730   3.930  0.0
assign ( resid     47  and name       HB1 )   ( resid     47 and name     HA )      5.693   3.893  0.0
assign ( resid     47  and name       HA )   ( resid     48 and name     HN )      5.237   3.437  0.0
assign ( resid     47  and name       HB2 )   ( resid     48 and name     HN )      5.681   3.881  0.0
assign ( resid     47  and name       HG2 )   ( resid     48 and name     HN )      5.373   3.573  0.0
assign ( resid     47  and name       HB1 )   ( resid     48 and name     HA )      5.285   3.485  0.0
assign ( resid     47  and name       HB2 )   ( resid     48 and name     HB1 )      5.243   3.443  0.0
assign ( resid     47  and name       HB2 )   ( resid     48 and name     HB2 )      4.637   2.837  0.0
assign ( resid     47  and name       HA )   ( resid     49 and name     HN )      6.000   4.200  0.0
assign ( resid     47  and name       HA )   ( resid     50 and name     HB1 )      5.320   3.520  0.0
assign ( resid     47  and name       HA )   ( resid     50 and name     HN )      5.320   3.520  0.0
assign ( resid     48  and name       HN )   ( resid     48 and name     HA )      4.669   2.869  0.0
assign ( resid     48  and name       HN )   ( resid     48 and name     HB1 )      3.171   1.371  0.0
assign ( resid     48  and name       HN )   ( resid     48 and name     HB2 )      4.059   2.259  0.0
assign ( resid     48  and name       HA )   ( resid     48 and name     HB1 )      4.549   2.749  0.0
assign ( resid     48  and name       HA )   ( resid     48 and name     HB2 )      3.771   1.971  0.0
assign ( resid     48  and name       HB1 )   ( resid     48 and name     HB2 )      2.400   0.600  0.0
assign ( resid     48  and name       HN )   ( resid     49 and name     HN )      3.166   1.366  0.0
assign ( resid     48  and name       HB1 )   ( resid     49 and name     HN )      4.454   2.654  0.0
assign ( resid     48  and name       HB2 )   ( resid     49 and name     HN )      5.337   3.537  0.0
assign ( resid     48  and name       HA )   ( resid     49 and name     HN )      5.452   3.652  0.0
assign ( resid     48  and name       HN )   ( resid     50 and name     HN )      4.376   2.576  0.0
assign ( resid     48  and name       HA )   ( resid     50 and name     HN )      6.000   4.200  0.0
assign ( resid     48  and name       HB1 )   ( resid     50 and name     HN )      5.178   3.378  0.0
assign ( resid     48  and name       HA )   ( resid     51 and name     HN )      4.410   2.610  0.0
assign ( resid     48  and name       HA )   ( resid     51 and name     HB# )      5.679   3.879  0.0
assign ( resid     48  and name       HA )   ( resid     52 and name     HG )      6.000   4.200  0.0
assign ( resid     48  and name       HA )   ( resid     52 and name     HN )      6.000   4.200  0.0
assign ( resid     49  and name       HN )   ( resid     49 and name     HA )      4.362   2.562  0.0
assign ( resid     49  and name       HN )   ( resid     49 and name     HB2 )      3.194   1.394  0.0
assign ( resid     49  and name       HN )   ( resid     49 and name     HG1 )      3.199   1.399  0.0
assign ( resid     49  and name       HN )   ( resid     49 and name     HG2 )      5.094   3.294  0.0
assign ( resid     49  and name       HA )   ( resid     49 and name     HB2 )      4.889   3.089  0.0
assign ( resid     49  and name       HA )   ( resid     49 and name     HB1 )      3.600   1.800  0.0
assign ( resid     49  and name       HA )   ( resid     49 and name     HG2 )      5.682   3.882  0.0
assign ( resid     49  and name       HD2 )   ( resid     49 and name     HD1 )      4.182   2.382  0.0
assign ( resid     49  and name       HD2 )   ( resid     49 and name     HG2 )      6.000   4.200  0.0
assign ( resid     49  and name       HD1 )   ( resid     49 and name     HE )      6.000   4.200  0.0
assign ( resid     49  and name       HD1 )   ( resid     49 and name     HB2 )      6.000   4.200  0.0
assign ( resid     49  and name       HD1 )   ( resid     49 and name     HG2 )      6.000   4.200  0.0
assign ( resid     49  and name       HB2 )   ( resid     49 and name     HB1 )      3.123   1.323  0.0
assign ( resid     49  and name       HB1 )   ( resid     49 and name     HG2 )      5.350   3.550  0.0
assign ( resid     49  and name       HG1 )   ( resid     49 and name     HD2 )      6.000   4.200  0.0
assign ( resid     49  and name       HG1 )   ( resid     49 and name     HB2 )      5.337   3.537  0.0
assign ( resid     49  and name       HG1 )   ( resid     49 and name     HG2 )      3.752   1.952  0.0
assign ( resid     49  and name       HG2 )   ( resid     49 and name     HE )      6.000   4.200  0.0
assign ( resid     49  and name       HN )   ( resid     50 and name     HN )      3.100   1.300  0.0
assign ( resid     49  and name       HN )   ( resid     50 and name     HB1 )      4.977   3.177  0.0
assign ( resid     49  and name       HB2 )   ( resid     50 and name     HN )      4.421   2.621  0.0
assign ( resid     49  and name       HB1 )   ( resid     50 and name     HN )      6.000   4.200  0.0
assign ( resid     49  and name       HA )   ( resid     50 and name     HA )      6.000   4.200  0.0
assign ( resid     49  and name       HA )   ( resid     50 and name     HN )      6.000   4.200  0.0
assign ( resid     49  and name       HD2 )   ( resid     50 and name     HN )      6.000   4.200  0.0
assign ( resid     49  and name       HA )   ( resid     52 and name     HD2# )      6.000   4.200  0.0
assign ( resid     49  and name       HA )   ( resid     52 and name     HN )      4.796   2.996  0.0
assign ( resid     49  and name       HB1 )   ( resid     53 and name     HB2 )      5.985   4.185  0.0
assign ( resid     50  and name       HN )   ( resid     50 and name     HA )      4.077   2.277  0.0
assign ( resid     50  and name       HN )   ( resid     50 and name     HB2 )      3.018   1.218  0.0
assign ( resid     50  and name       HN )   ( resid     50 and name     HB1 )      3.077   1.277  0.0
assign ( resid     50  and name       HA )   ( resid     50 and name     HG2 )      5.319   3.519  0.0
assign ( resid     50  and name       HA )   ( resid     50 and name     HB1 )      4.003   2.203  0.0
assign ( resid     50  and name       HG1 )   ( resid     50 and name     HA )      6.000   4.200  0.0
assign ( resid     50  and name       HG1 )   ( resid     50 and name     HB1 )      5.929   4.129  0.0
assign ( resid     50  and name       HG2 )   ( resid     50 and name     HB1 )      5.770   3.970  0.0
assign ( resid     50  and name       HB2 )   ( resid     50 and name     HB1 )      3.109   1.309  0.0
assign ( resid     50  and name       HG1 )   ( resid     50 and name     HG2 )      2.929   1.129  0.0
assign ( resid     50  and name       HN )   ( resid     51 and name     HN )      3.132   1.332  0.0
assign ( resid     50  and name       HA )   ( resid     51 and name     HN )      5.060   3.260  0.0
assign ( resid     50  and name       HG1 )   ( resid     51 and name     HA )      6.000   4.200  0.0
assign ( resid     50  and name       HB2 )   ( resid     51 and name     HN )      4.240   2.440  0.0
assign ( resid     50  and name       HB1 )   ( resid     51 and name     HN )      6.000   4.200  0.0
assign ( resid     50  and name       HA )   ( resid     52 and name     HN )      6.000   4.200  0.0
assign ( resid     50  and name       HA )   ( resid     53 and name     HN )      5.880   4.080  0.0
assign ( resid     50  and name       HA )   ( resid     53 and name     HB1 )      4.240   2.440  0.0
assign ( resid     50  and name       HG1 )   ( resid     54 and name     HD22 )      6.000   4.200  0.0
assign ( resid     50  and name       HG2 )   ( resid     54 and name     HD22 )      6.000   4.200  0.0
assign ( resid     50  and name       HG2 )   ( resid     54 and name     HN )      6.000   4.200  0.0
assign ( resid     50  and name       HG1 )   ( resid     54 and name     HD21 )      5.799   3.999  0.0
assign ( resid     50  and name       HG2 )   ( resid     54 and name     HD21 )      6.000   4.200  0.0
assign ( resid     51  and name       HN )   ( resid     51 and name     HA )      3.395   1.595  0.0
assign ( resid     51  and name       HN )   ( resid     51 and name     HB# )      4.900   3.100  0.0
assign ( resid     51  and name       HA )   ( resid     51 and name     HB# )      5.295   3.495  0.0
assign ( resid     51  and name       HB# )   ( resid     52 and name     HN )      5.368   3.568  0.0
assign ( resid     51  and name       HA )   ( resid     52 and name     HN )      5.145   3.345  0.0
assign ( resid     51  and name       HB# )   ( resid     53 and name     HN )      6.000   4.200  0.0
assign ( resid     51  and name       HA )   ( resid     54 and name     HN )      5.279   3.479  0.0
assign ( resid     51  and name       HA )   ( resid     54 and name     HD22 )      6.000   4.200  0.0
assign ( resid     51  and name       HB# )   ( resid     54 and name     HN )      6.000   4.200  0.0
assign ( resid     51  and name       HA )   ( resid     54 and name     HD21 )      5.783   3.983  0.0
assign ( resid     51  and name       HB# )   ( resid     54 and name     HD21 )      6.000   4.200  0.0
assign ( resid     51  and name       HA )   ( resid     54 and name     HB2 )      6.000   4.200  0.0
assign ( resid     51  and name       HA )   ( resid     55 and name     HN )      6.000   4.200  0.0
assign ( resid     51  and name       HB# )   ( resid     55 and name     HN )      6.000   4.200  0.0
assign ( resid     52  and name       HN )   ( resid     52 and name     HA )      4.130   2.330  0.0
assign ( resid     52  and name       HN )   ( resid     52 and name     HB2 )      2.680   0.880  0.0
assign ( resid     52  and name       HN )   ( resid     52 and name     HG )      2.833   1.033  0.0
assign ( resid     52  and name       HN )   ( resid     52 and name     HB1 )      3.845   2.045  0.0
assign ( resid     52  and name       HN )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     52  and name       HN )   ( resid     52 and name     HD2# )      6.000   4.200  0.0
assign ( resid     52  and name       HA )   ( resid     52 and name     HG )      3.454   1.654  0.0
assign ( resid     52  and name       HA )   ( resid     52 and name     HB1 )      3.919   2.119  0.0
assign ( resid     52  and name       HA )   ( resid     52 and name     HD1# )      5.621   3.821  0.0
assign ( resid     52  and name       HA )   ( resid     52 and name     HD2# )      6.000   4.200  0.0
assign ( resid     52  and name       HB2 )   ( resid     52 and name     HA )      5.329   3.529  0.0
assign ( resid     52  and name       HB2 )   ( resid     52 and name     HB1 )      2.637   0.837  0.0
assign ( resid     52  and name       HB2 )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     52  and name       HB2 )   ( resid     52 and name     HD2# )      5.821   4.021  0.0
assign ( resid     52  and name       HB1 )   ( resid     52 and name     HG )      3.129   1.329  0.0
assign ( resid     52  and name       HB1 )   ( resid     52 and name     HD2# )      6.000   4.200  0.0
assign ( resid     52  and name       HG )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     52  and name       HD2# )   ( resid     52 and name     HD1# )      5.617   3.817  0.0
assign ( resid     52  and name       HB1 )   ( resid     52 and name     HD1# )      6.000   4.200  0.0
assign ( resid     52  and name       HN )   ( resid     53 and name     HN )      3.316   1.516  0.0
assign ( resid     52  and name       HB2 )   ( resid     53 and name     HN )      4.386   2.586  0.0
assign ( resid     52  and name       HB1 )   ( resid     53 and name     HN )      5.557   3.757  0.0
assign ( resid     52  and name       HA )   ( resid     53 and name     HN )      5.553   3.753  0.0
assign ( resid     52  and name       HD1# )   ( resid     53 and name     HN )      6.000   4.200  0.0
assign ( resid     52  and name       HD2# )   ( resid     53 and name     HN )      6.000   4.200  0.0
assign ( resid     52  and name       HN )   ( resid     54 and name     HN )      5.339   3.539  0.0
assign ( resid     52  and name       HA )   ( resid     55 and name     HN )      4.920   3.120  0.0
assign ( resid     52  and name       HA )   ( resid     55 and name     HB# )      3.763   1.963  0.0
assign ( resid     52  and name       HA )   ( resid     56 and name     HN )      5.313   3.513  0.0
assign ( resid     53  and name       HN )   ( resid     53 and name     HD# )      5.863   4.063  0.0
assign ( resid     53  and name       HN )   ( resid     53 and name     HA )      4.549   2.749  0.0
assign ( resid     53  and name       HN )   ( resid     53 and name     HB1 )      3.095   1.295  0.0
assign ( resid     53  and name       HN )   ( resid     53 and name     HB2 )      3.223   1.423  0.0
assign ( resid     53  and name       HA )   ( resid     53 and name     HD# )      6.000   4.200  0.0
assign ( resid     53  and name       HA )   ( resid     53 and name     HB1 )      4.471   2.671  0.0
assign ( resid     53  and name       HA )   ( resid     53 and name     HB2 )      3.745   1.945  0.0
assign ( resid     53  and name       HB1 )   ( resid     53 and name     HB2 )      2.848   1.048  0.0
assign ( resid     53  and name       HN )   ( resid     54 and name     HN )      3.389   1.589  0.0
assign ( resid     53  and name       HB1 )   ( resid     54 and name     HN )      4.453   2.653  0.0
assign ( resid     53  and name       HB2 )   ( resid     54 and name     HN )      5.183   3.383  0.0
assign ( resid     53  and name       HD# )   ( resid     54 and name     HN )      4.829   3.029  0.0
assign ( resid     53  and name       HE# )   ( resid     54 and name     HA )      6.000   4.200  0.0
assign ( resid     53  and name       HD# )   ( resid     54 and name     HA )      6.000   4.200  0.0
assign ( resid     53  and name       HA )   ( resid     56 and name     HB2 )      3.745   1.945  0.0
assign ( resid     53  and name       HA )   ( resid     56 and name     HN )      6.000   4.200  0.0
assign ( resid     53  and name       HA )   ( resid     56 and name     HB1 )      4.260   2.460  0.0
assign ( resid     53  and name       HA )   ( resid     56 and name     HD# )      6.000   4.200  0.0
assign ( resid     53  and name       HA )   ( resid     57 and name     HN )      5.111   3.311  0.0
assign ( resid     53  and name       HE# )   ( resid     57 and name     HG2# )      6.000   4.200  0.0
assign ( resid     54  and name       HN )   ( resid     54 and name     HD21 )      5.799   3.999  0.0
assign ( resid     54  and name       HN )   ( resid     54 and name     HA )      4.031   2.231  0.0
assign ( resid     54  and name       HD22 )   ( resid     54 and name     HD21 )      2.400   0.600  0.0
assign ( resid     54  and name       HD21 )   ( resid     54 and name     HB1 )      4.417   2.617  0.0
assign ( resid     54  and name       HD21 )   ( resid     54 and name     HB2 )      4.883   3.083  0.0
assign ( resid     54  and name       HD22 )   ( resid     54 and name     HB1 )      5.626   3.826  0.0
assign ( resid     54  and name       HD22 )   ( resid     54 and name     HB2 )      5.632   3.832  0.0
assign ( resid     54  and name       HN )   ( resid     54 and name     HD22 )      6.000   4.200  0.0
assign ( resid     54  and name       HA )   ( resid     54 and name     HD22 )      6.000   4.200  0.0
assign ( resid     54  and name       HA )   ( resid     54 and name     HB1 )      4.120   2.320  0.0
assign ( resid     54  and name       HA )   ( resid     54 and name     HB2 )      3.688   1.888  0.0
assign ( resid     54  and name       HB1 )   ( resid     54 and name     HB2 )      2.469   0.669  0.0
assign ( resid     54  and name       HN )   ( resid     55 and name     HN )      3.547   1.747  0.0
assign ( resid     54  and name       HB1 )   ( resid     55 and name     HN )      4.386   2.586  0.0
assign ( resid     54  and name       HA )   ( resid     55 and name     HN )      5.527   3.727  0.0
assign ( resid     54  and name       HB2 )   ( resid     55 and name     HN )      3.949   2.149  0.0
assign ( resid     54  and name       HN )   ( resid     56 and name     HN )      4.751   2.951  0.0
assign ( resid     54  and name       HA )   ( resid     57 and name     HN )      5.033   3.233  0.0
assign ( resid     54  and name       HA )   ( resid     57 and name     HG2# )      6.000   4.200  0.0
assign ( resid     54  and name       HA )   ( resid     57 and name     HG1# )      6.000   4.200  0.0
assign ( resid     54  and name       HA )   ( resid     58 and name     HN )      5.870   4.070  0.0
assign ( resid     55  and name       HN )   ( resid     55 and name     HA )      3.708   1.908  0.0
assign ( resid     55  and name       HN )   ( resid     55 and name     HB# )      2.809   1.009  0.0
assign ( resid     55  and name       HA )   ( resid     55 and name     HB# )      2.902   1.102  0.0
assign ( resid     55  and name       HB# )   ( resid     56 and name     HB1 )      6.000   4.200  0.0
assign ( resid     55  and name       HA )   ( resid     56 and name     HN )      5.344   3.544  0.0
assign ( resid     55  and name       HA )   ( resid     57 and name     HN )      6.000   4.200  0.0
assign ( resid     55  and name       HN )   ( resid     58 and name     HB# )      6.000   4.200  0.0
assign ( resid     55  and name       HA )   ( resid     58 and name     HB# )      5.847   4.047  0.0
assign ( resid     56  and name       HN )   ( resid     56 and name     HD# )      6.000   4.200  0.0
assign ( resid     56  and name       HN )   ( resid     56 and name     HA )      3.964   2.164  0.0
assign ( resid     56  and name       HN )   ( resid     56 and name     HB1 )      3.046   1.246  0.0
assign ( resid     56  and name       HN )   ( resid     56 and name     HB2 )      2.749   0.949  0.0
assign ( resid     56  and name       HA )   ( resid     56 and name     HD# )      6.000   4.200  0.0
assign ( resid     56  and name       HB1 )   ( resid     56 and name     HD# )      5.023   3.223  0.0
assign ( resid     56  and name       HB2 )   ( resid     56 and name     HD# )      4.838   3.038  0.0
assign ( resid     56  and name       HB1 )   ( resid     56 and name     HA )      5.040   3.240  0.0
assign ( resid     56  and name       HB2 )   ( resid     56 and name     HA )      4.564   2.764  0.0
assign ( resid     56  and name       HN )   ( resid     57 and name     HN )      3.171   1.371  0.0
assign ( resid     56  and name       HA )   ( resid     57 and name     HN )      5.825   4.025  0.0
assign ( resid     56  and name       HA )   ( resid     57 and name     HA )      6.000   4.200  0.0
assign ( resid     56  and name       HB1 )   ( resid     57 and name     HN )      4.559   2.759  0.0
assign ( resid     56  and name       HB2 )   ( resid     57 and name     HN )      5.077   3.277  0.0
assign ( resid     56  and name       HE# )   ( resid     57 and name     HA )      6.000   4.200  0.0
assign ( resid     56  and name       HD# )   ( resid     57 and name     HN )      5.797   3.997  0.0
assign ( resid     56  and name       HD# )   ( resid     57 and name     HA )      5.909   4.109  0.0
assign ( resid     56  and name       HA )   ( resid     58 and name     HN )      6.000   4.200  0.0
assign ( resid     56  and name       HA )   ( resid     59 and name     HB# )      6.000   4.200  0.0
assign ( resid     56  and name       HZ )   ( resid     60 and name     HA )      6.000   4.200  0.0
assign ( resid     57  and name       HN )   ( resid     57 and name     HA )      4.480   2.680  0.0
assign ( resid     57  and name       HN )   ( resid     57 and name     HB )      3.186   1.386  0.0
assign ( resid     57  and name       HN )   ( resid     57 and name     HG2# )      4.973   3.173  0.0
assign ( resid     57  and name       HA )   ( resid     57 and name     HB )      3.900   2.100  0.0
assign ( resid     57  and name       HA )   ( resid     57 and name     HG1# )      5.525   3.725  0.0
assign ( resid     57  and name       HB )   ( resid     57 and name     HG1# )      5.416   3.616  0.0
assign ( resid     57  and name       HG1# )   ( resid     57 and name     HN )      6.000   4.200  0.0
assign ( resid     57  and name       HG2# )   ( resid     57 and name     HA )      6.000   4.200  0.0
assign ( resid     57  and name       HG2# )   ( resid     57 and name     HB )      6.000   4.200  0.0
assign ( resid     57  and name       HN )   ( resid     58 and name     HN )      3.492   1.692  0.0
assign ( resid     57  and name       HN )   ( resid     58 and name     HB# )      6.000   4.200  0.0
assign ( resid     57  and name       HA )   ( resid     58 and name     HN )      4.336   2.536  0.0
assign ( resid     57  and name       HB )   ( resid     58 and name     HN )      4.963   3.163  0.0
assign ( resid     57  and name       HG1# )   ( resid     58 and name     HN )      6.000   4.200  0.0
assign ( resid     57  and name       HG2# )   ( resid     58 and name     HN )      6.000   4.200  0.0
assign ( resid     57  and name       HG1# )   ( resid     58 and name     HA )      6.000   4.200  0.0
assign ( resid     57  and name       HA )   ( resid     59 and name     HN )      6.000   4.200  0.0
assign ( resid     57  and name       HB )   ( resid     59 and name     HN )      5.381   3.581  0.0
assign ( resid     57  and name       HN )   ( resid     60 and name     HB# )      6.000   4.200  0.0
assign ( resid     57  and name       HA )   ( resid     60 and name     HB# )      6.000   4.200  0.0
assign ( resid     57  and name       HA )   ( resid     60 and name     HN )      5.807   4.007  0.0
assign ( resid     57  and name       HA )   ( resid     61 and name     HB2 )      5.794   3.994  0.0
assign ( resid     57  and name       HG1# )   ( resid     61 and name     HB2 )      6.000   4.200  0.0
assign ( resid     58  and name       HN )   ( resid     58 and name     HA )      3.107   1.307  0.0
assign ( resid     58  and name       HN )   ( resid     58 and name     HB# )      4.900   3.100  0.0
assign ( resid     58  and name       HA )   ( resid     58 and name     HB# )      5.048   3.248  0.0
assign ( resid     58  and name       HN )   ( resid     59 and name     HN )      2.844   1.044  0.0
assign ( resid     58  and name       HB# )   ( resid     59 and name     HN )      6.000   4.200  0.0
assign ( resid     58  and name       HA )   ( resid     61 and name     HD# )      6.000   4.200  0.0
assign ( resid     59  and name       HN )   ( resid     59 and name     HA )      3.253   1.453  0.0
assign ( resid     59  and name       HN )   ( resid     59 and name     HB# )      4.900   3.100  0.0
assign ( resid     59  and name       HA )   ( resid     59 and name     HB# )      5.170   3.370  0.0
assign ( resid     59  and name       HB# )   ( resid     60 and name     HA )      6.000   4.200  0.0
assign ( resid     59  and name       HB# )   ( resid     61 and name     HN )      6.000   4.200  0.0
assign ( resid     60  and name       HN )   ( resid     60 and name     HA )      3.314   1.514  0.0
assign ( resid     60  and name       HN )   ( resid     60 and name     HB# )      4.900   3.100  0.0
assign ( resid     60  and name       HA )   ( resid     60 and name     HB# )      5.064   3.264  0.0
assign ( resid     60  and name       HA )   ( resid     61 and name     HN )      3.975   2.175  0.0
assign ( resid     60  and name       HB# )   ( resid     61 and name     HN )      6.000   4.200  0.0
assign ( resid     60  and name       HB# )   ( resid     61 and name     HB2 )      6.000   4.200  0.0
assign ( resid     61  and name       HN )   ( resid     61 and name     HB2 )      3.294   1.494  0.0
assign ( resid     61  and name       HN )   ( resid     61 and name     HB1 )      3.815   2.015  0.0
assign ( resid     61  and name       HA )   ( resid     61 and name     HN )      3.839   2.039  0.0
assign ( resid     61  and name       HA )   ( resid     61 and name     HD# )      6.000   4.200  0.0
assign ( resid     61  and name       HA )   ( resid     61 and name     HB1 )      3.484   1.684  0.0
assign ( resid     61  and name       HA )   ( resid     61 and name     HB2 )      3.945   2.145  0.0
assign ( resid     61  and name       HA )   ( resid     61 and name     HG2 )      5.134   3.334  0.0
assign ( resid     61  and name       HD# )   ( resid     61 and name     HG1 )      4.556   2.756  0.0
assign ( resid     61  and name       HD# )   ( resid     61 and name     HB2 )      4.556   2.756  0.0
assign ( resid     61  and name       HD# )   ( resid     61 and name     HB1 )      6.000   4.200  0.0
assign ( resid     61  and name       HG1 )   ( resid     61 and name     HA )      6.000   4.200  0.0
assign ( resid     61  and name       HG2 )   ( resid     61 and name     HN )      6.000   4.200  0.0



assign ( resid   11 and name   HN )  ( resid   7 and name    O ) 2.00 0.20 0.00 
assign ( resid   11 and name    N )  ( resid   7 and name    O ) 3.00 1.20 0.00 
assign ( resid   12 and name   HN )  ( resid   8 and name    O ) 2.00 0.20 0.00 
assign ( resid   12 and name    N )  ( resid   8 and name    O ) 3.00 1.20 0.00 
assign ( resid   13 and name   HN )  ( resid   9 and name    O ) 2.00 0.20 0.00 
assign ( resid   13 and name    N )  ( resid   9 and name    O ) 3.00 1.20 0.00 
assign ( resid   14 and name   HN )  ( resid   10 and name    O ) 2.00 0.20 0.00 
assign ( resid   14 and name    N )  ( resid   10 and name    O ) 3.00 1.20 0.00 
assign ( resid   15 and name   HN )  ( resid   11 and name    O ) 2.00 0.20 0.00 
assign ( resid   15 and name    N )  ( resid   11 and name    O ) 3.00 1.20 0.00 
assign ( resid   16 and name   HN )  ( resid   12 and name    O ) 2.00 0.20 0.00 
assign ( resid   16 and name    N )  ( resid   12 and name    O ) 3.00 1.20 0.00 
assign ( resid   17 and name   HN )  ( resid   13 and name    O ) 2.00 0.20 0.00 
assign ( resid   17 and name    N )  ( resid   13 and name    O ) 3.00 1.20 0.00 
assign ( resid   18 and name   HN )  ( resid   14 and name    O ) 2.00 0.20 0.00 
assign ( resid   18 and name    N )  ( resid   14 and name    O ) 3.00 1.20 0.00 
assign ( resid   31 and name   HN )  ( resid   27 and name    O ) 2.00 0.20 0.00 
assign ( resid   31 and name    N )  ( resid   27 and name    O ) 3.00 1.20 0.00 
assign ( resid   32 and name   HN )  ( resid   28 and name    O ) 2.00 0.20 0.00 
assign ( resid   32 and name    N )  ( resid   28 and name    O ) 3.00 1.20 0.00 
assign ( resid   33 and name   HN )  ( resid   29 and name    O ) 2.00 0.20 0.00 
assign ( resid   33 and name    N )  ( resid   29 and name    O ) 3.00 1.20 0.00 
assign ( resid   34 and name   HN )  ( resid   30 and name    O ) 2.00 0.20 0.00 !!
assign ( resid   34 and name    N )  ( resid   30 and name    O ) 3.00 1.20 0.00 !!
assign ( resid   50 and name   HN )  ( resid   46 and name    O ) 2.00 0.20 0.00 
assign ( resid   50 and name    N )  ( resid   46 and name    O ) 3.00 1.20 0.00 
assign ( resid   51 and name   HN )  ( resid   47 and name    O ) 2.00 0.20 0.00 
assign ( resid   51 and name    N )  ( resid   47 and name    O ) 3.00 1.20 0.00 
assign ( resid   52 and name   HN )  ( resid   48 and name    O ) 2.00 0.20 0.00 
assign ( resid   52 and name    N )  ( resid   48 and name    O ) 3.00 1.20 0.00 
assign ( resid   53 and name   HN )  ( resid   49 and name    O ) 2.00 0.20 0.00 
assign ( resid   53 and name    N )  ( resid   49 and name    O ) 3.00 1.20 0.00 
assign ( resid   54 and name   HN )  ( resid   50 and name    O ) 2.00 0.20 0.00 
assign ( resid   54 and name    N )  ( resid   50 and name    O ) 3.00 1.20 0.00 
assign ( resid   55 and name   HN )  ( resid   51 and name    O ) 2.00 0.20 0.00 
assign ( resid   55 and name    N )  ( resid   51 and name    O ) 3.00 1.20 0.00 
assign ( resid   56 and name   HN )  ( resid   52 and name    O ) 2.00 0.20 0.00 
assign ( resid   56 and name    N )  ( resid   52 and name    O ) 3.00 1.20 0.00 
assign ( resid   57 and name   HN )  ( resid   53 and name    O ) 2.00 0.20 0.00 
assign ( resid   57 and name    N )  ( resid   53 and name    O ) 3.00 1.20 0.00 
assign ( resid   58 and name   HN )  ( resid   54 and name    O ) 2.00 0.20 0.00 
assign ( resid   58 and name    N )  ( resid   54 and name    O ) 3.00 1.20 0.00 
assign ( resid   59 and name   HN )  ( resid   55 and name    O ) 2.00 0.20 0.00 
assign ( resid   59 and name    N )  ( resid   55 and name    O ) 3.00 1.20 0.00 
assign ( resid   60 and name   HN )  ( resid   56 and name    O ) 2.00 0.20 0.00 
assign ( resid   60 and name    N )  ( resid   56 and name    O ) 3.00 1.20 0.00 



assign (resid     6  and name       C)   (resid     7 and name     N)      
       (resid     7  and name       CA)   (resid     7 and name     C)      1.0   -64.0  8.0  2
assign (resid     7  and name       N)   (resid     7 and name     CA)      
       (resid     7  and name       C)   (resid     8 and name     N)      1.0   -44.0   5.0  2

assign (resid     7  and name       C)   (resid     8 and name     N)      
       (resid     8  and name       CA)   (resid     8 and name     C)      1.0   -66.0   20.0  2
assign (resid     8  and name       N)   (resid     8 and name     CA)      
       (resid     8  and name       C)   (resid     9 and name     N)      1.0   -35.8  20.0  2

assign (resid     8  and name       C)   (resid     9 and name     N)      
       (resid     9  and name       CA)   (resid     9 and name     C)      1.0   -68.8  20.0  2
assign (resid     9  and name       N)   (resid     9 and name     CA)      
       (resid     9  and name       C)   (resid     10 and name     N)      1.0   -36.6  20.0  2

assign (resid     9  and name       C)   (resid     10 and name     N)      
       (resid     10  and name       CA)   (resid     10 and name     C)      1.0   -77.2  20.0  2
assign (resid     10  and name       N)   (resid     10 and name     CA)      
       (resid     10  and name       C)   (resid     11 and name     N)      1.0   -29.8  20.0  2

assign (resid     10  and name       C)   (resid     11 and name     N)      
       (resid     11  and name       CA)   (resid     11 and name     C)      1.0   -80.2  20.0  2
assign (resid     11  and name       N)   (resid     11 and name     CA)      
       (resid     11  and name       C)   (resid     12 and name     N)      1.0   -27.6  20.0  2

assign (resid     11  and name       C)   (resid     12 and name     N)      
       (resid     12  and name       CA)   (resid     12 and name     C)      1.0   -88.0  20.0  2
assign (resid     12  and name       N)   (resid     12 and name     CA)      
       (resid     12  and name       C)   (resid     13 and name     N)      1.0   -53.4  20.0  2

assign (resid     12  and name       C)   (resid     13 and name     N)      
       (resid     13  and name       CA)   (resid     13 and name     C)      1.0   -40.1  20.0  2
assign (resid     13  and name       N)   (resid     13 and name     CA)      
       (resid     13  and name       C)   (resid     14 and name     N)      1.0   -61.5  25.0  2

assign (resid     13  and name       C)   (resid     14 and name     N)      
       (resid     14  and name       CA)   (resid     14 and name     C)      1.0   -65.0    25.0  2
assign (resid     14  and name       N)   (resid     14 and name     CA)      
       (resid     14  and name       C)   (resid     15 and name     N)      1.0   -41.0      25.0  2

assign (resid     14  and name       C)   (resid     15 and name     N)      
       (resid     15  and name       CA)   (resid     15 and name     C)      1.0   -54.1  20.0  2
assign (resid     15  and name       N)   (resid     15 and name     CA)      
       (resid     15  and name       C)   (resid     16 and name     N)      1.0   -58.0  20.0  2

assign (resid     15  and name       C)   (resid     16 and name     N)      
       (resid     16  and name       CA)   (resid     16 and name     C)      1.0   -53.2  20.0  2
assign (resid     16  and name       N)   (resid     16 and name     CA)      
       (resid     16  and name       C)   (resid     17 and name     N)      1.0   -40.4  20.0  2

assign (resid     16  and name       C)   (resid     17 and name     N)      
       (resid     17  and name       CA)   (resid     17 and name     C)      1.0   -68.0  20.0  2
assign (resid     17  and name       N)   (resid     17 and name     CA)      
       (resid     17  and name       C)   (resid     18 and name     N)      1.0   -30.8  20.0  2

assign (resid     17  and name       C)   (resid     18 and name     N)      
       (resid     18  and name       CA)   (resid     18 and name     C)      1.0   -74.0    20.0  2
assign (resid     18  and name       N)   (resid     18 and name     CA)      
       (resid     18  and name       C)   (resid     19 and name     N)      1.0   -22.0  25.0  2

assign (resid     18  and name       C)   (resid     19 and name     N)      
       (resid     19  and name       CA)   (resid     19 and name     C)      1.0   -95.0   15.0  2
assign (resid     19  and name       N)   (resid     19 and name     CA)      
       (resid     19  and name       C)   (resid     20 and name     N)      1.0   3.0  14.0  2

assign (resid     19  and name       C)   (resid     20 and name     N)      
       (resid     20  and name       CA)   (resid     20 and name     C)      1.0   -70.0     23.0  2
assign (resid     20  and name       N)   (resid     20 and name     CA)      
       (resid     20  and name       C)   (resid     21 and name     N)      1.0   137.0     16.0  2

assign (resid     20  and name       C)   (resid     21 and name     N)      
      (resid     21  and name       CA)   (resid     21 and name     C)      1.0   -107.0       25.0  2
assign (resid     21  and name       N)   (resid     21 and name     CA)      
       (resid     21  and name       C)   (resid     22 and name     N)      1.0   147.0        18.0  2

assign (resid     22  and name       C)   (resid     23 and name     N)      
       (resid     23  and name       CA)   (resid     23 and name     C)      1.0   -59.0  9.0  2
assign (resid     23  and name       N)   (resid     23 and name     CA)      
       (resid     23  and name       C)   (resid     24 and name     N)      1.0   -20.0   6.0  2

assign (resid     23  and name       C)   (resid     24 and name     N)      
       (resid     24  and name       CA)   (resid     24 and name     C)      1.0   -90.0  10.0  2
assign (resid     24  and name       N)   (resid     24 and name     CA)      
       (resid     24  and name       C)   (resid     25 and name     N)      1.0   3.0   6.0  2

assign (resid     24  and name       C)   (resid     25 and name     N)      
       (resid     25  and name       CA)   (resid     25 and name     C)      1.0   -91.0    32.0  2
assign (resid     25  and name       N)   (resid     25 and name     CA)      
       (resid     25  and name       C)   (resid     26 and name     N)      1.0   156.0     12.0  2

assign (resid     25  and name       C)   (resid     26 and name     N)      
       (resid     26  and name       CA)   (resid     26 and name     C)      1.0   -105.0  26.0  2
assign (resid     26  and name       N)   (resid     26 and name     CA)      
       (resid     26  and name       C)   (resid     27 and name     N)      1.0   167.0   10.0  2

assign (resid     26  and name       C)   (resid     27 and name     N)      
       (resid     27  and name       CA)   (resid     27 and name     C)      1.0   -61.0   15.0  2
assign (resid     27  and name       N)   (resid     27 and name     CA)      
       (resid     27  and name       C)   (resid     28 and name     N)      1.0   -38.0   15.0  2

assign (resid     27  and name       C)   (resid     28 and name     N)      
       (resid     28  and name       CA)   (resid     28 and name     C)      1.0   -83.6  25.0  2
assign (resid     28  and name       N)   (resid     28 and name     CA)      
       (resid     28  and name       C)   (resid     29 and name     N)      1.0   -30.1  25.0  2

assign (resid     28  and name       C)   (resid     29 and name     N)      
       (resid     29  and name       CA)   (resid     29 and name     C)      1.0   -73.1  15.0  2
assign (resid     29  and name       N)   (resid     29 and name     CA)      
       (resid     29  and name       C)   (resid     30 and name     N)      1.0   -43.8  15.0  2

assign (resid     29  and name       C)   (resid     30 and name     N)      
       (resid     30  and name       CA)   (resid     30 and name     C)      1.0   -85.1  15.0  2
assign (resid     30  and name       N)   (resid     30 and name     CA)      
       (resid     30  and name       C)   (resid     31 and name     N)      1.0   -21.4  15.0  2

assign (resid     30  and name       C)   (resid     31 and name     N)      
       (resid     31  and name       CA)   (resid     31 and name     C)      1.0   -77.8  15.0  2
assign (resid     31  and name       N)   (resid     31 and name     CA)      
       (resid     31  and name       C)   (resid     32 and name     N)      1.0   -62.0  25.0  2

assign (resid     31  and name       C)   (resid     32 and name     N)      
       (resid     32  and name       CA)   (resid     32 and name     C)      1.0   -69.7  15.0  2
assign (resid     32  and name       N)   (resid     32 and name     CA)      
       (resid     32  and name       C)   (resid     33 and name     N)      1.0   -25.4  15.0  2

assign (resid     32  and name       C)   (resid     33 and name     N)      
       (resid     33  and name       CA)   (resid     33 and name     C)      1.0   -71.8  15.0  2
assign (resid     33  and name       N)   (resid     33 and name     CA)      
       (resid     33  and name       C)   (resid     34 and name     N)      1.0   -16.0  20.0  2

assign (resid     33  and name       C)   (resid     34 and name     N)      
       (resid     34  and name       CA)   (resid     34 and name     C)      1.0   -83.0      15.0  2
assign (resid     34  and name       N)   (resid     34 and name     CA)      
       (resid     34  and name       C)   (resid     35 and name     N)      1.0   2.0     13.0  2

assign (resid     34  and name       C)   (resid     35 and name     N)      
       (resid     35  and name       CA)   (resid     35 and name     C)      1.0   -65.0     17.0  2
assign (resid     35  and name       N)   (resid     35 and name     CA)      
       (resid     35  and name       C)   (resid     36 and name     N)      1.0   -26.0      10.0  2

assign (resid     35  and name       C)   (resid     36 and name     N)      
       (resid     36 and name       CA)   (resid     36 and name     C)      1.0   -93.0  12.0  2
assign (resid     36 and name       N)   (resid     36 and name     CA)      
       (resid     36 and name       C)   (resid     37 and name     N)      1.0   1.0  12.0  2

assign (resid     36  and name       C)   (resid     37 and name     N)      
       (resid     37 and name       CA)   (resid     37 and name     C)      1.0   -84.0  18.0  2
assign (resid     37 and name       N)   (resid     37 and name     CA)      
       (resid     37 and name       C)   (resid     38 and name     N)      1.0   132.0  25.0  2

assign (resid     38  and name       C)   (resid     39 and name     N)      
       (resid     39 and name       CA)   (resid     39 and name     C)      1.0   -65.0  7.0  2
assign (resid     39 and name       N)   (resid     39 and name     CA)      
       (resid     39 and name       C)   (resid     40 and name     N)      1.0   -37.0  8.0  2

assign (resid     39 and name       C)   (resid     40 and name     N)      
       (resid     40 and name       CA)   (resid     40 and name     C)      1.0   -82.0  18.0  2
assign (resid     40 and name       N)   (resid     40 and name     CA)      
       (resid     40 and name       C)   (resid     41 and name     N)      1.0   -32.0  17.0  2

assign (resid     40 and name       C)   (resid     41 and name     N)      
       (resid     41 and name       CA)   (resid     41 and name     C)      1.0   -70.0  12.0  2
assign (resid     41 and name       N)   (resid     41 and name     CA)      
       (resid     41 and name       C)   (resid     42 and name     N)      1.0   -28.0  15.0  2

assign (resid     41 and name       C)   (resid     42 and name     N)      
      (resid     42 and name       CA)   (resid     42 and name     C)      1.0   -80.0  12.0  2
assign (resid     42 and name       N)   (resid     42 and name     CA)      
       (resid     42 and name       C)   (resid     43 and name     N)      1.0   -28.0  18.0  2

assign (resid     43 and name       C)   (resid     44 and name     N)      
       (resid     44 and name       CA)   (resid     44 and name     C)      1.0   -67.0     17.0  2
assign (resid     44 and name       N)   (resid     44 and name     CA)      
       (resid     44 and name       C)   (resid     45 and name     N)      1.0   -26.0     12.0  2

assign (resid     47  and name       C)   (resid     48 and name     N)      
       (resid     48  and name       CA)   (resid     48 and name     C)      1.0   -66.0  20.0  2
assign (resid     48  and name       N)   (resid     48 and name     CA)      
       (resid     48  and name       C)   (resid     49 and name     N)      1.0   -18.7  30.0  2

assign (resid     48  and name       C)   (resid     49 and name     N)      
       (resid     49  and name       CA)   (resid     49 and name     C)      1.0   -78.5  20.0  2
assign (resid     49  and name       N)   (resid     49 and name     CA)      
       (resid     49  and name       C)   (resid     50 and name     N)      1.0   -39.4  20.0  2

assign (resid     49  and name       C)   (resid     50 and name     N)      
       (resid     50  and name       CA)   (resid     50 and name     C)      1.0   -63.1  20.0  2
assign (resid     50  and name       N)   (resid     50 and name     CA)      
       (resid     50  and name       C)   (resid     51 and name     N)      1.0   -48.6  20.0  2

assign (resid     50  and name       C)   (resid     51 and name     N)      
       (resid     51  and name       CA)   (resid     51 and name     C)      1.0   -52.9  20.0  2
assign (resid     51  and name       N)   (resid     51 and name     CA)      
       (resid     51  and name       C)   (resid     52 and name     N)      1.0   -42.0 20.0  2

assign (resid     51  and name       C)   (resid     52 and name     N)      
       (resid     52  and name       CA)   (resid     52 and name     C)      1.0   -68.3  20.0  2
assign (resid     52  and name       N)   (resid     52 and name     CA)      
       (resid     52  and name       C)   (resid     53 and name     N)      1.0   -43.0  20.0  2

assign (resid     52  and name       C)   (resid     53 and name     N)      
       (resid     53  and name       CA)   (resid     53 and name     C)      1.0   -66.5  20.0  2
assign (resid     53  and name       N)   (resid     53 and name     CA)      
       (resid     53  and name       C)   (resid     54 and name     N)      1.0   -44.7  20.0  2

assign (resid     53  and name       C)   (resid     54 and name     N)      
       (resid     54  and name       CA)   (resid     54 and name     C)      1.0   -75.8  20.0  2
assign (resid     54  and name       N)   (resid     54 and name     CA)      
       (resid     54  and name       C)   (resid     55 and name     N)      1.0   -51.8  20.0  2

assign (resid     54  and name       C)   (resid     55 and name     N)      
       (resid     55  and name       CA)   (resid     55 and name     C)      1.0   -49.3  20.0  2
assign (resid     55  and name       N)   (resid     55 and name     CA)      
       (resid     55  and name       C)   (resid     56 and name     N)      1.0   -32.5  20.0  2

assign (resid     55  and name       C)   (resid     56 and name     N)      
       (resid     56  and name       CA)   (resid     56 and name     C)      1.0   -89.7  20.0  2
assign (resid     56  and name       N)   (resid     56 and name     CA)      
       (resid     56  and name       C)   (resid     57 and name     N)      1.0   -32.3  20.0  2

assign (resid     56  and name       C)   (resid     57 and name     N)      
       (resid     57  and name       CA)   (resid     57 and name     C)      1.0   -65.9  20.0  2
assign (resid     57  and name       N)   (resid     57 and name     CA)      
       (resid     57  and name       C)   (resid     58 and name     N)      1.0   -18.8  20.0  2

assign (resid     57  and name       C)   (resid     58 and name     N)      
       (resid     58  and name       CA)   (resid     58 and name     C)      1.0   -74.9  20.0  2
assign (resid     58  and name       N)   (resid     58 and name     CA)      
       (resid     58  and name       C)   (resid     59 and name     N)      1.0   -42.1  20.0  2

assign (resid     58  and name       C)   (resid     59 and name     N)      
       (resid     59  and name       CA)   (resid     59 and name     C)      1.0   -56.7  20.0  2
assign (resid     59  and name       N)   (resid     59 and name     CA)      
       (resid     59  and name       C)   (resid     60 and name     N)      1.0   -17.9  20.0  2

assign (resid     59  and name       C)   (resid     60 and name     N)      
       (resid     60  and name       CA)   (resid     60 and name     C)      1.0   -76.7  25.0  2
assign (resid     60  and name       N)   (resid     60 and name     CA)      
       (resid     60  and name       C)   (resid     61 and name     N)      1.0   -11.0  20.0  2

assign (resid     60  and name       C)   (resid     61 and name     N)      
       (resid     61  and name       CA)   (resid     61 and name     C)      1.0   -78.0    20.0  2
assign (resid     61  and name       N)   (resid     61 and name     CA)      
       (resid     61  and name       C)   (resid     62 and name     N)      1.0   -15.0   25.0  2


! rdc has been scaled to NH rdc
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 5    and name N   )
       ( resid 5    and name HN  )   -14.54   1.04


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   )
       ( resid 6    and name HN  )   -13.65   1.03


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   )
       ( resid 8    and name HN  )   -16.45   3.63


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   )
       ( resid 9    and name HN  )   -19.38   1.95


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10    and name N   )
       ( resid 10    and name HN  )   -5.58   1.15


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11    and name N   )
       ( resid 11    and name HN  )   -13.11   5.1


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12    and name N   )
       ( resid 12    and name HN  )   -20.92   2.17


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13    and name N   )
       ( resid 13    and name HN  )   -18.3   0.48


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14    and name N   )
       ( resid 14    and name HN  )   -10.79   2.0


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16    and name N   )
       ( resid 16    and name HN  )   -18.09   3.39


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17    and name N   )
       ( resid 17    and name HN  )   -10.19   1.55


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18    and name N   )
       ( resid 18    and name HN  )   -9.34   0.05


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19    and name N   )
       ( resid 19    and name HN  )   -13.51   0.94


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20    and name N   )
       ( resid 20    and name HN  )   -8.14   0.76


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21    and name N   )
       ( resid 21    and name HN  )   -7.87   0.73


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24    and name N   )
       ( resid 24    and name HN  )   -7.81   0.49


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25    and name N   )
       ( resid 25    and name HN  )   2.27   1.74


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26    and name N   )
       ( resid 26    and name HN  )   -10.43   1.7


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27    and name N   )
       ( resid 27    and name HN  )   12.06   1.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28    and name N   )
       ( resid 28    and name HN  )   19.6   0.84


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 29    and name N   )
       ( resid 29    and name HN  )   16.24   1.07


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 30    and name N   )
       ( resid 30    and name HN  )   12.02   0.53


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 31    and name N   )
       ( resid 31    and name HN  )   17.73   1.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 32    and name N   )
       ( resid 32    and name HN  )   21.45   1.25


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 33    and name N   )
       ( resid 33    and name HN  )   14.07   0.29


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 34    and name N   )
       ( resid 34    and name HN  )   16.81   0.49


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 35    and name N   )
       ( resid 35    and name HN  )   -1.85   0.44


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 36    and name N   )
       ( resid 36    and name HN  )   -10.71   1.57


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 37    and name N   )
       ( resid 37    and name HN  )   17.8   1.13


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 39    and name N   )
       ( resid 39    and name HN  )   -15.94   0.48


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 40    and name N   )
       ( resid 40    and name HN  )   -1.5   0.5


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 41    and name N   )
       ( resid 41    and name HN  )   -2.46   1.14


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 42    and name N   )
       ( resid 42    and name HN  )   -8.4   1.92


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 43    and name N   )
       ( resid 43    and name HN  )   -18.54   1.46


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 44    and name N   )
       ( resid 44    and name HN  )   -13.02   1.2


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 45    and name N   )
       ( resid 45    and name HN  )   -5.74   1.13


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 48    and name N   )
       ( resid 48    and name HN  )   11.81   1.48


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 49    and name N   )
       ( resid 49    and name HN  )   0.81   1.0


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 50    and name N   )
       ( resid 50    and name HN  )   -2.35   1.55


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 51    and name N   )
       ( resid 51    and name HN  )   1.5   1.69


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 52    and name N   )
       ( resid 52    and name HN  )   9.36   1.39


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 53    and name N   )
       ( resid 53    and name HN  )   1.32   0.54


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 54    and name N   )
       ( resid 54    and name HN  )   -1.69   0.91


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 55    and name N   )
       ( resid 55    and name HN  )   6.42   0.36


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 56    and name N   )
       ( resid 56    and name HN  )   5.76   0.43


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 57    and name N   )
       ( resid 57    and name HN  )   -0.25   0.81


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 58    and name N   )
       ( resid 58    and name HN  )   -1.67   2.4


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 59    and name N   )
       ( resid 59    and name HN  )   11.02   1.74


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 60    and name N   )
       ( resid 60    and name HN  )   1.15   0.9


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 61    and name N   )
       ( resid 61    and name HN  )   -4.74   1.2


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 62    and name N   )
       ( resid 62    and name HN  )   1.07   1.04


! rdc has been scaled to NH rdc
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 4    and name CA  )
       ( resid 4    and name HA  )   -0.64   0.18


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 5    and name CA  )
       ( resid 5    and name HA  )   -9.91   0.72


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name CA  )
       ( resid 8    and name HA  )   -3.8   1.7


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name CA  )
       ( resid 9    and name HA  )   -7.5   0.44


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10    and name CA  )
       ( resid 10    and name HA  )   17.54   0.48


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11    and name CA  )
       ( resid 11    and name HA  )   -3.92   0.57


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12    and name CA  )
       ( resid 12    and name HA  )   -9.54   0.91


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13    and name CA  )
       ( resid 13    and name HA  )   8.36   0.62


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15    and name CA  )
       ( resid 15    and name HA  )   1.25   0.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16    and name CA  )
       ( resid 16    and name HA  )   -13.36   1.02


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17    and name CA  )
       ( resid 17    and name HA  )   17.89   0.12


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18    and name CA  )
       ( resid 18    and name HA  )   -1.16   0.13


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19    and name CA  )
       ( resid 19    and name HA  )   4.36   0.47


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20    and name CA  )
       ( resid 20    and name HA  )   -2.85   0.9


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21    and name CA  )
       ( resid 21    and name HA  )   -9.0   0.24


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23    and name CA  )
       ( resid 23    and name HA  )   -6.21   0.67


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24    and name CA  )
       ( resid 24    and name HA  )   -3.16   0.37


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25    and name CA  )
       ( resid 25    and name HA  )   -8.72   0.38


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26    and name CA  )
       ( resid 26    and name HA  )   1.32   0.39


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27    and name CA  )
       ( resid 27    and name HA  )   5.4   0.53


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28    and name CA  )
       ( resid 28    and name HA  )   2.62   2.66


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 29    and name CA  )
       ( resid 29    and name HA  )   -1.51   1.25


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 30    and name CA  )
       ( resid 30    and name HA  )   -7.36   0.22


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 31    and name CA  )
       ( resid 31    and name HA  )   0.51   0.53


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 32    and name CA  )
       ( resid 32    and name HA  )   4.17   0.5


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 33    and name CA  )
       ( resid 33    and name HA  )   -7.27   0.6


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 34    and name CA  )
       ( resid 34    and name HA  )   7.41   0.25


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 35    and name CA  )
       ( resid 35    and name HA  )   -12.55   0.51


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 36    and name CA  )
       ( resid 36    and name HA  )   -4.77   0.71


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 39    and name CA  )
       ( resid 39    and name HA  )   -14.77   1.13


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 40    and name CA  )
       ( resid 40    and name HA  )   11.28   1.83


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 41    and name CA  )
       ( resid 41    and name HA  )   11.19   0.67


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 42    and name CA  )
       ( resid 42    and name HA  )   7.67   0.66


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 43    and name CA  )
       ( resid 43    and name HA  )   -19.92   1.18


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 44    and name CA  )
       ( resid 44    and name HA  )   -2.03   0.84


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 47    and name CA  )
       ( resid 47    and name HA  )   -3.6   0.65


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 48    and name CA  )
       ( resid 48    and name HA  )   11.32   0.12


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 49    and name CA  )
       ( resid 49    and name HA  )   1.95   0.41


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 50    and name CA  )
       ( resid 50    and name HA  )   -19.81   0.59


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 51    and name CA  )
       ( resid 51    and name HA  )   20.15   0.45


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 52    and name CA  )
       ( resid 52    and name HA  )   -4.68   1.26


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 53    and name CA  )
       ( resid 53    and name HA  )   1.01   0.19


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 54    and name CA  )
       ( resid 54    and name HA  )   -15.91   0.76


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 55    and name CA  )
       ( resid 55    and name HA  )   19.35   0.87


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 56    and name CA  )
       ( resid 56    and name HA  )   -5.08   0.36


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 57    and name CA  )
       ( resid 57    and name HA  )   -6.81   0.67


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 58    and name CA  )
       ( resid 58    and name HA  )   -0.19   0.35


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 59    and name CA  )
       ( resid 59    and name HA  )   7.47   0.74


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 60    and name CA  )
       ( resid 60    and name HA  )   1.82   0.59


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 61    and name CA  )
       ( resid 61    and name HA  )   -10.54   0.38


! rdc has been scaled to NH rdc
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 4    and name C  )
       ( resid 5    and name N   )   6.21   3.52


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name C  )
       ( resid 8    and name N   )   -1.77   2.73


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name C  )
       ( resid 9    and name N   )   1.6   4.13


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name C  )
       ( resid 10    and name N   )   3.12   0.98


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10    and name C  )
       ( resid 11    and name N   )   11.1   1.91


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11    and name C  )
       ( resid 12    and name N   )   4.25   0.58


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12    and name C  )
       ( resid 13    and name N   )   -3.85   0.87


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13    and name C  )
       ( resid 14    and name N   )   16.78   1.03


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15    and name C  )
       ( resid 16    and name N   )   8.41   2.26


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16    and name C  )
       ( resid 17    and name N   )   -3.28   1.65


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17    and name C  )
       ( resid 18    and name N   )   13.79   4.56


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18    and name C  )
       ( resid 19    and name N   )   1.5   6.14


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19    and name C  )
       ( resid 20    and name N   )   -2.61   4.7


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20    and name C  )
       ( resid 21    and name N   )   -2.66   4.48


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23    and name C  )
       ( resid 24    and name N   )   -13.67   3.54


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24    and name C  )
       ( resid 25    and name N   )   10.98   12.58


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25    and name C  )
       ( resid 26    and name N   )   -0.51   5.51


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26    and name C  )
       ( resid 27    and name N   )   -13.5   5.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27    and name C  )
       ( resid 28    and name N   )   -0.11   1.75


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28    and name C  )
       ( resid 29    and name N   )   -3.3   4.87


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 29    and name C  )
       ( resid 30    and name N   )   -10.12   2.12


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 30    and name C  )
       ( resid 31    and name N   )   -4.65   1.7


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 31    and name C  )
       ( resid 32    and name N   )   -10.23   1.71


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 32    and name C  )
       ( resid 33    and name N   )   -0.04   2.94


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 33    and name C  )
       ( resid 34    and name N   )   -15.69   1.08


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 34    and name C  )
       ( resid 35    and name N   )   -2.74   1.66


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 35    and name C  )
       ( resid 36    and name N   )   -2.83   5.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 36    and name C  )
       ( resid 37    and name N   )   3.35   6.39


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 38    and name C  )
       ( resid 39    and name N   )   2.16   4.92


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 39    and name C  )
       ( resid 40    and name N   )   -9.45   0.4


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 40    and name C  )
       ( resid 41    and name N   )   16.0   6.21


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 41    and name C  )
       ( resid 42    and name N   )   -0.23   0.86


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 42    and name C  )
       ( resid 43    and name N   )   11.98   3.97


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 43    and name C  )
       ( resid 44    and name N   )   -9.71   10.41


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 44    and name C  )
       ( resid 45    and name N   )   10.78   6.04


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 47    and name C  )
       ( resid 48    and name N   )   11.87   2.02


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 48    and name C  )
       ( resid 49    and name N   )   -7.25   1.9


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 49    and name C  )
       ( resid 50    and name N   )   8.25   0.58


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 50    and name C  )
       ( resid 51    and name N   )   -18.3   0.54


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 51    and name C  )
       ( resid 52    and name N   )   16.77   2.26


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 52    and name C  )
       ( resid 53    and name N   )   -9.42   1.91


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 53    and name C  )
       ( resid 54    and name N   )   0.95   1.52


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 54    and name C  )
       ( resid 55    and name N   )   -6.66   6.6


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 55    and name C  )
       ( resid 56    and name N   )   4.69   4.71


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 56    and name C  )
       ( resid 57    and name N   )   -1.64   1.37


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 57    and name C  )
       ( resid 58    and name N   )   -13.5   0.79


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 58    and name C  )
       ( resid 59    and name N   )   9.25   4.26


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 59    and name C  )
       ( resid 60    and name N   )   -8.05   5.7


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 60    and name C  )
       ( resid 61    and name N   )   0.1   5.58


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 61    and name C  )
       ( resid 62    and name N   )   -7.18   13.85


! rdc has been scaled to NH rdc
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 4    and name CA  )
       ( resid 4    and name C   )   -2.31   3.64


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 5    and name CA  )
       ( resid 5    and name C   )   -2.08   7.76


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name CA  )
       ( resid 7    and name C   )   -8.84   6.04


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name CA  )
       ( resid 8    and name C   )   13.69   8.25


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name CA  )
       ( resid 9    and name C   )   -7.88   2.72


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10    and name CA  )
       ( resid 10    and name C   )   -10.81   6.36


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11    and name CA  )
       ( resid 11    and name C   )   -0.18   0.61


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12    and name CA  )
       ( resid 12    and name C   )   1.44   1.62


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13    and name CA  )
       ( resid 13    and name C   )   -7.69   2.33


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14    and name CA  )
       ( resid 14    and name C   )   -15.57   6.84


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15    and name CA  )
       ( resid 15    and name C   )   9.1   9.87


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16    and name CA  )
       ( resid 16    and name C   )   -3.76   2.33


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17    and name CA  )
       ( resid 17    and name C   )   -11.18   1.51


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18    and name CA  )
       ( resid 18    and name C   )   -9.74   2.81


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19    and name CA  )
       ( resid 19    and name C   )   6.5   5.24


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20    and name CA  )
       ( resid 20    and name C   )   5.97   2.86


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23    and name CA  )
       ( resid 23    and name C   )   4.49   1.57


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24    and name CA  )
       ( resid 24    and name C   )   3.83   3.64


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25    and name CA  )
       ( resid 25    and name C   )   -13.79   1.41


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26    and name CA  )
       ( resid 26    and name C   )   11.28   14.53


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27    and name CA  )
       ( resid 27    and name C   )   0.72   1.74


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28    and name CA  )
       ( resid 28    and name C   )   -8.88   6.96


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 29    and name CA  )
       ( resid 29    and name C   )   6.76   4.21


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 30    and name CA  )
       ( resid 30    and name C   )   9.83   5.38


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 31    and name CA  )
       ( resid 31    and name C   )   -3.9   3.2


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 32    and name CA  )
       ( resid 32    and name C   )   5.1   2.59


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 33    and name CA  )
       ( resid 33    and name C   )   -0.58   7.12


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 34    and name CA  )
       ( resid 34    and name C   )   -2.29   4.35


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 35    and name CA  )
       ( resid 35    and name C   )   17.42   3.96


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 36    and name CA  )
       ( resid 36    and name C   )   -3.34   5.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 38    and name CA  )
       ( resid 38    and name C   )   2.7   15.07


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 39    and name CA  )
       ( resid 39    and name C   )   14.03   5.67


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 40    and name CA  )
       ( resid 40    and name C   )   -10.95   11.77


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 41    and name CA  )
       ( resid 41    and name C   )   -16.84   5.61


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 42    and name CA  )
       ( resid 42    and name C   )   4.7   7.15


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 43    and name CA  )
       ( resid 43    and name C   )   -0.88   8.84


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 44    and name CA  )
       ( resid 44    and name C   )   9.72   3.3


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 47    and name CA  )
       ( resid 47    and name C   )   -6.41   1.35


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 48    and name CA  )
       ( resid 48    and name C   )   -16.13   12.58


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 49    and name CA  )
       ( resid 49    and name C   )   9.55   2.42


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 50    and name CA  )
       ( resid 50    and name C   )   -1.81   2.26


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 51    and name CA  )
       ( resid 51    and name C   )   0.96   2.79


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 52    and name CA  )
       ( resid 52    and name C   )   -13.96   4.78


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 53    and name CA  )
       ( resid 53    and name C   )   19.18   4.67


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 54    and name CA  )
       ( resid 54    and name C   )   -2.6   4.55


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 55    and name CA  )
       ( resid 55    and name C   )   -9.18   3.18


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 56    and name CA  )
       ( resid 56    and name C   )   -2.4   2.27


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 57    and name CA  )
       ( resid 57    and name C   )   13.09   3.47


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 58    and name CA  )
       ( resid 58    and name C   )   -0.76   0.7


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 59    and name CA  )
       ( resid 59    and name C   )   -11.82   1.02


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 60    and name CA  )
       ( resid 60    and name C   )   7.45   5.97


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 61    and name CA  )
       ( resid 61    and name C   )   4.48   2.48



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ILE   5           H        ILE   5 -12.557 -10.980 -11.266
    2    HA   ILE   5           HA       ILE   5 -11.435 -10.104 -13.093
    3    HB   ILE   5           HB       ILE   5 -13.262  -7.649 -12.482
    4   HG12  ILE   5          1HG1      ILE   5 -13.879  -9.993 -14.427
    5   HG13  ILE   5          2HG1      ILE   5 -14.477  -9.976 -12.780
    6   HG21  ILE   5          1HG2      ILE   5 -13.045  -7.570 -15.250
    7   HG22  ILE   5          2HG2      ILE   5 -11.505  -8.328 -14.919
    8   HG23  ILE   5          3HG2      ILE   5 -11.872  -6.750 -14.231
    9   HD11  ILE   5          3HD1      ILE   5 -16.173  -9.140 -14.401
   10   HD12  ILE   5          1HD1      ILE   5 -15.118  -7.796 -14.827
   11   HD13  ILE   5          2HD1      ILE   5 -15.770  -7.932 -13.187
   12    H    MET   6           H        MET   6 -10.373  -9.671 -10.348
   13    HA   MET   6           HA       MET   6  -8.798  -8.456  -9.066
   14    HB2  MET   6           1HB      MET   6  -7.728  -8.090 -11.955
   15    HB3  MET   6           2HB      MET   6  -6.755  -7.755 -10.508
   16    HG2  MET   6           1HG      MET   6  -6.960 -10.169  -9.787
   17    HG3  MET   6           2HG      MET   6  -7.970 -10.511 -11.205
   18    HE1  MET   6           3HE      MET   6  -5.599 -12.316 -10.660
   19    HE2  MET   6           1HE      MET   6  -4.745 -12.388 -12.205
   20    HE3  MET   6           2HE      MET   6  -6.505 -12.417 -12.171
   21    H    GLN   7           H        GLN   7 -11.220  -6.914 -10.272
   22    HA   GLN   7           HA       GLN   7 -10.531  -4.270 -11.019
   23    HB2  GLN   7           1HB      GLN   7 -12.851  -5.317 -11.266
   24    HB3  GLN   7           2HB      GLN   7 -13.074  -5.219  -9.514
   25    HG2  GLN   7           1HG      GLN   7 -12.901  -2.665  -9.638
   26    HG3  GLN   7           2HG      GLN   7 -12.650  -2.762 -11.383
   27   HE21  GLN   7          1HE2      GLN   7 -14.585  -2.381 -12.538
   28   HE22  GLN   7          2HE2      GLN   7 -16.150  -2.694 -11.953
   29    H    ALA   8           H        ALA   8 -11.322  -5.605  -7.766
   30    HA   ALA   8           HA       ALA   8 -11.004  -3.177  -6.264
   31    HB1  ALA   8           1HB      ALA   8 -10.635  -6.117  -5.398
   32    HB2  ALA   8           2HB      ALA   8 -12.160  -5.235  -5.375
   33    HB3  ALA   8           3HB      ALA   8 -10.845  -4.751  -4.286
   34    H    LYS   9           H        LYS   9  -8.711  -5.838  -7.125
   35    HA   LYS   9           HA       LYS   9  -6.478  -4.777  -5.662
   36    HB2  LYS   9           1HB      LYS   9  -6.661  -7.203  -6.479
   37    HB3  LYS   9           2HB      LYS   9  -6.467  -6.644  -8.142
   38    HG2  LYS   9           1HG      LYS   9  -4.139  -5.740  -7.580
   39    HG3  LYS   9           2HG      LYS   9  -4.346  -6.277  -5.900
   40    HD2  LYS   9           1HD      LYS   9  -4.494  -8.693  -6.699
   41    HD3  LYS   9           2HD      LYS   9  -4.283  -8.154  -8.373
   42    HE2  LYS   9           1HE      LYS   9  -2.000  -7.238  -7.795
   43    HE3  LYS   9           2HE      LYS   9  -2.208  -7.764  -6.117
   44    HZ1  LYS   9           3HZ      LYS   9  -2.479  -9.671  -8.351
   45    HZ2  LYS   9           1HZ      LYS   9  -2.122  -9.974  -6.721
   46    HZ3  LYS   9           2HZ      LYS   9  -0.953  -9.263  -7.727
   47    H    GLU  10           H        GLU  10  -7.476  -4.385  -9.090
   48    HA   GLU  10           HA       GLU  10  -5.210  -2.823  -9.956
   49    HB2  GLU  10           1HB      GLU  10  -8.072  -3.178 -11.034
   50    HB3  GLU  10           2HB      GLU  10  -6.920  -2.133 -11.848
   51    HG2  GLU  10           1HG      GLU  10  -6.391  -5.143 -11.336
   52    HG3  GLU  10           2HG      GLU  10  -7.025  -4.512 -12.850
   53    H    ASP  11           H        ASP  11  -8.383  -1.981  -8.612
   54    HA   ASP  11           HA       ASP  11  -8.186   0.905  -8.837
   55    HB2  ASP  11           1HB      ASP  11  -9.770  -0.885  -6.879
   56    HB3  ASP  11           2HB      ASP  11  -9.959   0.871  -6.945
   57    H    PHE  12           H        PHE  12  -7.129  -1.419  -6.325
   58    HA   PHE  12           HA       PHE  12  -6.263   0.507  -4.351
   59    HB2  PHE  12           1HB      PHE  12  -6.618  -2.012  -3.917
   60    HB3  PHE  12           2HB      PHE  12  -5.153  -2.338  -4.822
   61    HD1  PHE  12           1HD      PHE  12  -6.490  -0.479  -1.798
   62    HD2  PHE  12           2HD      PHE  12  -2.892  -1.994  -3.743
   63    HE1  PHE  12           1HE      PHE  12  -5.140   0.088   0.215
   64    HE2  PHE  12           2HE      PHE  12  -1.586  -1.432  -1.704
   65    HZ   PHE  12           HZ       PHE  12  -2.693  -0.391   0.260
   66    H    LYS  13           H        LYS  13  -4.418  -1.195  -6.997
   67    HA   LYS  13           HA       LYS  13  -1.881  -0.019  -6.454
   68    HB2  LYS  13           1HB      LYS  13  -3.077  -1.126  -9.066
   69    HB3  LYS  13           2HB      LYS  13  -1.378  -0.695  -8.871
   70    HG2  LYS  13           1HG      LYS  13  -1.120  -2.418  -7.014
   71    HG3  LYS  13           2HG      LYS  13  -2.824  -2.814  -7.143
   72    HD2  LYS  13           1HD      LYS  13  -1.673  -4.573  -8.394
   73    HD3  LYS  13           2HD      LYS  13  -2.397  -3.540  -9.624
   74    HE2  LYS  13           1HE      LYS  13  -0.173  -2.417 -10.014
   75    HE3  LYS  13           2HE      LYS  13   0.556  -3.356  -8.710
   76    HZ1  LYS  13           3HZ      LYS  13  -0.822  -4.873 -10.749
   77    HZ2  LYS  13           1HZ      LYS  13   0.654  -5.169  -9.971
   78    HZ3  LYS  13           2HZ      LYS  13   0.581  -4.063 -11.258
   79    H    LYS  14           H        LYS  14  -4.535   0.980  -8.618
   80    HA   LYS  14           HA       LYS  14  -3.306   3.218  -9.858
   81    HB2  LYS  14           1HB      LYS  14  -6.242   2.578  -9.260
   82    HB3  LYS  14           2HB      LYS  14  -5.779   4.039 -10.160
   83    HG2  LYS  14           1HG      LYS  14  -4.665   2.640 -11.934
   84    HG3  LYS  14           2HG      LYS  14  -5.040   1.165 -11.046
   85    HD2  LYS  14           1HD      LYS  14  -7.514   1.554 -11.357
   86    HD3  LYS  14           2HD      LYS  14  -7.194   3.112 -12.145
   87    HE2  LYS  14           1HE      LYS  14  -7.659   1.307 -13.860
   88    HE3  LYS  14           2HE      LYS  14  -6.000   1.901 -14.033
   89    HZ1  LYS  14           3HZ      LYS  14  -6.225  -0.246 -12.143
   90    HZ2  LYS  14           1HZ      LYS  14  -5.179  -0.068 -13.467
   91    HZ3  LYS  14           2HZ      LYS  14  -6.743  -0.691 -13.698
   92    H    MET  15           H        MET  15  -5.123   2.930  -6.802
   93    HA   MET  15           HA       MET  15  -5.111   5.728  -6.179
   94    HB2  MET  15           1HB      MET  15  -6.621   3.899  -5.105
   95    HB3  MET  15           2HB      MET  15  -5.227   3.360  -4.184
   96    HG2  MET  15           1HG      MET  15  -6.525   4.883  -2.721
   97    HG3  MET  15           2HG      MET  15  -5.061   5.754  -3.168
   98    HE1  MET  15           3HE      MET  15  -6.163   8.040  -2.511
   99    HE2  MET  15           1HE      MET  15  -7.637   7.175  -2.024
  100    HE3  MET  15           2HE      MET  15  -7.737   8.590  -3.068
  101    H    MET  16           H        MET  16  -2.918   3.020  -5.253
  102    HA   MET  16           HA       MET  16  -1.145   4.464  -3.527
  103    HB2  MET  16           1HB      MET  16  -0.797   1.918  -5.225
  104    HB3  MET  16           2HB      MET  16   0.472   2.474  -4.132
  105    HG2  MET  16           1HG      MET  16  -2.385   1.780  -3.191
  106    HG3  MET  16           2HG      MET  16  -1.029   0.676  -3.101
  107    HE1  MET  16           3HE      MET  16   1.259   1.382  -1.925
  108    HE2  MET  16           1HE      MET  16   0.264   0.455  -0.794
  109    HE3  MET  16           2HE      MET  16   1.129   1.888  -0.260
  110    H    GLU  17           H        GLU  17  -0.857   3.836  -7.063
  111    HA   GLU  17           HA       GLU  17   1.731   5.111  -7.313
  112    HB2  GLU  17           1HB      GLU  17   1.564   4.701  -9.702
  113    HB3  GLU  17           2HB      GLU  17   0.740   3.332  -8.916
  114    HG2  GLU  17           1HG      GLU  17  -1.460   4.609  -9.305
  115    HG3  GLU  17           2HG      GLU  17  -0.580   5.759 -10.277
  116    H    GLU  18           H        GLU  18  -1.616   6.231  -7.377
  117    HA   GLU  18           HA       GLU  18  -0.979   8.974  -8.362
  118    HB2  GLU  18           1HB      GLU  18  -3.626   7.639  -7.510
  119    HB3  GLU  18           2HB      GLU  18  -3.526   9.333  -8.041
  120    HG2  GLU  18           1HG      GLU  18  -2.695   8.602 -10.306
  121    HG3  GLU  18           2HG      GLU  18  -2.702   6.933  -9.805
  122    H    ALA  19           H        ALA  19  -1.286   7.292  -5.304
  123    HA   ALA  19           HA       ALA  19  -1.925   9.716  -3.735
  124    HB1  ALA  19           1HB      ALA  19  -3.020   7.619  -3.025
  125    HB2  ALA  19           2HB      ALA  19  -1.898   8.105  -1.753
  126    HB3  ALA  19           3HB      ALA  19  -1.461   6.811  -2.862
  127    H    LYS  20           H        LYS  20   0.828   8.848  -5.287
  128    HA   LYS  20           HA       LYS  20   2.988   8.268  -4.004
  129    HB2  LYS  20           1HB      LYS  20   2.702  10.974  -5.455
  130    HB3  LYS  20           2HB      LYS  20   4.284  10.357  -4.973
  131    HG2  LYS  20           1HG      LYS  20   2.395   8.765  -6.793
  132    HG3  LYS  20           2HG      LYS  20   3.557   9.888  -7.453
  133    HD2  LYS  20           1HD      LYS  20   5.459   8.534  -6.397
  134    HD3  LYS  20           2HD      LYS  20   4.299   7.379  -5.763
  135    HE2  LYS  20           1HE      LYS  20   3.618   6.736  -8.080
  136    HE3  LYS  20           2HE      LYS  20   4.733   7.932  -8.754
  137    HZ1  LYS  20           3HZ      LYS  20   6.156   6.373  -6.930
  138    HZ2  LYS  20           1HZ      LYS  20   6.323   6.429  -8.616
  139    HZ3  LYS  20           2HZ      LYS  20   5.263   5.305  -7.907
  140    H    PHE  21           H        PHE  21   3.656   8.403  -1.984
  141    HA   PHE  21           HA       PHE  21   3.350  10.888  -0.386
  142    HB2  PHE  21           1HB      PHE  21   2.578   9.470   1.528
  143    HB3  PHE  21           2HB      PHE  21   1.498   9.287   0.150
  144    HD1  PHE  21           2HD      PHE  21   1.664   7.158  -1.381
  145    HD2  PHE  21           1HD      PHE  21   3.886   7.505   2.332
  146    HE1  PHE  21           2HE      PHE  21   2.058   4.693  -1.364
  147    HE2  PHE  21           1HE      PHE  21   4.295   5.064   2.315
  148    HZ   PHE  21           HZ       PHE  21   3.376   3.649   0.482
  149    H    ASN  22           H        ASN  22   4.758  10.611   1.668
  150    HA   ASN  22           HA       ASN  22   7.429  10.460   1.066
  151    HB2  ASN  22           1HB      ASN  22   6.012  10.004   3.721
  152    HB3  ASN  22           2HB      ASN  22   7.757  10.257   3.608
  153   HD21  ASN  22          1HD2      ASN  22   4.716  11.821   2.344
  154   HD22  ASN  22          2HD2      ASN  22   5.248  13.412   2.614
  155    HA   PRO  23           HA       PRO  23   7.825   5.814   0.526
  156    HB2  PRO  23           1HB      PRO  23  10.533   5.626  -0.040
  157    HB3  PRO  23           2HB      PRO  23   9.346   6.251  -1.227
  158    HG2  PRO  23           1HG      PRO  23  11.190   7.817   0.609
  159    HG3  PRO  23           2HG      PRO  23  10.855   8.073  -1.123
  160    HD2  PRO  23           1HD      PRO  23   9.630   9.575   0.826
  161    HD3  PRO  23           2HD      PRO  23   8.779   9.155  -0.700
  162    H    ARG  24           H        ARG  24   9.386   7.742   2.949
  163    HA   ARG  24           HA       ARG  24  10.468   5.412   4.449
  164    HB2  ARG  24           1HB      ARG  24  10.520   8.451   5.036
  165    HB3  ARG  24           2HB      ARG  24  11.351   7.232   6.038
  166    HG2  ARG  24           1HG      ARG  24  12.792   6.559   4.053
  167    HG3  ARG  24           2HG      ARG  24  11.949   7.736   3.031
  168    HD2  ARG  24           1HD      ARG  24  13.564   8.507   5.539
  169    HD3  ARG  24           2HD      ARG  24  14.179   8.607   3.871
  170    HE   ARG  24           HE       ARG  24  11.726  10.023   3.933
  171   HH11  ARG  24          1HH2      ARG  24  14.903  10.282   5.375
  172   HH12  ARG  24          2HH2      ARG  24  14.855  12.010   5.490
  173   HH21  ARG  24          1HH1      ARG  24  11.691  12.284   4.098
  174   HH22  ARG  24          2HH1      ARG  24  13.041  13.134   4.769
  175    H    ALA  25           H        ALA  25   7.472   6.864   4.168
  176    HA   ALA  25           HA       ALA  25   6.607   6.790   6.960
  177    HB1  ALA  25           1HB      ALA  25   4.961   6.683   4.364
  178    HB2  ALA  25           2HB      ALA  25   5.353   8.141   5.246
  179    HB3  ALA  25           3HB      ALA  25   4.280   6.949   5.974
  180    H    THR  26           H        THR  26   5.247   5.183   7.876
  181    HA   THR  26           HA       THR  26   5.813   2.406   6.953
  182    HB   THR  26           HB       THR  26   5.188   1.769   9.291
  183    HG1  THR  26           1HG      THR  26   4.908   4.453  10.010
  184   HG21  THR  26          3HG2      THR  26   6.978   2.958  10.555
  185   HG22  THR  26          1HG2      THR  26   7.010   4.262   9.367
  186   HG23  THR  26          2HG2      THR  26   7.571   2.647   8.916
  187    H    PHE  27           H        PHE  27   3.976   0.851   7.351
  188    HA   PHE  27           HA       PHE  27   1.670   1.514   5.810
  189    HB2  PHE  27           1HB      PHE  27   2.468  -0.839   6.009
  190    HB3  PHE  27           2HB      PHE  27   2.217  -0.818   7.748
  191    HD1  PHE  27           1HD      PHE  27   0.306  -0.210   4.501
  192    HD2  PHE  27           2HD      PHE  27   0.032  -1.608   8.616
  193    HE1  PHE  27           1HE      PHE  27  -2.060  -0.829   4.148
  194    HE2  PHE  27           2HE      PHE  27  -2.330  -2.244   8.230
  195    HZ   PHE  27           HZ       PHE  27  -3.374  -1.875   6.006
  196    H    SER  28           H        SER  28   2.130   1.279   9.357
  197    HA   SER  28           HA       SER  28  -0.557   1.681  10.202
  198    HB2  SER  28           1HB      SER  28   2.058   2.545  11.562
  199    HB3  SER  28           2HB      SER  28   0.486   2.396  12.376
  200    HG   SER  28           HG       SER  28   2.278   0.468  11.520
  201    H    GLU  29           H        GLU  29   1.965   4.104   9.413
  202    HA   GLU  29           HA       GLU  29   0.363   6.433  10.100
  203    HB2  GLU  29           1HB      GLU  29   2.906   6.081   8.371
  204    HB3  GLU  29           2HB      GLU  29   2.230   7.674   8.769
  205    HG2  GLU  29           1HG      GLU  29   3.202   5.612  10.884
  206    HG3  GLU  29           2HG      GLU  29   4.150   6.992  10.337
  207    H    PHE  30           H        PHE  30   1.124   4.767   6.999
  208    HA   PHE  30           HA       PHE  30  -0.348   6.558   5.273
  209    HB2  PHE  30           1HB      PHE  30   1.493   4.983   4.519
  210    HB3  PHE  30           2HB      PHE  30   0.442   3.607   4.835
  211    HD1  PHE  30           1HD      PHE  30   0.778   6.765   2.752
  212    HD2  PHE  30           2HD      PHE  30  -1.399   3.010   3.206
  213    HE1  PHE  30           1HE      PHE  30  -0.377   7.145   0.583
  214    HE2  PHE  30           2HE      PHE  30  -2.516   3.412   1.024
  215    HZ   PHE  30           HZ       PHE  30  -2.011   5.472  -0.282
  216    H    ALA  31           H        ALA  31  -1.173   3.444   6.821
  217    HA   ALA  31           HA       ALA  31  -3.795   3.138   5.705
  218    HB1  ALA  31           1HB      ALA  31  -2.588   1.988   8.303
  219    HB2  ALA  31           2HB      ALA  31  -2.478   1.244   6.714
  220    HB3  ALA  31           3HB      ALA  31  -4.043   1.392   7.510
  221    H    ALA  32           H        ALA  32  -2.589   4.630   8.715
  222    HA   ALA  32           HA       ALA  32  -5.107   5.211   9.989
  223    HB1  ALA  32           1HB      ALA  32  -2.413   6.712  10.081
  224    HB2  ALA  32           2HB      ALA  32  -2.944   5.467  11.207
  225    HB3  ALA  32           3HB      ALA  32  -3.767   7.032  11.183
  226    H    LYS  33           H        LYS  33  -3.276   6.933   7.435
  227    HA   LYS  33           HA       LYS  33  -5.039   9.255   7.427
  228    HB2  LYS  33           1HB      LYS  33  -2.608   9.316   6.635
  229    HB3  LYS  33           2HB      LYS  33  -3.046   8.289   5.264
  230    HG2  LYS  33           1HG      LYS  33  -4.647  10.086   4.404
  231    HG3  LYS  33           2HG      LYS  33  -4.261  11.103   5.810
  232    HD2  LYS  33           1HD      LYS  33  -1.833  11.238   5.027
  233    HD3  LYS  33           2HD      LYS  33  -2.235  10.237   3.621
  234    HE2  LYS  33           1HE      LYS  33  -3.836  12.011   2.805
  235    HE3  LYS  33           2HE      LYS  33  -3.459  13.010   4.221
  236    HZ1  LYS  33           3HZ      LYS  33  -1.686  12.249   1.986
  237    HZ2  LYS  33           1HZ      LYS  33  -1.069  12.820   3.460
  238    HZ3  LYS  33           2HZ      LYS  33  -2.104  13.801   2.535
  239    H    HIS  34           H        HIS  34  -4.786   6.259   5.403
  240    HA   HIS  34           HA       HIS  34  -7.181   7.043   3.820
  241    HB2  HIS  34           1HB      HIS  34  -5.139   4.757   3.507
  242    HB3  HIS  34           2HB      HIS  34  -6.541   4.946   2.439
  243    HD2  HIS  34           2HD      HIS  34  -6.305   7.094   0.557
  244    HE1  HIS  34           1HE      HIS  34  -2.467   8.380   1.741
  245    HE2  HIS  34           2HE      HIS  34  -4.300   8.669   0.010
  246    H    ALA  35           H        ALA  35  -6.692   5.559   6.747
  247    HA   ALA  35           HA       ALA  35  -8.056   3.136   6.808
  248    HB1  ALA  35           1HB      ALA  35  -7.912   5.402   8.878
  249    HB2  ALA  35           2HB      ALA  35  -7.043   3.871   8.901
  250    HB3  ALA  35           3HB      ALA  35  -8.759   3.897   9.245
  251    H    LYS  36           H        LYS  36  -9.442   6.441   6.691
  252    HA   LYS  36           HA       LYS  36 -12.169   5.521   7.034
  253    HB2  LYS  36           1HB      LYS  36 -10.962   8.240   6.128
  254    HB3  LYS  36           2HB      LYS  36 -12.686   8.009   6.503
  255    HG2  LYS  36           1HG      LYS  36 -12.095   7.380   8.888
  256    HG3  LYS  36           2HG      LYS  36 -10.365   7.593   8.523
  257    HD2  LYS  36           1HD      LYS  36 -10.783  10.061   7.980
  258    HD3  LYS  36           2HD      LYS  36 -12.502   9.846   8.388
  259    HE2  LYS  36           1HE      LYS  36 -10.152   9.453  10.355
  260    HE3  LYS  36           2HE      LYS  36 -11.274  10.825  10.348
  261    HZ1  LYS  36           3HZ      LYS  36 -12.061   9.293  11.945
  262    HZ2  LYS  36           1HZ      LYS  36 -11.885   7.969  10.899
  263    HZ3  LYS  36           2HZ      LYS  36 -13.092   9.130  10.606
  264    H    ASP  37           H        ASP  37 -10.001   5.542   4.372
  265    HA   ASP  37           HA       ASP  37 -11.795   6.151   2.211
  266    HB2  ASP  37           1HB      ASP  37  -9.186   6.013   2.107
  267    HB3  ASP  37           2HB      ASP  37  -9.363   4.270   2.001
  268    H    SER  38           H        SER  38 -13.207   4.830   1.098
  269    HA   SER  38           HA       SER  38 -14.375   2.583   2.358
  270    HB2  SER  38           1HB      SER  38 -14.668   3.743  -0.445
  271    HB3  SER  38           2HB      SER  38 -15.631   2.363   0.097
  272    HG   SER  38           HG       SER  38 -15.668   5.034   0.936
  273    H    ARG  39           H        ARG  39 -11.915   2.841  -0.107
  274    HA   ARG  39           HA       ARG  39 -11.855   0.085  -1.032
  275    HB2  ARG  39           1HB      ARG  39  -9.740   2.341  -1.102
  276    HB3  ARG  39           2HB      ARG  39  -9.555   0.781  -1.942
  277    HG2  ARG  39           1HG      ARG  39 -11.646   1.274  -3.321
  278    HG3  ARG  39           2HG      ARG  39 -11.835   2.826  -2.483
  279    HD2  ARG  39           1HD      ARG  39  -9.609   3.586  -3.396
  280    HD3  ARG  39           2HD      ARG  39  -9.426   2.026  -4.238
  281    HE   ARG  39           HE       ARG  39 -11.920   3.140  -4.999
  282   HH11  ARG  39          1HH2      ARG  39  -8.529   3.833  -5.333
  283   HH12  ARG  39          2HH2      ARG  39  -8.693   4.638  -6.855
  284   HH21  ARG  39          1HH1      ARG  39 -12.126   4.200  -7.003
  285   HH22  ARG  39          2HH1      ARG  39 -10.729   4.844  -7.796
  286    H    PHE  40           H        PHE  40 -10.553   1.722   1.768
  287    HA   PHE  40           HA       PHE  40  -8.400  -0.133   2.299
  288    HB2  PHE  40           1HB      PHE  40  -8.528   2.221   3.295
  289    HB3  PHE  40           2HB      PHE  40  -9.884   1.722   4.289
  290    HD1  PHE  40           2HD      PHE  40  -6.220   1.126   3.616
  291    HD2  PHE  40           1HD      PHE  40  -9.521   0.318   6.356
  292    HE1  PHE  40           2HE      PHE  40  -4.652   0.146   5.252
  293    HE2  PHE  40           1HE      PHE  40  -7.918  -0.675   7.970
  294    HZ   PHE  40           HZ       PHE  40  -5.490  -0.771   7.421
  295    H    LYS  41           H        LYS  41 -11.669   0.237   3.749
  296    HA   LYS  41           HA       LYS  41 -11.556  -2.179   5.353
  297    HB2  LYS  41           1HB      LYS  41 -13.878  -1.659   5.987
  298    HB3  LYS  41           2HB      LYS  41 -13.012  -0.112   5.876
  299    HG2  LYS  41           1HG      LYS  41 -13.976   0.276   3.571
  300    HG3  LYS  41           2HG      LYS  41 -14.837  -1.267   3.637
  301    HD2  LYS  41           1HD      LYS  41 -16.160  -0.400   5.656
  302    HD3  LYS  41           2HD      LYS  41 -15.348   1.162   5.485
  303    HE2  LYS  41           1HE      LYS  41 -16.350   1.417   3.174
  304    HE3  LYS  41           2HE      LYS  41 -17.136  -0.148   3.327
  305    HZ1  LYS  41           3HZ      LYS  41 -17.573   1.992   5.307
  306    HZ2  LYS  41           1HZ      LYS  41 -18.535   0.638   4.962
  307    HZ3  LYS  41           2HZ      LYS  41 -18.458   1.927   3.859
  308    H    ALA  42           H        ALA  42 -12.205  -1.611   1.982
  309    HA   ALA  42           HA       ALA  42 -14.102  -3.704   1.414
  310    HB1  ALA  42           1HB      ALA  42 -13.356  -3.350  -0.962
  311    HB2  ALA  42           2HB      ALA  42 -11.929  -2.460  -0.398
  312    HB3  ALA  42           3HB      ALA  42 -13.528  -1.775  -0.173
  313    H    ILE  43           H        ILE  43 -10.586  -3.656   1.784
  314    HA   ILE  43           HA       ILE  43 -10.361  -6.520   0.999
  315    HB   ILE  43           HB       ILE  43  -8.248  -4.541   2.058
  316   HG12  ILE  43          1HG1      ILE  43  -8.609  -5.470  -0.874
  317   HG13  ILE  43          2HG1      ILE  43  -9.266  -3.946  -0.301
  318   HG21  ILE  43          1HG2      ILE  43  -7.527  -6.916   2.459
  319   HG22  ILE  43          2HG2      ILE  43  -6.607  -6.336   1.096
  320   HG23  ILE  43          3HG2      ILE  43  -7.979  -7.382   0.828
  321   HD11  ILE  43          3HD1      ILE  43  -7.022  -3.104   0.234
  322   HD12  ILE  43          1HD1      ILE  43  -7.051  -3.670  -1.432
  323   HD13  ILE  43          2HD1      ILE  43  -6.287  -4.654  -0.194
  324    H    GLU  44           H        GLU  44 -10.814  -7.978   2.489
  325    HA   GLU  44           HA       GLU  44 -11.256  -7.500   5.301
  326    HB2  GLU  44           1HB      GLU  44 -11.297 -10.228   5.207
  327    HB3  GLU  44           2HB      GLU  44 -12.639  -9.276   4.546
  328    HG2  GLU  44           1HG      GLU  44 -11.828  -9.527   2.238
  329    HG3  GLU  44           2HG      GLU  44 -10.281 -10.177   2.771
  330    H    LYS  45           H        LYS  45  -8.659  -9.164   3.412
  331    HA   LYS  45           HA       LYS  45  -7.100  -9.928   5.746
  332    HB2  LYS  45           1HB      LYS  45  -6.485  -9.984   2.718
  333    HB3  LYS  45           2HB      LYS  45  -5.407 -10.674   3.946
  334    HG2  LYS  45           1HG      LYS  45  -7.260 -12.272   4.676
  335    HG3  LYS  45           2HG      LYS  45  -8.328 -11.589   3.445
  336    HD2  LYS  45           1HD      LYS  45  -6.718 -12.360   1.615
  337    HD3  LYS  45           2HD      LYS  45  -5.658 -13.051   2.851
  338    HE2  LYS  45           1HE      LYS  45  -7.494 -14.651   3.530
  339    HE3  LYS  45           2HE      LYS  45  -8.557 -13.955   2.292
  340    HZ1  LYS  45           3HZ      LYS  45  -7.338 -16.013   1.630
  341    HZ2  LYS  45           1HZ      LYS  45  -5.897 -15.121   1.682
  342    HZ3  LYS  45           2HZ      LYS  45  -7.120 -14.689   0.586
  343    H    MET  46           H        MET  46  -6.033  -8.488   6.880
  344    HA   MET  46           HA       MET  46  -5.024  -5.919   6.043
  345    HB2  MET  46           1HB      MET  46  -4.538  -7.675   8.539
  346    HB3  MET  46           2HB      MET  46  -3.917  -6.024   8.379
  347    HG2  MET  46           1HG      MET  46  -6.286  -5.149   8.146
  348    HG3  MET  46           2HG      MET  46  -6.911  -6.789   8.263
  349    HE1  MET  46           3HE      MET  46  -6.007  -3.597  10.177
  350    HE2  MET  46           1HE      MET  46  -4.400  -4.334  10.103
  351    HE3  MET  46           2HE      MET  46  -5.210  -4.153  11.640
  352    H    LYS  47           H        LYS  47  -3.684  -9.187   6.300
  353    HA   LYS  47           HA       LYS  47  -0.908  -8.624   6.118
  354    HB2  LYS  47           1HB      LYS  47  -2.523 -11.095   5.192
  355    HB3  LYS  47           2HB      LYS  47  -0.744 -11.065   5.271
  356    HG2  LYS  47           1HG      LYS  47  -0.862 -10.609   7.772
  357    HG3  LYS  47           2HG      LYS  47  -2.640 -10.639   7.691
  358    HD2  LYS  47           1HD      LYS  47  -2.565 -13.071   6.901
  359    HD3  LYS  47           2HD      LYS  47  -0.789 -13.042   6.995
  360    HE2  LYS  47           1HE      LYS  47  -2.673 -12.619   9.407
  361    HE3  LYS  47           2HE      LYS  47  -1.783 -14.108   9.056
  362    HZ1  LYS  47           3HZ      LYS  47  -0.694 -11.442   9.772
  363    HZ2  LYS  47           1HZ      LYS  47   0.272 -12.644   9.062
  364    HZ3  LYS  47           2HZ      LYS  47  -0.464 -12.928  10.566
  365    H    ASP  48           H        ASP  48  -3.407  -9.051   3.545
  366    HA   ASP  48           HA       ASP  48  -1.581  -9.103   1.320
  367    HB2  ASP  48           1HB      ASP  48  -3.963  -9.948   1.165
  368    HB3  ASP  48           2HB      ASP  48  -4.574  -8.320   1.455
  369    H    ARG  49           H        ARG  49  -3.327  -6.494   3.012
  370    HA   ARG  49           HA       ARG  49  -2.504  -4.312   1.292
  371    HB2  ARG  49           1HB      ARG  49  -3.522  -4.422   4.187
  372    HB3  ARG  49           2HB      ARG  49  -3.084  -2.900   3.413
  373    HG2  ARG  49           1HG      ARG  49  -4.794  -3.240   1.612
  374    HG3  ARG  49           2HG      ARG  49  -5.178  -4.833   2.270
  375    HD2  ARG  49           1HD      ARG  49  -5.532  -2.324   3.986
  376    HD3  ARG  49           2HD      ARG  49  -6.800  -2.851   2.884
  377    HE   ARG  49           HE       ARG  49  -5.995  -5.085   4.474
  378   HH11  ARG  49          1HH2      ARG  49  -7.573  -2.008   4.905
  379   HH12  ARG  49          2HH2      ARG  49  -8.648  -2.581   6.138
  380   HH21  ARG  49          1HH1      ARG  49  -7.447  -5.814   6.064
  381   HH22  ARG  49          2HH1      ARG  49  -8.574  -4.718   6.786
  382    H    GLU  50           H        GLU  50  -1.142  -5.723   4.310
  383    HA   GLU  50           HA       GLU  50   1.053  -3.872   4.582
  384    HB2  GLU  50           1HB      GLU  50   0.206  -5.424   6.426
  385    HB3  GLU  50           2HB      GLU  50   0.880  -6.807   5.550
  386    HG2  GLU  50           1HG      GLU  50   3.220  -5.805   5.786
  387    HG3  GLU  50           2HG      GLU  50   2.549  -4.411   6.633
  388    H    ALA  51           H        ALA  51   0.749  -7.074   2.910
  389    HA   ALA  51           HA       ALA  51   3.443  -7.431   2.056
  390    HB1  ALA  51           1HB      ALA  51   1.667  -9.213   1.976
  391    HB2  ALA  51           2HB      ALA  51   2.432  -9.020   0.390
  392    HB3  ALA  51           3HB      ALA  51   0.830  -8.330   0.696
  393    H    LEU  52           H        LEU  52   0.635  -5.871   0.420
  394    HA   LEU  52           HA       LEU  52   1.933  -5.111  -1.993
  395    HB2  LEU  52           1HB      LEU  52  -0.540  -4.043  -0.530
  396    HB3  LEU  52           2HB      LEU  52  -0.060  -3.420  -2.111
  397    HG   LEU  52           HG       LEU  52  -0.590  -6.449  -1.679
  398   HD11  LEU  52          1HD1      LEU  52  -2.612  -4.322  -2.592
  399   HD12  LEU  52          2HD1      LEU  52  -2.717  -5.317  -1.137
  400   HD13  LEU  52          3HD1      LEU  52  -2.878  -6.065  -2.719
  401   HD21  LEU  52          3HD2      LEU  52  -0.911  -6.443  -4.210
  402   HD22  LEU  52          1HD2      LEU  52   0.705  -5.930  -3.763
  403   HD23  LEU  52          2HD2      LEU  52  -0.479  -4.732  -4.252
  404    H    PHE  53           H        PHE  53   1.420  -3.391   1.097
  405    HA   PHE  53           HA       PHE  53   2.457  -0.843   0.369
  406    HB2  PHE  53           1HB      PHE  53   1.138  -1.378   2.474
  407    HB3  PHE  53           2HB      PHE  53   2.511  -2.251   3.121
  408    HD1  PHE  53           2HD      PHE  53   1.263   1.162   2.151
  409    HD2  PHE  53           1HD      PHE  53   4.589  -1.016   3.932
  410    HE1  PHE  53           2HE      PHE  53   2.299   3.281   2.868
  411    HE2  PHE  53           1HE      PHE  53   5.590   1.140   4.656
  412    HZ   PHE  53           HZ       PHE  53   4.428   3.274   4.129
  413    H    ASN  54           H        ASN  54   4.060  -3.655   1.881
  414    HA   ASN  54           HA       ASN  54   6.708  -2.567   2.080
  415    HB2  ASN  54           1HB      ASN  54   5.733  -5.490   1.836
  416    HB3  ASN  54           2HB      ASN  54   7.405  -5.058   2.219
  417   HD21  ASN  54          1HD2      ASN  54   5.276  -6.466   3.903
  418   HD22  ASN  54          2HD2      ASN  54   5.221  -5.584   5.354
  419    H    GLU  55           H        GLU  55   5.059  -4.464  -0.503
  420    HA   GLU  55           HA       GLU  55   7.322  -4.697  -2.270
  421    HB2  GLU  55           1HB      GLU  55   5.246  -6.189  -2.377
  422    HB3  GLU  55           2HB      GLU  55   4.304  -4.815  -2.965
  423    HG2  GLU  55           1HG      GLU  55   5.797  -4.676  -5.044
  424    HG3  GLU  55           2HG      GLU  55   6.767  -6.024  -4.443
  425    H    PHE  56           H        PHE  56   4.611  -2.327  -1.988
  426    HA   PHE  56           HA       PHE  56   5.106  -0.852  -4.349
  427    HB2  PHE  56           1HB      PHE  56   2.977  -0.649  -3.024
  428    HB3  PHE  56           2HB      PHE  56   3.852   0.068  -1.675
  429    HD1  PHE  56           1HD      PHE  56   2.950   0.597  -5.333
  430    HD2  PHE  56           2HD      PHE  56   4.437   2.523  -1.708
  431    HE1  PHE  56           1HE      PHE  56   2.819   2.827  -6.438
  432    HE2  PHE  56           2HE      PHE  56   4.279   4.732  -2.837
  433    HZ   PHE  56           HZ       PHE  56   3.478   4.886  -5.192
  434    H    VAL  57           H        VAL  57   6.249  -0.279  -0.963
  435    HA   VAL  57           HA       VAL  57   7.790   2.082  -1.491
  436    HB   VAL  57           HB       VAL  57   7.975  -0.068   0.740
  437   HG11  VAL  57          1HG1      VAL  57  10.203   1.041   0.749
  438   HG12  VAL  57          2HG1      VAL  57   9.286   1.773   2.059
  439   HG13  VAL  57          3HG1      VAL  57   9.477   2.640   0.529
  440   HG21  VAL  57          3HG2      VAL  57   6.740   1.627   2.136
  441   HG22  VAL  57          1HG2      VAL  57   5.817   1.348   0.655
  442   HG23  VAL  57          2HG2      VAL  57   6.786   2.806   0.820
  443    H    ALA  58           H        ALA  58   8.685  -1.405  -1.379
  444    HA   ALA  58           HA       ALA  58  11.471  -1.046  -1.901
  445    HB1  ALA  58           1HB      ALA  58  10.489  -3.141  -0.903
  446    HB2  ALA  58           2HB      ALA  58  11.430  -3.536  -2.350
  447    HB3  ALA  58           3HB      ALA  58   9.659  -3.492  -2.423
  448    H    ALA  59           H        ALA  59   8.638  -1.569  -4.058
  449    HA   ALA  59           HA       ALA  59  10.142  -1.806  -6.526
  450    HB1  ALA  59           1HB      ALA  59   7.880  -2.831  -6.253
  451    HB2  ALA  59           2HB      ALA  59   7.835  -1.654  -7.575
  452    HB3  ALA  59           3HB      ALA  59   7.160  -1.238  -5.991
  453    H    ALA  60           H        ALA  60   8.374   0.859  -4.863
  454    HA   ALA  60           HA       ALA  60   8.569   2.814  -6.953
  455    HB1  ALA  60           1HB      ALA  60   7.978   4.466  -5.086
  456    HB2  ALA  60           2HB      ALA  60   8.223   3.168  -3.904
  457    HB3  ALA  60           3HB      ALA  60   6.921   3.042  -5.086
  458    H    ARG  61           H        ARG  61  10.679   2.069  -4.127
  459    HA   ARG  61           HA       ARG  61  12.464   4.273  -4.576
  460    HB2  ARG  61           1HB      ARG  61  12.184   3.155  -2.308
  461    HB3  ARG  61           2HB      ARG  61  12.900   1.669  -2.946
  462    HG2  ARG  61           1HG      ARG  61  15.119   2.888  -3.348
  463    HG3  ARG  61           2HG      ARG  61  14.394   4.392  -2.744
  464    HD2  ARG  61           1HD      ARG  61  14.694   1.823  -1.057
  465    HD3  ARG  61           2HD      ARG  61  15.815   3.204  -0.995
  466    HE   ARG  61           HE       ARG  61  13.180   4.195  -0.577
  467   HH11  ARG  61          1HH2      ARG  61  15.521   2.160   1.064
  468   HH12  ARG  61          2HH2      ARG  61  14.937   2.547   2.648
  469   HH21  ARG  61          1HH1      ARG  61  12.443   4.672   1.503
  470   HH22  ARG  61          2HH1      ARG  61  13.199   3.966   2.890
  Start of MODEL    2
    1    H    ILE   5           H        ILE   5 -13.111 -10.500 -11.748
    2    HA   ILE   5           HA       ILE   5 -11.489  -9.951 -13.307
    3    HB   ILE   5           HB       ILE   5 -12.940  -7.198 -13.315
    4   HG12  ILE   5          1HG1      ILE   5 -13.402  -9.514 -15.321
    5   HG13  ILE   5          2HG1      ILE   5 -14.382  -9.362 -13.878
    6   HG21  ILE   5          1HG2      ILE   5 -10.746  -8.346 -15.144
    7   HG22  ILE   5          2HG2      ILE   5 -10.996  -6.672 -14.642
    8   HG23  ILE   5          3HG2      ILE   5 -11.995  -7.359 -15.909
    9   HD11  ILE   5          3HD1      ILE   5 -14.153  -7.184 -16.010
   10   HD12  ILE   5          1HD1      ILE   5 -15.221  -7.172 -14.600
   11   HD13  ILE   5          2HD1      ILE   5 -15.469  -8.349 -15.887
   12    H    MET   6           H        MET   6 -10.871  -9.720 -10.506
   13    HA   MET   6           HA       MET   6  -9.457  -8.723  -8.885
   14    HB2  MET   6           1HB      MET   6  -7.803  -8.600 -11.488
   15    HB3  MET   6           2HB      MET   6  -7.085  -8.379  -9.883
   16    HG2  MET   6           1HG      MET   6  -7.827 -10.718  -9.228
   17    HG3  MET   6           2HG      MET   6  -8.541 -10.935 -10.836
   18    HE1  MET   6           3HE      MET   6  -5.460 -13.294 -11.066
   19    HE2  MET   6           1HE      MET   6  -7.178 -13.087 -11.437
   20    HE3  MET   6           2HE      MET   6  -6.620 -13.046  -9.765
   21    H    GLN   7           H        GLN   7 -11.360  -6.835 -10.249
   22    HA   GLN   7           HA       GLN   7 -10.260  -4.345 -10.968
   23    HB2  GLN   7           1HB      GLN   7 -12.673  -5.017 -11.353
   24    HB3  GLN   7           2HB      GLN   7 -12.993  -4.863  -9.623
   25    HG2  GLN   7           1HG      GLN   7 -12.439  -2.374  -9.748
   26    HG3  GLN   7           2HG      GLN   7 -12.076  -2.528 -11.464
   27   HE21  GLN   7          1HE2      GLN   7 -13.804  -1.381 -12.453
   28   HE22  GLN   7          2HE2      GLN   7 -15.449  -1.645 -12.122
   29    H    ALA   8           H        ALA   8 -11.141  -5.605  -7.754
   30    HA   ALA   8           HA       ALA   8 -10.781  -3.230  -6.198
   31    HB1  ALA   8           1HB      ALA   8 -11.872  -5.341  -5.344
   32    HB2  ALA   8           2HB      ALA   8 -10.557  -4.835  -4.270
   33    HB3  ALA   8           3HB      ALA   8 -10.316  -6.171  -5.405
   34    H    LYS   9           H        LYS   9  -8.446  -5.862  -7.123
   35    HA   LYS   9           HA       LYS   9  -6.204  -4.790  -5.734
   36    HB2  LYS   9           1HB      LYS   9  -6.517  -7.222  -6.660
   37    HB3  LYS   9           2HB      LYS   9  -6.079  -6.589  -8.245
   38    HG2  LYS   9           1HG      LYS   9  -3.823  -5.837  -7.330
   39    HG3  LYS   9           2HG      LYS   9  -4.276  -6.444  -5.726
   40    HD2  LYS   9           1HD      LYS   9  -4.434  -8.813  -6.665
   41    HD3  LYS   9           2HD      LYS   9  -3.957  -8.207  -8.256
   42    HE2  LYS   9           1HE      LYS   9  -1.740  -7.456  -7.306
   43    HE3  LYS   9           2HE      LYS   9  -2.219  -8.055  -5.713
   44    HZ1  LYS   9           3HZ      LYS   9  -2.607 -10.246  -6.968
   45    HZ2  LYS   9           1HZ      LYS   9  -1.024  -9.786  -6.577
   46    HZ3  LYS   9           2HZ      LYS   9  -1.603  -9.568  -8.158
   47    H    GLU  10           H        GLU  10  -7.302  -4.405  -9.138
   48    HA   GLU  10           HA       GLU  10  -5.060  -2.882 -10.117
   49    HB2  GLU  10           1HB      GLU  10  -7.989  -3.050 -11.045
   50    HB3  GLU  10           2HB      GLU  10  -6.754  -2.171 -11.947
   51    HG2  GLU  10           1HG      GLU  10  -5.439  -4.289 -12.294
   52    HG3  GLU  10           2HG      GLU  10  -6.588  -5.194 -11.317
   53    H    ASP  11           H        ASP  11  -8.159  -1.998  -8.683
   54    HA   ASP  11           HA       ASP  11  -7.936   0.890  -8.825
   55    HB2  ASP  11           1HB      ASP  11  -9.528  -0.932  -6.921
   56    HB3  ASP  11           2HB      ASP  11  -9.682   0.827  -6.908
   57    H    PHE  12           H        PHE  12  -6.834  -1.529  -6.445
   58    HA   PHE  12           HA       PHE  12  -5.973   0.285  -4.381
   59    HB2  PHE  12           1HB      PHE  12  -6.326  -2.323  -4.222
   60    HB3  PHE  12           2HB      PHE  12  -4.721  -2.479  -4.922
   61    HD1  PHE  12           1HD      PHE  12  -6.627  -0.850  -2.089
   62    HD2  PHE  12           2HD      PHE  12  -2.704  -2.190  -3.450
   63    HE1  PHE  12           1HE      PHE  12  -5.658  -0.326   0.093
   64    HE2  PHE  12           2HE      PHE  12  -1.785  -1.685  -1.198
   65    HZ   PHE  12           HZ       PHE  12  -3.254  -0.757   0.583
   66    H    LYS  13           H        LYS  13  -4.076  -1.269  -7.070
   67    HA   LYS  13           HA       LYS  13  -1.555  -0.076  -6.456
   68    HB2  LYS  13           1HB      LYS  13  -2.702  -1.168  -9.077
   69    HB3  LYS  13           2HB      LYS  13  -1.014  -0.692  -8.891
   70    HG2  LYS  13           1HG      LYS  13  -0.751  -2.411  -6.996
   71    HG3  LYS  13           2HG      LYS  13  -2.423  -2.925  -7.261
   72    HD2  LYS  13           1HD      LYS  13  -0.207  -3.095  -9.427
   73    HD3  LYS  13           2HD      LYS  13  -0.655  -4.451  -8.385
   74    HE2  LYS  13           1HE      LYS  13  -3.038  -4.319  -9.345
   75    HE3  LYS  13           2HE      LYS  13  -2.468  -3.103 -10.487
   76    HZ1  LYS  13           3HZ      LYS  13  -0.937  -5.555 -10.288
   77    HZ2  LYS  13           1HZ      LYS  13  -1.298  -4.602 -11.639
   78    HZ3  LYS  13           2HZ      LYS  13  -2.466  -5.665 -11.013
   79    H    LYS  14           H        LYS  14  -4.222   0.916  -8.614
   80    HA   LYS  14           HA       LYS  14  -3.036   3.206  -9.812
   81    HB2  LYS  14           1HB      LYS  14  -5.958   2.488  -9.252
   82    HB3  LYS  14           2HB      LYS  14  -5.522   3.964 -10.129
   83    HG2  LYS  14           1HG      LYS  14  -4.367   2.605 -11.907
   84    HG3  LYS  14           2HG      LYS  14  -4.715   1.116 -11.034
   85    HD2  LYS  14           1HD      LYS  14  -7.197   1.455 -11.361
   86    HD3  LYS  14           2HD      LYS  14  -6.899   3.015 -12.149
   87    HE2  LYS  14           1HE      LYS  14  -7.318   1.201 -13.866
   88    HE3  LYS  14           2HE      LYS  14  -5.667   1.825 -14.020
   89    HZ1  LYS  14           3HZ      LYS  14  -5.905  -0.335 -12.134
   90    HZ2  LYS  14           1HZ      LYS  14  -4.807  -0.123 -13.409
   91    HZ3  LYS  14           2HZ      LYS  14  -6.347  -0.777 -13.715
   92    H    MET  15           H        MET  15  -4.885   2.814  -6.774
   93    HA   MET  15           HA       MET  15  -4.913   5.600  -6.115
   94    HB2  MET  15           1HB      MET  15  -6.477   3.904  -5.068
   95    HB3  MET  15           2HB      MET  15  -5.119   3.154  -4.247
   96    HG2  MET  15           1HG      MET  15  -6.354   4.712  -2.672
   97    HG3  MET  15           2HG      MET  15  -4.707   5.299  -2.928
   98    HE1  MET  15           3HE      MET  15  -6.820   8.593  -2.647
   99    HE2  MET  15           1HE      MET  15  -5.389   7.723  -2.092
  100    HE3  MET  15           2HE      MET  15  -6.992   7.085  -1.769
  101    H    MET  16           H        MET  16  -2.684   2.913  -5.211
  102    HA   MET  16           HA       MET  16  -0.963   4.380  -3.453
  103    HB2  MET  16           1HB      MET  16  -0.594   1.840  -5.107
  104    HB3  MET  16           2HB      MET  16   0.734   2.453  -4.143
  105    HG2  MET  16           1HG      MET  16  -2.018   1.750  -2.947
  106    HG3  MET  16           2HG      MET  16  -0.633   0.644  -2.948
  107    HE1  MET  16           3HE      MET  16  -0.777   1.773   0.768
  108    HE2  MET  16           1HE      MET  16  -0.609   0.417  -0.337
  109    HE3  MET  16           2HE      MET  16  -2.077   1.394  -0.333
  110    H    GLU  17           H        GLU  17  -0.616   3.866  -7.007
  111    HA   GLU  17           HA       GLU  17   1.955   5.208  -7.163
  112    HB2  GLU  17           1HB      GLU  17   1.810   4.875  -9.576
  113    HB3  GLU  17           2HB      GLU  17   1.047   3.454  -8.830
  114    HG2  GLU  17           1HG      GLU  17  -1.211   4.639  -9.175
  115    HG3  GLU  17           2HG      GLU  17  -0.384   5.850 -10.118
  116    H    GLU  18           H        GLU  18  -1.468   6.237  -7.571
  117    HA   GLU  18           HA       GLU  18  -0.895   8.988  -8.389
  118    HB2  GLU  18           1HB      GLU  18  -3.488   7.583  -7.500
  119    HB3  GLU  18           2HB      GLU  18  -3.448   9.272  -8.041
  120    HG2  GLU  18           1HG      GLU  18  -2.620   8.539 -10.316
  121    HG3  GLU  18           2HG      GLU  18  -2.591   6.871  -9.796
  122    H    ALA  19           H        ALA  19  -1.357   7.276  -5.308
  123    HA   ALA  19           HA       ALA  19  -1.950   9.702  -3.751
  124    HB1  ALA  19           1HB      ALA  19  -1.962   8.111  -1.764
  125    HB2  ALA  19           2HB      ALA  19  -1.457   6.804  -2.836
  126    HB3  ALA  19           3HB      ALA  19  -3.028   7.565  -3.056
  127    H    LYS  20           H        LYS  20   0.781   8.771  -5.301
  128    HA   LYS  20           HA       LYS  20   2.928   8.127  -4.018
  129    HB2  LYS  20           1HB      LYS  20   2.904   9.430  -6.274
  130    HB3  LYS  20           2HB      LYS  20   2.997  10.924  -5.343
  131    HG2  LYS  20           1HG      LYS  20   5.338  10.540  -5.843
  132    HG3  LYS  20           2HG      LYS  20   5.217   9.813  -4.238
  133    HD2  LYS  20           1HD      LYS  20   4.902   7.494  -5.360
  134    HD3  LYS  20           2HD      LYS  20   5.116   8.257  -6.932
  135    HE2  LYS  20           1HE      LYS  20   7.449   8.965  -6.240
  136    HE3  LYS  20           2HE      LYS  20   7.222   8.132  -4.697
  137    HZ1  LYS  20           3HZ      LYS  20   8.345   6.671  -6.169
  138    HZ2  LYS  20           1HZ      LYS  20   7.218   6.926  -7.407
  139    HZ3  LYS  20           2HZ      LYS  20   6.760   6.086  -6.003
  140    H    PHE  21           H        PHE  21   3.615   8.307  -1.983
  141    HA   PHE  21           HA       PHE  21   3.383  10.851  -0.469
  142    HB2  PHE  21           1HB      PHE  21   2.573   9.519   1.504
  143    HB3  PHE  21           2HB      PHE  21   1.484   9.332   0.133
  144    HD1  PHE  21           2HD      PHE  21   1.543   7.143  -1.305
  145    HD2  PHE  21           1HD      PHE  21   3.829   7.533   2.353
  146    HE1  PHE  21           2HE      PHE  21   1.855   4.672  -1.226
  147    HE2  PHE  21           1HE      PHE  21   4.151   5.073   2.418
  148    HZ   PHE  21           HZ       PHE  21   3.159   3.645   0.630
  149    H    ASN  22           H        ASN  22   4.767  10.599   1.614
  150    HA   ASN  22           HA       ASN  22   7.446  10.370   1.048
  151    HB2  ASN  22           1HB      ASN  22   5.969   9.969   3.697
  152    HB3  ASN  22           2HB      ASN  22   7.722  10.162   3.614
  153   HD21  ASN  22          1HD2      ASN  22   8.259  12.222   2.009
  154   HD22  ASN  22          2HD2      ASN  22   7.398  13.631   2.407
  155    HA   PRO  23           HA       PRO  23   7.806   5.714   0.551
  156    HB2  PRO  23           1HB      PRO  23  10.522   5.483   0.055
  157    HB3  PRO  23           2HB      PRO  23   9.376   6.127  -1.162
  158    HG2  PRO  23           1HG      PRO  23  11.189   7.669   0.720
  159    HG3  PRO  23           2HG      PRO  23  10.916   7.922  -1.023
  160    HD2  PRO  23           1HD      PRO  23   9.647   9.458   0.871
  161    HD3  PRO  23           2HD      PRO  23   8.843   9.038  -0.666
  162    H    ARG  24           H        ARG  24   9.347   7.636   3.001
  163    HA   ARG  24           HA       ARG  24  10.365   5.305   4.533
  164    HB2  ARG  24           1HB      ARG  24  10.407   8.338   5.135
  165    HB3  ARG  24           2HB      ARG  24  11.209   7.113   6.153
  166    HG2  ARG  24           1HG      ARG  24  12.706   6.456   4.209
  167    HG3  ARG  24           2HG      ARG  24  11.888   7.631   3.168
  168    HD2  ARG  24           1HD      ARG  24  13.432   8.406   5.714
  169    HD3  ARG  24           2HD      ARG  24  14.096   8.516   4.066
  170    HE   ARG  24           HE       ARG  24  11.631   9.916   4.058
  171   HH11  ARG  24          1HH2      ARG  24  14.760  10.209   5.604
  172   HH12  ARG  24          2HH2      ARG  24  14.690  11.935   5.718
  173   HH21  ARG  24          1HH1      ARG  24  11.568  12.173   4.226
  174   HH22  ARG  24          2HH1      ARG  24  12.886  13.038   4.939
  175    H    ALA  25           H        ALA  25   7.384   6.867   4.208
  176    HA   ALA  25           HA       ALA  25   6.461   6.752   6.975
  177    HB1  ALA  25           1HB      ALA  25   4.867   6.728   4.350
  178    HB2  ALA  25           2HB      ALA  25   5.262   8.162   5.273
  179    HB3  ALA  25           3HB      ALA  25   4.152   6.969   5.947
  180    H    THR  26           H        THR  26   5.116   5.124   7.871
  181    HA   THR  26           HA       THR  26   5.649   2.381   6.877
  182    HB   THR  26           HB       THR  26   4.991   1.695   9.193
  183    HG1  THR  26           1HG      THR  26   4.038   4.304   9.170
  184   HG21  THR  26          3HG2      THR  26   7.386   2.550   8.859
  185   HG22  THR  26          1HG2      THR  26   6.785   2.836  10.500
  186   HG23  THR  26          2HG2      THR  26   6.838   4.164   9.344
  187    H    PHE  27           H        PHE  27   3.785   0.852   7.255
  188    HA   PHE  27           HA       PHE  27   1.482   1.534   5.714
  189    HB2  PHE  27           1HB      PHE  27   2.235  -0.816   5.885
  190    HB3  PHE  27           2HB      PHE  27   2.030  -0.800   7.641
  191    HD1  PHE  27           2HD      PHE  27   0.094  -0.338   4.393
  192    HD2  PHE  27           1HD      PHE  27  -0.184  -1.352   8.629
  193    HE1  PHE  27           2HE      PHE  27  -2.308  -0.917   4.134
  194    HE2  PHE  27           1HE      PHE  27  -2.567  -1.929   8.329
  195    HZ   PHE  27           HZ       PHE  27  -3.601  -1.734   6.097
  196    H    SER  28           H        SER  28   1.962   1.306   9.264
  197    HA   SER  28           HA       SER  28  -0.721   1.700  10.123
  198    HB2  SER  28           1HB      SER  28   0.334   2.402  12.293
  199    HB3  SER  28           2HB      SER  28   1.177   0.998  11.616
  200    HG   SER  28           HG       SER  28   1.982   3.659  11.072
  201    H    GLU  29           H        GLU  29   1.805   4.134   9.320
  202    HA   GLU  29           HA       GLU  29   0.204   6.450  10.030
  203    HB2  GLU  29           1HB      GLU  29   2.703   6.129   8.237
  204    HB3  GLU  29           2HB      GLU  29   2.023   7.712   8.694
  205    HG2  GLU  29           1HG      GLU  29   2.444   7.184  11.137
  206    HG3  GLU  29           2HG      GLU  29   3.087   5.604  10.709
  207    H    PHE  30           H        PHE  30   0.931   4.773   6.907
  208    HA   PHE  30           HA       PHE  30  -0.566   6.546   5.202
  209    HB2  PHE  30           1HB      PHE  30   1.250   4.957   4.409
  210    HB3  PHE  30           2HB      PHE  30   0.182   3.588   4.735
  211    HD1  PHE  30           2HD      PHE  30   0.596   6.705   2.613
  212    HD2  PHE  30           1HD      PHE  30  -1.755   3.071   3.180
  213    HE1  PHE  30           2HE      PHE  30  -0.587   7.103   0.456
  214    HE2  PHE  30           1HE      PHE  30  -2.920   3.508   1.026
  215    HZ   PHE  30           HZ       PHE  30  -2.333   5.513  -0.328
  216    H    ALA  31           H        ALA  31  -1.382   3.473   6.800
  217    HA   ALA  31           HA       ALA  31  -4.022   3.161   5.732
  218    HB1  ALA  31           1HB      ALA  31  -2.682   1.284   6.714
  219    HB2  ALA  31           2HB      ALA  31  -4.241   1.419   7.525
  220    HB3  ALA  31           3HB      ALA  31  -2.780   2.020   8.309
  221    H    ALA  32           H        ALA  32  -2.753   4.736   8.673
  222    HA   ALA  32           HA       ALA  32  -5.241   5.316  10.002
  223    HB1  ALA  32           1HB      ALA  32  -2.563   6.823  10.015
  224    HB2  ALA  32           2HB      ALA  32  -3.060   5.583  11.155
  225    HB3  ALA  32           3HB      ALA  32  -3.881   7.147  11.151
  226    H    LYS  33           H        LYS  33  -3.484   7.047   7.411
  227    HA   LYS  33           HA       LYS  33  -5.241   9.359   7.297
  228    HB2  LYS  33           1HB      LYS  33  -3.210   8.185   5.299
  229    HB3  LYS  33           2HB      LYS  33  -4.005   9.737   5.059
  230    HG2  LYS  33           1HG      LYS  33  -2.271   9.133   7.535
  231    HG3  LYS  33           2HG      LYS  33  -1.604   9.844   6.065
  232    HD2  LYS  33           1HD      LYS  33  -3.140  11.843   6.320
  233    HD3  LYS  33           2HD      LYS  33  -3.865  11.137   7.767
  234    HE2  LYS  33           1HE      LYS  33  -2.114  12.853   8.369
  235    HE3  LYS  33           2HE      LYS  33  -1.661  11.245   8.959
  236    HZ1  LYS  33           3HZ      LYS  33  -0.749  11.770   6.274
  237    HZ2  LYS  33           1HZ      LYS  33   0.106  11.185   7.619
  238    HZ3  LYS  33           2HZ      LYS  33  -0.116  12.858   7.416
  239    H    HIS  34           H        HIS  34  -5.063   6.283   5.471
  240    HA   HIS  34           HA       HIS  34  -7.461   7.023   3.885
  241    HB2  HIS  34           1HB      HIS  34  -5.432   4.718   3.637
  242    HB3  HIS  34           2HB      HIS  34  -6.833   4.896   2.563
  243    HD2  HIS  34           2HD      HIS  34  -6.606   7.062   0.704
  244    HE1  HIS  34           1HE      HIS  34  -2.725   8.284   1.793
  245    HE2  HIS  34           2HE      HIS  34  -4.583   8.590   0.093
  246    H    ALA  35           H        ALA  35  -6.896   5.638   6.870
  247    HA   ALA  35           HA       ALA  35  -8.255   3.229   7.044
  248    HB1  ALA  35           1HB      ALA  35  -8.053   5.506   9.064
  249    HB2  ALA  35           2HB      ALA  35  -7.192   3.971   9.083
  250    HB3  ALA  35           3HB      ALA  35  -8.900   4.010   9.474
  251    H    LYS  36           H        LYS  36  -9.671   6.502   6.921
  252    HA   LYS  36           HA       LYS  36 -12.383   5.535   7.317
  253    HB2  LYS  36           1HB      LYS  36 -11.230   8.282   6.468
  254    HB3  LYS  36           2HB      LYS  36 -12.940   8.013   6.867
  255    HG2  LYS  36           1HG      LYS  36 -12.291   7.320   9.219
  256    HG3  LYS  36           2HG      LYS  36 -10.575   7.579   8.826
  257    HD2  LYS  36           1HD      LYS  36 -11.054  10.049   8.373
  258    HD3  LYS  36           2HD      LYS  36 -12.752   9.788   8.814
  259    HE2  LYS  36           1HE      LYS  36 -10.344   9.394  10.703
  260    HE3  LYS  36           2HE      LYS  36 -11.507  10.732  10.778
  261    HZ1  LYS  36           3HZ      LYS  36 -12.486   9.333  12.244
  262    HZ2  LYS  36           1HZ      LYS  36 -11.826   7.932  11.552
  263    HZ3  LYS  36           2HZ      LYS  36 -13.173   8.679  10.835
  264    H    ASP  37           H        ASP  37 -10.248   5.622   4.626
  265    HA   ASP  37           HA       ASP  37 -12.047   6.277   2.489
  266    HB2  ASP  37           1HB      ASP  37  -9.432   6.111   2.384
  267    HB3  ASP  37           2HB      ASP  37  -9.636   4.367   2.217
  268    H    SER  38           H        SER  38 -13.399   4.966   1.266
  269    HA   SER  38           HA       SER  38 -14.657   2.708   2.446
  270    HB2  SER  38           1HB      SER  38 -14.771   3.879  -0.365
  271    HB3  SER  38           2HB      SER  38 -15.795   2.527   0.137
  272    HG   SER  38           HG       SER  38 -16.798   4.566   0.466
  273    H    ARG  39           H        ARG  39 -12.070   3.008   0.093
  274    HA   ARG  39           HA       ARG  39 -11.910   0.273  -0.832
  275    HB2  ARG  39           1HB      ARG  39  -9.948   2.630  -0.932
  276    HB3  ARG  39           2HB      ARG  39  -9.582   1.063  -1.681
  277    HG2  ARG  39           1HG      ARG  39 -11.597   1.256  -3.187
  278    HG3  ARG  39           2HG      ARG  39 -12.090   2.764  -2.385
  279    HD2  ARG  39           1HD      ARG  39  -9.420   2.455  -3.890
  280    HD3  ARG  39           2HD      ARG  39 -10.895   3.131  -4.627
  281    HE   ARG  39           HE       ARG  39 -10.408   4.506  -2.180
  282   HH11  ARG  39          1HH2      ARG  39  -8.913   4.169  -5.326
  283   HH12  ARG  39          2HH2      ARG  39  -8.269   5.779  -5.330
  284   HH21  ARG  39          1HH1      ARG  39  -9.595   6.585  -2.224
  285   HH22  ARG  39          2HH1      ARG  39  -8.671   7.146  -3.576
  286    H    PHE  40           H        PHE  40 -10.629   1.953   1.966
  287    HA   PHE  40           HA       PHE  40  -8.498   0.092   2.601
  288    HB2  PHE  40           1HB      PHE  40  -8.415   2.297   3.669
  289    HB3  PHE  40           2HB      PHE  40 -10.038   2.117   4.313
  290    HD1  PHE  40           2HD      PHE  40  -6.552   0.720   4.574
  291    HD2  PHE  40           1HD      PHE  40 -10.439   0.978   6.497
  292    HE1  PHE  40           2HE      PHE  40  -5.656  -0.404   6.584
  293    HE2  PHE  40           1HE      PHE  40  -9.504  -0.138   8.507
  294    HZ   PHE  40           HZ       PHE  40  -7.111  -0.822   8.553
  295    H    LYS  41           H        LYS  41 -11.813   0.424   3.880
  296    HA   LYS  41           HA       LYS  41 -11.756  -1.995   5.507
  297    HB2  LYS  41           1HB      LYS  41 -14.213  -1.457   5.913
  298    HB3  LYS  41           2HB      LYS  41 -13.181  -0.039   6.137
  299    HG2  LYS  41           1HG      LYS  41 -13.782   0.823   3.860
  300    HG3  LYS  41           2HG      LYS  41 -14.731  -0.615   3.509
  301    HD2  LYS  41           1HD      LYS  41 -16.346   1.127   4.076
  302    HD3  LYS  41           2HD      LYS  41 -16.297   0.041   5.468
  303    HE2  LYS  41           1HE      LYS  41 -14.847   1.677   6.715
  304    HE3  LYS  41           2HE      LYS  41 -14.776   2.728   5.301
  305    HZ1  LYS  41           3HZ      LYS  41 -17.174   2.964   5.421
  306    HZ2  LYS  41           1HZ      LYS  41 -16.439   3.474   6.860
  307    HZ3  LYS  41           2HZ      LYS  41 -17.225   1.968   6.795
  308    H    ALA  42           H        ALA  42 -12.297  -1.423   2.122
  309    HA   ALA  42           HA       ALA  42 -14.140  -3.546   1.476
  310    HB1  ALA  42           1HB      ALA  42 -13.579  -1.608  -0.074
  311    HB2  ALA  42           2HB      ALA  42 -13.332  -3.162  -0.874
  312    HB3  ALA  42           3HB      ALA  42 -11.948  -2.252  -0.265
  313    H    ILE  43           H        ILE  43 -10.647  -3.404   2.008
  314    HA   ILE  43           HA       ILE  43 -10.274  -6.230   1.199
  315    HB   ILE  43           HB       ILE  43  -8.180  -4.376   2.495
  316   HG12  ILE  43          1HG1      ILE  43  -8.936  -3.077   0.520
  317   HG13  ILE  43          2HG1      ILE  43  -7.392  -3.794   0.106
  318   HG21  ILE  43          1HG2      ILE  43  -7.821  -6.763   0.559
  319   HG22  ILE  43          2HG2      ILE  43  -7.645  -6.877   2.302
  320   HG23  ILE  43          3HG2      ILE  43  -6.523  -5.881   1.369
  321   HD11  ILE  43          3HD1      ILE  43  -8.806  -5.702  -1.012
  322   HD12  ILE  43          1HD1      ILE  43  -8.748  -4.134  -1.820
  323   HD13  ILE  43          2HD1      ILE  43 -10.160  -4.585  -0.858
  324    H    GLU  44           H        GLU  44 -10.903  -7.717   2.660
  325    HA   GLU  44           HA       GLU  44 -11.422  -7.267   5.456
  326    HB2  GLU  44           1HB      GLU  44 -11.188  -9.839   3.756
  327    HB3  GLU  44           2HB      GLU  44 -11.793  -9.815   5.434
  328    HG2  GLU  44           1HG      GLU  44 -13.699  -8.285   4.742
  329    HG3  GLU  44           2HG      GLU  44 -13.092  -8.252   3.075
  330    H    LYS  45           H        LYS  45  -8.802  -8.953   3.665
  331    HA   LYS  45           HA       LYS  45  -7.317  -9.735   6.064
  332    HB2  LYS  45           1HB      LYS  45  -6.647  -9.844   3.047
  333    HB3  LYS  45           2HB      LYS  45  -5.632 -10.562   4.314
  334    HG2  LYS  45           1HG      LYS  45  -7.574 -12.077   4.989
  335    HG3  LYS  45           2HG      LYS  45  -8.563 -11.368   3.697
  336    HD2  LYS  45           1HD      LYS  45  -6.912 -12.232   1.954
  337    HD3  LYS  45           2HD      LYS  45  -5.920 -12.937   3.238
  338    HE2  LYS  45           1HE      LYS  45  -7.834 -14.454   3.879
  339    HE3  LYS  45           2HE      LYS  45  -8.821 -13.752   2.591
  340    HZ1  LYS  45           3HZ      LYS  45  -7.960 -15.369   1.362
  341    HZ2  LYS  45           1HZ      LYS  45  -6.692 -15.675   2.441
  342    HZ3  LYS  45           2HZ      LYS  45  -6.552 -14.420   1.307
  343    H    MET  46           H        MET  46  -5.825  -8.501   7.067
  344    HA   MET  46           HA       MET  46  -4.964  -5.913   5.969
  345    HB2  MET  46           1HB      MET  46  -5.797  -6.190   8.375
  346    HB3  MET  46           2HB      MET  46  -4.383  -7.192   8.700
  347    HG2  MET  46           1HG      MET  46  -2.870  -5.195   8.128
  348    HG3  MET  46           2HG      MET  46  -4.308  -4.218   7.837
  349    HE1  MET  46           3HE      MET  46  -2.751  -6.657  10.553
  350    HE2  MET  46           1HE      MET  46  -2.597  -5.535  11.904
  351    HE3  MET  46           2HE      MET  46  -1.706  -5.247  10.418
  352    H    LYS  47           H        LYS  47  -3.781  -9.155   6.538
  353    HA   LYS  47           HA       LYS  47  -0.965  -8.750   6.424
  354    HB2  LYS  47           1HB      LYS  47  -2.663 -11.213   5.668
  355    HB3  LYS  47           2HB      LYS  47  -0.898 -11.269   5.829
  356    HG2  LYS  47           1HG      LYS  47  -2.816 -10.484   8.144
  357    HG3  LYS  47           2HG      LYS  47  -2.156 -12.114   7.923
  358    HD2  LYS  47           1HD      LYS  47   0.216 -11.190   8.195
  359    HD3  LYS  47           2HD      LYS  47  -0.428  -9.571   8.437
  360    HE2  LYS  47           1HE      LYS  47  -1.603 -10.317  10.510
  361    HE3  LYS  47           2HE      LYS  47  -0.975 -11.955  10.276
  362    HZ1  LYS  47           3HZ      LYS  47   1.287 -10.723  10.161
  363    HZ2  LYS  47           1HZ      LYS  47   0.578 -11.050  11.663
  364    HZ3  LYS  47           2HZ      LYS  47   0.460  -9.493  10.992
  365    H    ASP  48           H        ASP  48  -3.372  -9.283   3.867
  366    HA   ASP  48           HA       ASP  48  -1.506  -9.538   1.702
  367    HB2  ASP  48           1HB      ASP  48  -3.978 -10.278   1.645
  368    HB3  ASP  48           2HB      ASP  48  -4.453  -8.577   1.567
  369    H    ARG  49           H        ARG  49  -3.002  -6.758   3.305
  370    HA   ARG  49           HA       ARG  49  -2.332  -4.749   1.341
  371    HB2  ARG  49           1HB      ARG  49  -2.674  -4.408   4.386
  372    HB3  ARG  49           2HB      ARG  49  -2.652  -3.106   3.200
  373    HG2  ARG  49           1HG      ARG  49  -4.740  -4.035   2.101
  374    HG3  ARG  49           2HG      ARG  49  -4.767  -5.355   3.286
  375    HD2  ARG  49           1HD      ARG  49  -6.365  -3.585   4.042
  376    HD3  ARG  49           2HD      ARG  49  -5.005  -3.607   5.147
  377    HE   ARG  49           HE       ARG  49  -4.345  -1.511   4.387
  378   HH11  ARG  49          1HH2      ARG  49  -6.671  -2.847   2.172
  379   HH12  ARG  49          2HH2      ARG  49  -6.804  -1.393   1.243
  380   HH21  ARG  49          1HH1      ARG  49  -4.489   0.341   3.188
  381   HH22  ARG  49          2HH1      ARG  49  -5.554   0.431   1.831
  382    H    GLU  50           H        GLU  50  -0.581  -6.113   4.191
  383    HA   GLU  50           HA       GLU  50   1.655  -4.353   4.261
  384    HB2  GLU  50           1HB      GLU  50   1.483  -7.333   5.020
  385    HB3  GLU  50           2HB      GLU  50   2.862  -6.312   5.419
  386    HG2  GLU  50           1HG      GLU  50  -0.020  -5.763   6.380
  387    HG3  GLU  50           2HG      GLU  50   1.205  -6.571   7.360
  388    H    ALA  51           H        ALA  51   1.099  -7.417   2.439
  389    HA   ALA  51           HA       ALA  51   3.652  -7.711   1.266
  390    HB1  ALA  51           1HB      ALA  51   0.929  -8.434   0.021
  391    HB2  ALA  51           2HB      ALA  51   1.807  -9.438   1.164
  392    HB3  ALA  51           3HB      ALA  51   2.489  -9.135  -0.442
  393    H    LEU  52           H        LEU  52   0.719  -6.008  -0.102
  394    HA   LEU  52           HA       LEU  52   1.984  -5.013  -2.450
  395    HB2  LEU  52           1HB      LEU  52  -0.580  -4.317  -0.966
  396    HB3  LEU  52           2HB      LEU  52  -0.042  -3.233  -2.256
  397    HG   LEU  52           HG       LEU  52  -1.715  -5.000  -3.079
  398   HD11  LEU  52          1HD1      LEU  52   0.264  -4.014  -4.608
  399   HD12  LEU  52          2HD1      LEU  52  -0.737  -5.334  -5.189
  400   HD13  LEU  52          3HD1      LEU  52   0.875  -5.673  -4.561
  401   HD21  LEU  52          3HD2      LEU  52  -1.146  -7.382  -3.219
  402   HD22  LEU  52          1HD2      LEU  52  -0.892  -6.883  -1.556
  403   HD23  LEU  52          2HD2      LEU  52   0.488  -7.104  -2.611
  404    H    PHE  53           H        PHE  53   1.441  -3.521   0.774
  405    HA   PHE  53           HA       PHE  53   2.430  -0.922   0.212
  406    HB2  PHE  53           1HB      PHE  53   1.127  -1.616   2.312
  407    HB3  PHE  53           2HB      PHE  53   2.563  -2.453   2.886
  408    HD1  PHE  53           1HD      PHE  53   1.132   0.930   2.122
  409    HD2  PHE  53           2HD      PHE  53   4.597  -1.162   3.710
  410    HE1  PHE  53           1HE      PHE  53   2.065   3.066   2.924
  411    HE2  PHE  53           2HE      PHE  53   5.499   1.005   4.532
  412    HZ   PHE  53           HZ       PHE  53   4.223   3.106   4.132
  413    H    ASN  54           H        ASN  54   4.062  -3.764   1.581
  414    HA   ASN  54           HA       ASN  54   6.699  -2.668   1.814
  415    HB2  ASN  54           1HB      ASN  54   5.757  -5.588   1.470
  416    HB3  ASN  54           2HB      ASN  54   7.428  -5.155   1.859
  417   HD21  ASN  54          1HD2      ASN  54   5.140  -6.573   3.462
  418   HD22  ASN  54          2HD2      ASN  54   5.162  -5.780   4.964
  419    H    GLU  55           H        GLU  55   5.054  -4.478  -0.852
  420    HA   GLU  55           HA       GLU  55   7.322  -4.633  -2.604
  421    HB2  GLU  55           1HB      GLU  55   5.190  -6.105  -2.765
  422    HB3  GLU  55           2HB      GLU  55   4.344  -4.712  -3.417
  423    HG2  GLU  55           1HG      GLU  55   5.067  -6.070  -5.361
  424    HG3  GLU  55           2HG      GLU  55   6.099  -4.647  -5.355
  425    H    PHE  56           H        PHE  56   4.598  -2.302  -2.274
  426    HA   PHE  56           HA       PHE  56   5.094  -0.738  -4.563
  427    HB2  PHE  56           1HB      PHE  56   2.947  -0.595  -3.293
  428    HB3  PHE  56           2HB      PHE  56   3.791   0.032  -1.872
  429    HD1  PHE  56           1HD      PHE  56   3.149   0.767  -5.549
  430    HD2  PHE  56           2HD      PHE  56   4.190   2.500  -1.682
  431    HE1  PHE  56           1HE      PHE  56   3.061   3.049  -6.527
  432    HE2  PHE  56           2HE      PHE  56   4.072   4.773  -2.688
  433    HZ   PHE  56           HZ       PHE  56   3.513   5.049  -5.094
  434    H    VAL  57           H        VAL  57   6.176  -0.239  -1.150
  435    HA   VAL  57           HA       VAL  57   7.714   2.142  -1.585
  436    HB   VAL  57           HB       VAL  57   7.834  -0.028   0.610
  437   HG11  VAL  57          1HG1      VAL  57  10.051   1.105   0.723
  438   HG12  VAL  57          2HG1      VAL  57   9.069   1.815   2.003
  439   HG13  VAL  57          3HG1      VAL  57   9.310   2.697   0.491
  440   HG21  VAL  57          3HG2      VAL  57   5.660   1.345   0.487
  441   HG22  VAL  57          1HG2      VAL  57   6.605   2.826   0.679
  442   HG23  VAL  57          2HG2      VAL  57   6.537   1.643   1.986
  443    H    ALA  58           H        ALA  58   8.611  -1.338  -1.522
  444    HA   ALA  58           HA       ALA  58  11.415  -0.986  -1.929
  445    HB1  ALA  58           1HB      ALA  58   9.593  -3.392  -2.553
  446    HB2  ALA  58           2HB      ALA  58  10.382  -3.088  -1.009
  447    HB3  ALA  58           3HB      ALA  58  11.355  -3.469  -2.433
  448    H    ALA  59           H        ALA  59   8.664  -1.472  -4.203
  449    HA   ALA  59           HA       ALA  59  10.241  -1.653  -6.629
  450    HB1  ALA  59           1HB      ALA  59   7.253  -1.073  -6.171
  451    HB2  ALA  59           2HB      ALA  59   7.964  -2.660  -6.467
  452    HB3  ALA  59           3HB      ALA  59   7.974  -1.442  -7.750
  453    H    ALA  60           H        ALA  60   8.460   0.974  -4.937
  454    HA   ALA  60           HA       ALA  60   8.710   2.995  -6.956
  455    HB1  ALA  60           1HB      ALA  60   8.294   3.248  -3.911
  456    HB2  ALA  60           2HB      ALA  60   7.023   3.183  -5.129
  457    HB3  ALA  60           3HB      ALA  60   8.092   4.590  -5.053
  458    H    ARG  61           H        ARG  61  10.796   2.139  -4.136
  459    HA   ARG  61           HA       ARG  61  12.562   4.380  -4.430
  460    HB2  ARG  61           1HB      ARG  61  12.272   3.116  -2.251
  461    HB3  ARG  61           2HB      ARG  61  13.014   1.687  -2.978
  462    HG2  ARG  61           1HG      ARG  61  15.214   2.947  -3.253
  463    HG3  ARG  61           2HG      ARG  61  14.472   4.404  -2.565
  464    HD2  ARG  61           1HD      ARG  61  15.827   3.238  -0.815
  465    HD3  ARG  61           2HD      ARG  61  14.102   3.129  -0.387
  466    HE   ARG  61           HE       ARG  61  14.860   0.830  -1.945
  467   HH11  ARG  61          1HH2      ARG  61  15.281   2.188   1.268
  468   HH12  ARG  61          2HH2      ARG  61  15.524   0.649   2.030
  469   HH21  ARG  61          1HH1      ARG  61  15.186  -1.167  -0.905
  470   HH22  ARG  61          2HH1      ARG  61  15.470  -1.237   0.800
  Start of MODEL    3
    1    H    ILE   5           H        ILE   5 -12.975 -10.136 -11.796
    2    HA   ILE   5           HA       ILE   5 -11.663  -9.486 -13.587
    3    HB   ILE   5           HB       ILE   5 -13.249  -6.827 -13.308
    4   HG12  ILE   5          1HG1      ILE   5 -13.955  -9.154 -15.224
    5   HG13  ILE   5          2HG1      ILE   5 -14.625  -9.068 -13.615
    6   HG21  ILE   5          1HG2      ILE   5 -11.583  -6.185 -14.905
    7   HG22  ILE   5          2HG2      ILE   5 -12.750  -6.886 -16.001
    8   HG23  ILE   5          3HG2      ILE   5 -11.352  -7.828 -15.509
    9   HD11  ILE   5          3HD1      ILE   5 -16.125  -8.061 -15.378
   10   HD12  ILE   5          1HD1      ILE   5 -14.929  -6.787 -15.610
   11   HD13  ILE   5          2HD1      ILE   5 -15.743  -6.970 -14.050
   12    H    MET   6           H        MET   6 -10.675  -9.192 -10.900
   13    HA   MET   6           HA       MET   6  -9.047  -8.113  -9.567
   14    HB2  MET   6           1HB      MET   6  -7.979  -7.614 -12.439
   15    HB3  MET   6           2HB      MET   6  -6.995  -7.417 -10.979
   16    HG2  MET   6           1HG      MET   6  -7.341  -9.847 -10.408
   17    HG3  MET   6           2HG      MET   6  -8.331 -10.042 -11.867
   18    HE1  MET   6           3HE      MET   6  -6.076 -11.955 -11.331
   19    HE2  MET   6           1HE      MET   6  -5.161 -12.001 -12.842
   20    HE3  MET   6           2HE      MET   6  -6.919 -11.957 -12.882
   21    H    GLN   7           H        GLN   7 -11.384  -6.440 -10.705
   22    HA   GLN   7           HA       GLN   7 -10.534  -3.823 -11.328
   23    HB2  GLN   7           1HB      GLN   7 -12.899  -4.718 -11.643
   24    HB3  GLN   7           2HB      GLN   7 -13.137  -4.695  -9.887
   25    HG2  GLN   7           1HG      GLN   7 -12.752  -2.165  -9.895
   26    HG3  GLN   7           2HG      GLN   7 -12.542  -2.211 -11.645
   27   HE21  GLN   7          1HE2      GLN   7 -14.523  -0.612 -10.450
   28   HE22  GLN   7          2HE2      GLN   7 -16.057  -1.231 -10.843
   29    H    ALA   8           H        ALA   8 -11.311  -5.362  -8.195
   30    HA   ALA   8           HA       ALA   8 -11.009  -3.077  -6.509
   31    HB1  ALA   8           1HB      ALA   8 -10.539  -6.065  -5.877
   32    HB2  ALA   8           2HB      ALA   8 -12.091  -5.233  -5.767
   33    HB3  ALA   8           3HB      ALA   8 -10.773  -4.791  -4.667
   34    H    LYS   9           H        LYS   9  -8.646  -5.595  -7.573
   35    HA   LYS   9           HA       LYS   9  -6.438  -4.563  -6.077
   36    HB2  LYS   9           1HB      LYS   9  -6.568  -6.296  -8.643
   37    HB3  LYS   9           2HB      LYS   9  -5.067  -6.020  -7.730
   38    HG2  LYS   9           1HG      LYS   9  -6.109  -7.080  -5.676
   39    HG3  LYS   9           2HG      LYS   9  -7.613  -7.358  -6.586
   40    HD2  LYS   9           1HD      LYS   9  -6.362  -8.861  -8.197
   41    HD3  LYS   9           2HD      LYS   9  -4.858  -8.579  -7.303
   42    HE2  LYS   9           1HE      LYS   9  -5.871  -9.645  -5.250
   43    HE3  LYS   9           2HE      LYS   9  -7.381  -9.928  -6.146
   44    HZ1  LYS   9           3HZ      LYS   9  -6.346 -11.871  -6.545
   45    HZ2  LYS   9           1HZ      LYS   9  -4.787 -11.227  -6.405
   46    HZ3  LYS   9           2HZ      LYS   9  -5.675 -10.987  -7.832
   47    H    GLU  10           H        GLU  10  -7.539  -3.961  -9.395
   48    HA   GLU  10           HA       GLU  10  -5.320  -2.328 -10.196
   49    HB2  GLU  10           1HB      GLU  10  -8.236  -2.528 -11.176
   50    HB3  GLU  10           2HB      GLU  10  -7.036  -1.482 -11.970
   51    HG2  GLU  10           1HG      GLU  10  -5.601  -3.463 -12.509
   52    HG3  GLU  10           2HG      GLU  10  -6.670  -4.533 -11.638
   53    H    ASP  11           H        ASP  11  -8.455  -1.631  -8.669
   54    HA   ASP  11           HA       ASP  11  -8.294   1.241  -8.684
   55    HB2  ASP  11           1HB      ASP  11  -9.823  -0.692  -6.828
   56    HB3  ASP  11           2HB      ASP  11 -10.023   1.058  -6.774
   57    H    PHE  12           H        PHE  12  -7.233  -1.235  -6.360
   58    HA   PHE  12           HA       PHE  12  -6.336   0.547  -4.288
   59    HB2  PHE  12           1HB      PHE  12  -6.692  -1.909  -3.899
   60    HB3  PHE  12           2HB      PHE  12  -5.412  -2.295  -5.035
   61    HD1  PHE  12           2HD      PHE  12  -6.081  -0.393  -1.833
   62    HD2  PHE  12           1HD      PHE  12  -3.036  -2.340  -4.261
   63    HE1  PHE  12           2HE      PHE  12  -4.389  -0.024  -0.058
   64    HE2  PHE  12           1HE      PHE  12  -1.378  -1.942  -2.458
   65    HZ   PHE  12           HZ       PHE  12  -2.043  -0.801  -0.348
   66    H    LYS  13           H        LYS  13  -4.536  -1.043  -7.006
   67    HA   LYS  13           HA       LYS  13  -2.003   0.119  -6.488
   68    HB2  LYS  13           1HB      LYS  13  -3.330  -0.949  -9.058
   69    HB3  LYS  13           2HB      LYS  13  -1.618  -0.511  -8.995
   70    HG2  LYS  13           1HG      LYS  13  -2.868  -2.594  -7.096
   71    HG3  LYS  13           2HG      LYS  13  -2.175  -3.040  -8.654
   72    HD2  LYS  13           1HD      LYS  13   0.081  -2.094  -7.905
   73    HD3  LYS  13           2HD      LYS  13  -0.616  -1.683  -6.336
   74    HE2  LYS  13           1HE      LYS  13  -0.441  -4.548  -7.442
   75    HE3  LYS  13           2HE      LYS  13   0.623  -3.860  -6.206
   76    HZ1  LYS  13           3HZ      LYS  13  -1.347  -3.433  -4.842
   77    HZ2  LYS  13           1HZ      LYS  13  -1.174  -5.081  -5.190
   78    HZ3  LYS  13           2HZ      LYS  13  -2.329  -4.160  -6.019
   79    H    LYS  14           H        LYS  14  -4.663   1.080  -8.521
   80    HA   LYS  14           HA       LYS  14  -3.470   3.292  -9.751
   81    HB2  LYS  14           1HB      LYS  14  -5.662   2.289 -10.486
   82    HB3  LYS  14           2HB      LYS  14  -6.440   2.956  -9.038
   83    HG2  LYS  14           1HG      LYS  14  -5.846   5.312  -9.783
   84    HG3  LYS  14           2HG      LYS  14  -4.997   4.659 -11.201
   85    HD2  LYS  14           1HD      LYS  14  -7.183   3.706 -12.050
   86    HD3  LYS  14           2HD      LYS  14  -8.020   4.375 -10.636
   87    HE2  LYS  14           1HE      LYS  14  -7.384   6.710 -11.348
   88    HE3  LYS  14           2HE      LYS  14  -6.516   6.053 -12.754
   89    HZ1  LYS  14           3HZ      LYS  14  -8.515   5.163 -13.596
   90    HZ2  LYS  14           1HZ      LYS  14  -8.805   6.785 -13.210
   91    HZ3  LYS  14           2HZ      LYS  14  -9.375   5.555 -12.186
   92    H    MET  15           H        MET  15  -5.241   2.958  -6.679
   93    HA   MET  15           HA       MET  15  -5.253   5.748  -6.026
   94    HB2  MET  15           1HB      MET  15  -6.787   4.058  -4.942
   95    HB3  MET  15           2HB      MET  15  -5.421   3.309  -4.148
   96    HG2  MET  15           1HG      MET  15  -4.957   5.443  -2.870
   97    HG3  MET  15           2HG      MET  15  -6.270   6.246  -3.712
   98    HE1  MET  15           3HE      MET  15  -5.451   2.984  -1.643
   99    HE2  MET  15           1HE      MET  15  -6.566   3.183  -0.290
  100    HE3  MET  15           2HE      MET  15  -5.281   4.351  -0.550
  101    H    MET  16           H        MET  16  -3.001   3.079  -5.233
  102    HA   MET  16           HA       MET  16  -1.331   4.543  -3.419
  103    HB2  MET  16           1HB      MET  16  -0.893   2.044  -5.187
  104    HB3  MET  16           2HB      MET  16   0.359   2.610  -4.079
  105    HG2  MET  16           1HG      MET  16  -2.486   1.901  -3.148
  106    HG3  MET  16           2HG      MET  16  -1.154   0.770  -3.115
  107    HE1  MET  16           3HE      MET  16   0.211   0.452  -0.902
  108    HE2  MET  16           1HE      MET  16   1.085   1.842  -0.273
  109    HE3  MET  16           2HE      MET  16   1.207   1.445  -1.975
  110    H    GLU  17           H        GLU  17  -0.953   4.034  -6.935
  111    HA   GLU  17           HA       GLU  17   1.643   5.254  -7.102
  112    HB2  GLU  17           1HB      GLU  17   1.314   5.103  -9.571
  113    HB3  GLU  17           2HB      GLU  17   0.703   3.620  -8.801
  114    HG2  GLU  17           1HG      GLU  17  -1.617   4.630  -8.910
  115    HG3  GLU  17           2HG      GLU  17  -1.014   5.984  -9.818
  116    H    GLU  18           H        GLU  18  -1.642   6.486  -7.640
  117    HA   GLU  18           HA       GLU  18  -0.829   9.172  -8.442
  118    HB2  GLU  18           1HB      GLU  18  -3.220   9.618  -8.668
  119    HB3  GLU  18           2HB      GLU  18  -2.985   7.950  -9.205
  120    HG2  GLU  18           1HG      GLU  18  -4.868   7.660  -7.767
  121    HG3  GLU  18           2HG      GLU  18  -3.568   7.367  -6.672
  122    H    ALA  19           H        ALA  19  -1.266   7.547  -5.423
  123    HA   ALA  19           HA       ALA  19  -1.881   9.979  -3.874
  124    HB1  ALA  19           1HB      ALA  19  -1.886   8.378  -1.884
  125    HB2  ALA  19           2HB      ALA  19  -1.490   7.064  -2.993
  126    HB3  ALA  19           3HB      ALA  19  -3.021   7.934  -3.161
  127    H    LYS  20           H        LYS  20   0.799   8.917  -5.362
  128    HA   LYS  20           HA       LYS  20   2.904   8.250  -4.074
  129    HB2  LYS  20           1HB      LYS  20   2.906   9.601  -6.303
  130    HB3  LYS  20           2HB      LYS  20   3.001  11.067  -5.334
  131    HG2  LYS  20           1HG      LYS  20   5.317  10.681  -5.787
  132    HG3  LYS  20           2HG      LYS  20   5.165   9.920  -4.213
  133    HD2  LYS  20           1HD      LYS  20   4.808   7.634  -5.427
  134    HD3  LYS  20           2HD      LYS  20   5.161   8.462  -6.944
  135    HE2  LYS  20           1HE      LYS  20   7.103   8.253  -4.555
  136    HE3  LYS  20           2HE      LYS  20   7.225   7.344  -6.074
  137    HZ1  LYS  20           3HZ      LYS  20   7.388  10.278  -5.705
  138    HZ2  LYS  20           1HZ      LYS  20   7.267   9.529  -7.220
  139    HZ3  LYS  20           2HZ      LYS  20   8.617   9.231  -6.238
  140    H    PHE  21           H        PHE  21   3.634   8.429  -2.040
  141    HA   PHE  21           HA       PHE  21   3.429  11.004  -0.582
  142    HB2  PHE  21           1HB      PHE  21   2.644   9.740   1.439
  143    HB3  PHE  21           2HB      PHE  21   1.504   9.603   0.100
  144    HD1  PHE  21           1HD      PHE  21   1.405   7.431  -1.312
  145    HD2  PHE  21           2HD      PHE  21   3.860   7.684   2.237
  146    HE1  PHE  21           1HE      PHE  21   1.636   4.960  -1.301
  147    HE2  PHE  21           2HE      PHE  21   4.096   5.194   2.247
  148    HZ   PHE  21           HZ       PHE  21   2.985   3.836   0.465
  149    H    ASN  22           H        ASN  22   4.717  10.761   1.542
  150    HA   ASN  22           HA       ASN  22   7.365  10.574   1.044
  151    HB2  ASN  22           1HB      ASN  22   5.956  10.087   3.682
  152    HB3  ASN  22           2HB      ASN  22   7.696  10.371   3.558
  153   HD21  ASN  22          1HD2      ASN  22   8.139  12.427   2.040
  154   HD22  ASN  22          2HD2      ASN  22   7.219  13.801   2.423
  155    HA   PRO  23           HA       PRO  23   7.798   6.014   0.442
  156    HB2  PRO  23           1HB      PRO  23  10.515   5.883  -0.043
  157    HB3  PRO  23           2HB      PRO  23   9.361   6.524  -1.244
  158    HG2  PRO  23           1HG      PRO  23  11.146   8.051   0.673
  159    HG3  PRO  23           2HG      PRO  23  10.827   8.362  -1.054
  160    HD2  PRO  23           1HD      PRO  23   9.559   9.767   0.953
  161    HD3  PRO  23           2HD      PRO  23   8.750   9.420  -0.628
  162    H    ARG  24           H        ARG  24   9.299   7.880   2.948
  163    HA   ARG  24           HA       ARG  24  10.365   5.533   4.401
  164    HB2  ARG  24           1HB      ARG  24  10.387   8.554   5.053
  165    HB3  ARG  24           2HB      ARG  24  11.177   7.321   6.064
  166    HG2  ARG  24           1HG      ARG  24  12.687   6.688   4.119
  167    HG3  ARG  24           2HG      ARG  24  11.893   7.909   3.106
  168    HD2  ARG  24           1HD      ARG  24  13.389   8.581   5.713
  169    HD3  ARG  24           2HD      ARG  24  14.096   8.729   4.102
  170    HE   ARG  24           HE       ARG  24  12.087  10.486   5.319
  171   HH11  ARG  24          1HH2      ARG  24  13.416   9.362   2.280
  172   HH12  ARG  24          2HH2      ARG  24  12.964  10.785   1.405
  173   HH21  ARG  24          1HH1      ARG  24  11.466  12.326   4.127
  174   HH22  ARG  24          2HH1      ARG  24  11.865  12.454   2.447
  175    H    ALA  25           H        ALA  25   7.382   6.921   4.093
  176    HA   ALA  25           HA       ALA  25   6.476   6.796   6.854
  177    HB1  ALA  25           1HB      ALA  25   4.901   6.739   4.221
  178    HB2  ALA  25           2HB      ALA  25   5.276   8.178   5.145
  179    HB3  ALA  25           3HB      ALA  25   4.185   6.970   5.820
  180    H    THR  26           H        THR  26   5.147   5.176   7.704
  181    HA   THR  26           HA       THR  26   5.740   2.435   6.744
  182    HB   THR  26           HB       THR  26   5.147   1.740   9.063
  183    HG1  THR  26           1HG      THR  26   4.174   3.067  10.413
  184   HG21  THR  26          3HG2      THR  26   6.938   2.905  10.334
  185   HG22  THR  26          1HG2      THR  26   6.924   4.256   9.201
  186   HG23  THR  26          2HG2      THR  26   7.506   2.670   8.674
  187    H    PHE  27           H        PHE  27   3.935   0.881   7.159
  188    HA   PHE  27           HA       PHE  27   1.637   1.497   5.609
  189    HB2  PHE  27           1HB      PHE  27   2.448  -0.836   5.835
  190    HB3  PHE  27           2HB      PHE  27   2.248  -0.784   7.580
  191    HD1  PHE  27           2HD      PHE  27   0.261  -0.341   4.365
  192    HD2  PHE  27           1HD      PHE  27   0.079  -1.483   8.557
  193    HE1  PHE  27           2HE      PHE  27  -2.121  -0.960   4.101
  194    HE2  PHE  27           1HE      PHE  27  -2.314  -2.091   8.270
  195    HZ   PHE  27           HZ       PHE  27  -3.397  -1.845   6.049
  196    H    SER  28           H        SER  28   2.089   1.291   9.163
  197    HA   SER  28           HA       SER  28  -0.615   1.648   9.990
  198    HB2  SER  28           1HB      SER  28   0.414   2.407  12.165
  199    HB3  SER  28           2HB      SER  28   1.265   0.985  11.541
  200    HG   SER  28           HG       SER  28   2.919   2.284  11.834
  201    H    GLU  29           H        GLU  29   1.880   4.072   9.155
  202    HA   GLU  29           HA       GLU  29   0.270   6.384   9.856
  203    HB2  GLU  29           1HB      GLU  29   2.776   6.048   8.067
  204    HB3  GLU  29           2HB      GLU  29   2.082   7.639   8.492
  205    HG2  GLU  29           1HG      GLU  29   2.489   7.165  10.934
  206    HG3  GLU  29           2HG      GLU  29   3.128   5.584  10.550
  207    H    PHE  30           H        PHE  30   1.001   4.673   6.798
  208    HA   PHE  30           HA       PHE  30  -0.426   6.446   5.053
  209    HB2  PHE  30           1HB      PHE  30   1.314   4.796   4.283
  210    HB3  PHE  30           2HB      PHE  30   0.261   3.465   4.736
  211    HD1  PHE  30           2HD      PHE  30   0.480   6.509   2.498
  212    HD2  PHE  30           1HD      PHE  30  -1.617   2.757   3.218
  213    HE1  PHE  30           2HE      PHE  30  -0.769   6.776   0.367
  214    HE2  PHE  30           1HE      PHE  30  -2.861   3.057   1.079
  215    HZ   PHE  30           HZ       PHE  30  -2.439   5.065  -0.346
  216    H    ALA  31           H        ALA  31  -1.344   3.375   6.666
  217    HA   ALA  31           HA       ALA  31  -3.995   3.155   5.598
  218    HB1  ALA  31           1HB      ALA  31  -4.307   1.469   7.470
  219    HB2  ALA  31           2HB      ALA  31  -2.788   2.004   8.196
  220    HB3  ALA  31           3HB      ALA  31  -2.777   1.212   6.627
  221    H    ALA  32           H        ALA  32  -2.674   4.689   8.531
  222    HA   ALA  32           HA       ALA  32  -5.114   5.325   9.885
  223    HB1  ALA  32           1HB      ALA  32  -2.428   6.830   9.851
  224    HB2  ALA  32           2HB      ALA  32  -2.897   5.583  11.001
  225    HB3  ALA  32           3HB      ALA  32  -3.733   7.138  11.010
  226    H    LYS  33           H        LYS  33  -3.335   7.008   7.316
  227    HA   LYS  33           HA       LYS  33  -5.062   9.340   7.329
  228    HB2  LYS  33           1HB      LYS  33  -2.635   9.335   6.471
  229    HB3  LYS  33           2HB      LYS  33  -3.147   8.323   5.115
  230    HG2  LYS  33           1HG      LYS  33  -4.726  10.126   4.314
  231    HG3  LYS  33           2HG      LYS  33  -4.312  11.136   5.713
  232    HD2  LYS  33           1HD      LYS  33  -1.905  11.271   4.881
  233    HD3  LYS  33           2HD      LYS  33  -2.358  10.291   3.467
  234    HE2  LYS  33           1HE      LYS  33  -3.577  13.052   4.149
  235    HE3  LYS  33           2HE      LYS  33  -2.384  12.743   2.879
  236    HZ1  LYS  33           3HZ      LYS  33  -5.165  11.720   3.053
  237    HZ2  LYS  33           1HZ      LYS  33  -4.027  11.098   1.962
  238    HZ3  LYS  33           2HZ      LYS  33  -4.496  12.726   1.858
  239    H    HIS  34           H        HIS  34  -4.905   6.365   5.328
  240    HA   HIS  34           HA       HIS  34  -7.297   7.194   3.775
  241    HB2  HIS  34           1HB      HIS  34  -5.354   4.816   3.506
  242    HB3  HIS  34           2HB      HIS  34  -6.739   5.073   2.427
  243    HD2  HIS  34           2HD      HIS  34  -6.348   7.112   0.492
  244    HE1  HIS  34           1HE      HIS  34  -2.497   8.285   1.752
  245    HE2  HIS  34           2HE      HIS  34  -4.256   8.568  -0.056
  246    H    ALA  35           H        ALA  35  -6.839   5.868   6.737
  247    HA   ALA  35           HA       ALA  35  -8.214   3.458   6.910
  248    HB1  ALA  35           1HB      ALA  35  -7.225   4.338   8.969
  249    HB2  ALA  35           2HB      ALA  35  -8.943   4.330   9.290
  250    HB3  ALA  35           3HB      ALA  35  -8.136   5.842   8.857
  251    H    LYS  36           H        LYS  36  -9.616   6.732   6.715
  252    HA   LYS  36           HA       LYS  36 -12.335   5.818   6.990
  253    HB2  LYS  36           1HB      LYS  36 -12.883   8.256   6.588
  254    HB3  LYS  36           2HB      LYS  36 -11.547   8.103   7.735
  255    HG2  LYS  36           1HG      LYS  36  -9.871   8.536   5.835
  256    HG3  LYS  36           2HG      LYS  36 -11.205   8.696   4.703
  257    HD2  LYS  36           1HD      LYS  36 -10.639  10.970   5.239
  258    HD3  LYS  36           2HD      LYS  36 -12.094  10.665   6.179
  259    HE2  LYS  36           1HE      LYS  36 -10.678  10.265   8.237
  260    HE3  LYS  36           2HE      LYS  36  -9.216  10.542   7.283
  261    HZ1  LYS  36           3HZ      LYS  36 -10.689  12.695   6.695
  262    HZ2  LYS  36           1HZ      LYS  36  -9.519  12.636   7.919
  263    HZ3  LYS  36           2HZ      LYS  36 -11.159  12.411   8.302
  264    H    ASP  37           H        ASP  37 -10.240   5.396   4.519
  265    HA   ASP  37           HA       ASP  37 -11.972   6.084   2.261
  266    HB2  ASP  37           1HB      ASP  37  -9.369   6.030   2.165
  267    HB3  ASP  37           2HB      ASP  37  -9.477   4.277   2.151
  268    H    SER  38           H        SER  38 -13.536   4.772   1.455
  269    HA   SER  38           HA       SER  38 -14.437   2.395   2.731
  270    HB2  SER  38           1HB      SER  38 -15.882   3.886   1.342
  271    HB3  SER  38           2HB      SER  38 -14.993   3.430  -0.107
  272    HG   SER  38           HG       SER  38 -16.046   1.607  -0.149
  273    H    ARG  39           H        ARG  39 -12.059   2.923   0.245
  274    HA   ARG  39           HA       ARG  39 -11.941   0.264  -0.923
  275    HB2  ARG  39           1HB      ARG  39  -9.921   2.589  -0.849
  276    HB3  ARG  39           2HB      ARG  39  -9.641   1.080  -1.754
  277    HG2  ARG  39           1HG      ARG  39 -11.743   1.518  -3.126
  278    HG3  ARG  39           2HG      ARG  39 -12.012   3.025  -2.227
  279    HD2  ARG  39           1HD      ARG  39  -9.822   3.915  -3.079
  280    HD3  ARG  39           2HD      ARG  39  -9.555   2.400  -3.973
  281    HE   ARG  39           HE       ARG  39 -12.078   3.418  -4.747
  282   HH11  ARG  39          1HH2      ARG  39  -8.731   4.269  -4.886
  283   HH12  ARG  39          2HH2      ARG  39  -8.861   5.150  -6.369
  284   HH21  ARG  39          1HH1      ARG  39 -12.268   4.565  -6.684
  285   HH22  ARG  39          2HH1      ARG  39 -10.880   5.319  -7.390
  286    H    PHE  40           H        PHE  40 -10.734   1.725   1.951
  287    HA   PHE  40           HA       PHE  40  -8.609  -0.154   2.407
  288    HB2  PHE  40           1HB      PHE  40  -8.748   2.178   3.474
  289    HB3  PHE  40           2HB      PHE  40 -10.040   1.577   4.499
  290    HD1  PHE  40           2HD      PHE  40  -6.398   1.176   3.645
  291    HD2  PHE  40           1HD      PHE  40  -9.567  -0.016   6.386
  292    HE1  PHE  40           2HE      PHE  40  -4.732   0.137   5.147
  293    HE2  PHE  40           1HE      PHE  40  -7.879  -1.051   7.863
  294    HZ   PHE  40           HZ       PHE  40  -5.466  -0.975   7.260
  295    H    LYS  41           H        LYS  41 -11.917   0.207   3.621
  296    HA   LYS  41           HA       LYS  41 -11.972  -2.177   5.240
  297    HB2  LYS  41           1HB      LYS  41 -14.300  -0.487   4.088
  298    HB3  LYS  41           2HB      LYS  41 -14.478  -1.663   5.406
  299    HG2  LYS  41           1HG      LYS  41 -12.694   0.876   5.556
  300    HG3  LYS  41           2HG      LYS  41 -14.345   0.786   6.186
  301    HD2  LYS  41           1HD      LYS  41 -13.630  -1.079   7.785
  302    HD3  LYS  41           2HD      LYS  41 -11.974  -0.943   7.193
  303    HE2  LYS  41           1HE      LYS  41 -13.477   1.368   8.556
  304    HE3  LYS  41           2HE      LYS  41 -12.270   0.340   9.342
  305    HZ1  LYS  41           3HZ      LYS  41 -11.287   2.361   8.514
  306    HZ2  LYS  41           1HZ      LYS  41 -11.835   2.027   6.947
  307    HZ3  LYS  41           2HZ      LYS  41 -10.676   1.023   7.669
  308    H    ALA  42           H        ALA  42 -12.188  -1.689   1.898
  309    HA   ALA  42           HA       ALA  42 -14.009  -3.797   1.134
  310    HB1  ALA  42           1HB      ALA  42 -13.231  -1.876  -0.383
  311    HB2  ALA  42           2HB      ALA  42 -13.017  -3.470  -1.111
  312    HB3  ALA  42           3HB      ALA  42 -11.633  -2.622  -0.426
  313    H    ILE  43           H        ILE  43 -10.532  -3.655   1.891
  314    HA   ILE  43           HA       ILE  43 -10.195  -6.527   1.214
  315    HB   ILE  43           HB       ILE  43  -8.051  -4.682   2.462
  316   HG12  ILE  43          1HG1      ILE  43  -8.886  -3.404   0.484
  317   HG13  ILE  43          2HG1      ILE  43  -7.320  -4.067   0.085
  318   HG21  ILE  43          1HG2      ILE  43  -7.849  -7.159   0.607
  319   HG22  ILE  43          2HG2      ILE  43  -7.492  -7.126   2.320
  320   HG23  ILE  43          3HG2      ILE  43  -6.474  -6.235   1.197
  321   HD11  ILE  43          3HD1      ILE  43  -8.592  -4.504  -1.846
  322   HD12  ILE  43          1HD1      ILE  43 -10.046  -4.885  -0.944
  323   HD13  ILE  43          2HD1      ILE  43  -8.720  -6.045  -1.027
  324    H    GLU  44           H        GLU  44 -10.746  -7.949   2.651
  325    HA   GLU  44           HA       GLU  44 -11.299  -7.404   5.424
  326    HB2  GLU  44           1HB      GLU  44 -11.086 -10.016   3.780
  327    HB3  GLU  44           2HB      GLU  44 -11.647  -9.972   5.468
  328    HG2  GLU  44           1HG      GLU  44 -13.563  -8.453   4.786
  329    HG3  GLU  44           2HG      GLU  44 -12.998  -8.468   3.116
  330    H    LYS  45           H        LYS  45  -8.698  -9.158   3.677
  331    HA   LYS  45           HA       LYS  45  -7.252  -9.860   6.108
  332    HB2  LYS  45           1HB      LYS  45  -6.511 -10.087   3.110
  333    HB3  LYS  45           2HB      LYS  45  -5.520 -10.748   4.434
  334    HG2  LYS  45           1HG      LYS  45  -7.465 -12.211   5.160
  335    HG3  LYS  45           2HG      LYS  45  -8.452 -11.558   3.833
  336    HD2  LYS  45           1HD      LYS  45  -6.777 -12.492   2.142
  337    HD3  LYS  45           2HD      LYS  45  -5.828 -13.174   3.483
  338    HE2  LYS  45           1HE      LYS  45  -8.751 -13.938   2.832
  339    HE3  LYS  45           2HE      LYS  45  -7.326 -14.932   2.491
  340    HZ1  LYS  45           3HZ      LYS  45  -6.849 -14.665   4.972
  341    HZ2  LYS  45           1HZ      LYS  45  -8.101 -15.713   4.522
  342    HZ3  LYS  45           2HZ      LYS  45  -8.463 -14.160   5.110
  343    H    MET  46           H        MET  46  -5.785  -8.705   7.073
  344    HA   MET  46           HA       MET  46  -4.951  -6.117   5.975
  345    HB2  MET  46           1HB      MET  46  -5.709  -6.609   8.461
  346    HB3  MET  46           2HB      MET  46  -4.105  -7.302   8.678
  347    HG2  MET  46           1HG      MET  46  -3.817  -4.985   9.333
  348    HG3  MET  46           2HG      MET  46  -3.182  -5.010   7.711
  349    HE1  MET  46           3HE      MET  46  -6.428  -4.540   9.818
  350    HE2  MET  46           1HE      MET  46  -7.024  -2.995   9.215
  351    HE3  MET  46           2HE      MET  46  -5.481  -3.069  10.031
  352    H    LYS  47           H        LYS  47  -3.705  -9.337   6.539
  353    HA   LYS  47           HA       LYS  47  -0.904  -8.846   6.515
  354    HB2  LYS  47           1HB      LYS  47  -2.541 -11.311   5.629
  355    HB3  LYS  47           2HB      LYS  47  -0.768 -11.318   5.811
  356    HG2  LYS  47           1HG      LYS  47  -1.012 -10.693   8.256
  357    HG3  LYS  47           2HG      LYS  47  -2.781 -10.681   8.078
  358    HD2  LYS  47           1HD      LYS  47  -2.737 -13.153   7.470
  359    HD3  LYS  47           2HD      LYS  47  -0.970 -13.164   7.658
  360    HE2  LYS  47           1HE      LYS  47  -2.934 -12.456   9.940
  361    HE3  LYS  47           2HE      LYS  47  -2.146 -14.029   9.737
  362    HZ1  LYS  47           3HZ      LYS  47  -0.608 -13.051  11.042
  363    HZ2  LYS  47           1HZ      LYS  47  -1.017 -11.475  10.566
  364    HZ3  LYS  47           2HZ      LYS  47  -0.042 -12.440   9.562
  365    H    ASP  48           H        ASP  48  -3.243  -9.414   3.903
  366    HA   ASP  48           HA       ASP  48  -1.332  -9.647   1.795
  367    HB2  ASP  48           1HB      ASP  48  -3.737 -10.408   1.566
  368    HB3  ASP  48           2HB      ASP  48  -4.289  -8.736   1.692
  369    H    ARG  49           H        ARG  49  -2.984  -6.909   3.290
  370    HA   ARG  49           HA       ARG  49  -2.233  -4.885   1.386
  371    HB2  ARG  49           1HB      ARG  49  -2.991  -4.691   4.367
  372    HB3  ARG  49           2HB      ARG  49  -2.729  -3.288   3.326
  373    HG2  ARG  49           1HG      ARG  49  -4.567  -4.143   1.772
  374    HG3  ARG  49           2HG      ARG  49  -4.834  -5.487   2.879
  375    HD2  ARG  49           1HD      ARG  49  -6.203  -4.186   4.221
  376    HD3  ARG  49           2HD      ARG  49  -4.999  -2.932   4.385
  377    HE   ARG  49           HE       ARG  49  -7.253  -2.904   2.590
  378   HH11  ARG  49          1HH2      ARG  49  -3.938  -1.816   2.897
  379   HH12  ARG  49          2HH2      ARG  49  -4.140  -0.479   1.828
  380   HH21  ARG  49          1HH1      ARG  49  -7.462  -1.200   1.138
  381   HH22  ARG  49          2HH1      ARG  49  -6.140  -0.128   0.838
  382    H    GLU  50           H        GLU  50  -0.761  -6.113   4.373
  383    HA   GLU  50           HA       GLU  50   1.363  -4.223   4.575
  384    HB2  GLU  50           1HB      GLU  50   0.648  -5.808   6.439
  385    HB3  GLU  50           2HB      GLU  50   1.320  -7.166   5.526
  386    HG2  GLU  50           1HG      GLU  50   3.635  -6.119   5.652
  387    HG3  GLU  50           2HG      GLU  50   2.975  -4.724   6.505
  388    H    ALA  51           H        ALA  51   1.099  -7.419   2.947
  389    HA   ALA  51           HA       ALA  51   3.778  -7.721   2.054
  390    HB1  ALA  51           1HB      ALA  51   2.802  -9.311   0.370
  391    HB2  ALA  51           2HB      ALA  51   1.180  -8.686   0.712
  392    HB3  ALA  51           3HB      ALA  51   2.063  -9.554   1.963
  393    H    LEU  52           H        LEU  52   0.935  -6.206   0.463
  394    HA   LEU  52           HA       LEU  52   2.210  -5.424  -1.960
  395    HB2  LEU  52           1HB      LEU  52  -0.280  -4.388  -0.494
  396    HB3  LEU  52           2HB      LEU  52   0.175  -3.818  -2.101
  397    HG   LEU  52           HG       LEU  52  -0.349  -6.791  -1.457
  398   HD11  LEU  52          1HD1      LEU  52  -2.468  -5.588  -1.160
  399   HD12  LEU  52          2HD1      LEU  52  -2.544  -6.492  -2.663
  400   HD13  LEU  52          3HD1      LEU  52  -2.265  -4.747  -2.709
  401   HD21  LEU  52          3HD2      LEU  52   0.981  -6.863  -3.435
  402   HD22  LEU  52          1HD2      LEU  52   0.361  -5.343  -4.060
  403   HD23  LEU  52          2HD2      LEU  52  -0.620  -6.797  -4.136
  404    H    PHE  53           H        PHE  53   1.628  -3.730   1.091
  405    HA   PHE  53           HA       PHE  53   2.597  -1.164   0.355
  406    HB2  PHE  53           1HB      PHE  53   1.296  -1.754   2.479
  407    HB3  PHE  53           2HB      PHE  53   2.730  -2.540   3.111
  408    HD1  PHE  53           1HD      PHE  53   1.281   0.766   2.083
  409    HD2  PHE  53           2HD      PHE  53   4.746  -1.183   3.861
  410    HE1  PHE  53           1HE      PHE  53   2.208   2.965   2.727
  411    HE2  PHE  53           2HE      PHE  53   5.646   1.046   4.508
  412    HZ   PHE  53           HZ       PHE  53   4.378   3.120   3.929
  413    H    ASN  54           H        ASN  54   4.252  -3.939   1.848
  414    HA   ASN  54           HA       ASN  54   6.868  -2.794   2.063
  415    HB2  ASN  54           1HB      ASN  54   5.949  -5.726   1.783
  416    HB3  ASN  54           2HB      ASN  54   7.624  -5.270   2.137
  417   HD21  ASN  54          1HD2      ASN  54   6.033  -6.834   3.955
  418   HD22  ASN  54          2HD2      ASN  54   5.784  -5.914   5.361
  419    H    GLU  55           H        GLU  55   5.264  -4.649  -0.525
  420    HA   GLU  55           HA       GLU  55   7.542  -4.832  -2.266
  421    HB2  GLU  55           1HB      GLU  55   5.480  -6.332  -2.438
  422    HB3  GLU  55           2HB      GLU  55   4.535  -4.948  -3.008
  423    HG2  GLU  55           1HG      GLU  55   6.065  -4.735  -5.041
  424    HG3  GLU  55           2HG      GLU  55   7.036  -6.086  -4.461
  425    H    PHE  56           H        PHE  56   4.799  -2.534  -1.985
  426    HA   PHE  56           HA       PHE  56   5.257  -1.036  -4.324
  427    HB2  PHE  56           1HB      PHE  56   3.153  -0.882  -2.953
  428    HB3  PHE  56           2HB      PHE  56   4.040  -0.150  -1.631
  429    HD1  PHE  56           2HD      PHE  56   3.072   0.353  -5.250
  430    HD2  PHE  56           1HD      PHE  56   4.590   2.305  -1.659
  431    HE1  PHE  56           2HE      PHE  56   2.882   2.571  -6.354
  432    HE2  PHE  56           1HE      PHE  56   4.402   4.515  -2.794
  433    HZ   PHE  56           HZ       PHE  56   3.551   4.651  -5.140
  434    H    VAL  57           H        VAL  57   6.385  -0.485  -0.949
  435    HA   VAL  57           HA       VAL  57   7.895   1.903  -1.447
  436    HB   VAL  57           HB       VAL  57   8.134  -0.270   0.754
  437   HG11  VAL  57          1HG1      VAL  57  10.334   0.841   0.774
  438   HG12  VAL  57          2HG1      VAL  57   9.424   1.628   2.053
  439   HG13  VAL  57          3HG1      VAL  57   9.625   2.439   0.494
  440   HG21  VAL  57          3HG2      VAL  57   6.870   2.565   0.864
  441   HG22  VAL  57          1HG2      VAL  57   6.878   1.375   2.169
  442   HG23  VAL  57          2HG2      VAL  57   5.950   1.073   0.707
  443    H    ALA  58           H        ALA  58   8.839  -1.568  -1.346
  444    HA   ALA  58           HA       ALA  58  11.623  -1.177  -1.824
  445    HB1  ALA  58           1HB      ALA  58  11.617  -3.646  -2.380
  446    HB2  ALA  58           2HB      ALA  58   9.845  -3.619  -2.440
  447    HB3  ALA  58           3HB      ALA  58  10.676  -3.318  -0.915
  448    H    ALA  59           H        ALA  59   8.837  -1.680  -4.022
  449    HA   ALA  59           HA       ALA  59  10.367  -1.874  -6.469
  450    HB1  ALA  59           1HB      ALA  59   8.074  -2.863  -6.242
  451    HB2  ALA  59           2HB      ALA  59   8.090  -1.679  -7.555
  452    HB3  ALA  59           3HB      ALA  59   7.384  -1.255  -5.986
  453    H    ALA  60           H        ALA  60   8.584   0.760  -4.792
  454    HA   ALA  60           HA       ALA  60   8.788   2.752  -6.830
  455    HB1  ALA  60           1HB      ALA  60   8.237   4.374  -4.935
  456    HB2  ALA  60           2HB      ALA  60   8.499   3.064  -3.768
  457    HB3  ALA  60           3HB      ALA  60   7.172   2.958  -4.924
  458    H    ARG  61           H        ARG  61  10.859   1.930  -4.037
  459    HA   ARG  61           HA       ARG  61  12.623   4.147  -4.397
  460    HB2  ARG  61           1HB      ARG  61  12.355   2.910  -2.187
  461    HB3  ARG  61           2HB      ARG  61  13.074   1.459  -2.905
  462    HG2  ARG  61           1HG      ARG  61  15.254   2.729  -3.286
  463    HG3  ARG  61           2HG      ARG  61  14.526   4.172  -2.568
  464    HD2  ARG  61           1HD      ARG  61  14.256   2.899  -0.391
  465    HD3  ARG  61           2HD      ARG  61  15.054   1.495  -1.126
  466    HE   ARG  61           HE       ARG  61  16.301   3.999  -0.252
  467   HH11  ARG  61          1HH2      ARG  61  16.632   1.263  -2.431
  468   HH12  ARG  61          2HH2      ARG  61  18.360   1.371  -2.504
  469   HH21  ARG  61          1HH1      ARG  61  18.537   4.137  -0.413
  470   HH22  ARG  61          2HH1      ARG  61  19.430   3.000  -1.362
  Start of MODEL    4
    1    H    ILE   5           H        ILE   5 -12.208 -10.854 -11.565
    2    HA   ILE   5           HA       ILE   5 -11.358  -9.680 -13.387
    3    HB   ILE   5           HB       ILE   5 -13.246  -7.471 -12.335
    4   HG12  ILE   5          1HG1      ILE   5 -13.991  -9.567 -14.505
    5   HG13  ILE   5          2HG1      ILE   5 -14.384  -9.804 -12.806
    6   HG21  ILE   5          1HG2      ILE   5 -12.040  -6.212 -14.036
    7   HG22  ILE   5          2HG2      ILE   5 -13.297  -6.917 -15.055
    8   HG23  ILE   5          3HG2      ILE   5 -11.690  -7.661 -15.015
    9   HD11  ILE   5          3HD1      ILE   5 -15.354  -7.389 -14.435
   10   HD12  ILE   5          1HD1      ILE   5 -15.822  -7.816 -12.785
   11   HD13  ILE   5          2HD1      ILE   5 -16.320  -8.839 -14.138
   12    H    MET   6           H        MET   6 -10.266  -9.356 -10.529
   13    HA   MET   6           HA       MET   6  -8.663  -8.162  -9.288
   14    HB2  MET   6           1HB      MET   6  -7.753  -7.615 -12.183
   15    HB3  MET   6           2HB      MET   6  -6.737  -7.329 -10.785
   16    HG2  MET   6           1HG      MET   6  -6.809  -9.766 -10.185
   17    HG3  MET   6           2HG      MET   6  -7.895 -10.096 -11.542
   18    HE1  MET   6           3HE      MET   6  -7.024 -10.689 -13.987
   19    HE2  MET   6           1HE      MET   6  -5.660  -9.815 -14.699
   20    HE3  MET   6           2HE      MET   6  -7.051  -8.935 -14.091
   21    H    GLN   7           H        GLN   7 -11.193  -6.710 -10.336
   22    HA   GLN   7           HA       GLN   7 -10.591  -4.028 -11.017
   23    HB2  GLN   7           1HB      GLN   7 -12.865  -5.125 -11.287
   24    HB3  GLN   7           2HB      GLN   7 -13.072  -5.100  -9.535
   25    HG2  GLN   7           1HG      GLN   7 -12.946  -2.543  -9.569
   26    HG3  GLN   7           2HG      GLN   7 -12.743  -2.581 -11.316
   27   HE21  GLN   7          1HE2      GLN   7 -14.836  -1.170 -10.085
   28   HE22  GLN   7          2HE2      GLN   7 -16.315  -1.902 -10.478
   29    H    ALA   8           H        ALA   8 -11.348  -5.534  -7.851
   30    HA   ALA   8           HA       ALA   8 -11.122  -3.203  -6.212
   31    HB1  ALA   8           1HB      ALA   8 -10.961  -4.870  -4.306
   32    HB2  ALA   8           2HB      ALA   8 -10.698  -6.178  -5.478
   33    HB3  ALA   8           3HB      ALA   8 -12.242  -5.332  -5.440
   34    H    LYS   9           H        LYS   9  -8.812  -5.761  -7.106
   35    HA   LYS   9           HA       LYS   9  -6.655  -4.750  -5.540
   36    HB2  LYS   9           1HB      LYS   9  -6.787  -7.123  -6.472
   37    HB3  LYS   9           2HB      LYS   9  -6.528  -6.479  -8.089
   38    HG2  LYS   9           1HG      LYS   9  -4.242  -5.599  -7.375
   39    HG3  LYS   9           2HG      LYS   9  -4.516  -6.197  -5.741
   40    HD2  LYS   9           1HD      LYS   9  -3.051  -7.832  -6.822
   41    HD3  LYS   9           2HD      LYS   9  -4.647  -8.589  -6.740
   42    HE2  LYS   9           1HE      LYS   9  -5.027  -8.118  -9.157
   43    HE3  LYS   9           2HE      LYS   9  -3.540  -7.185  -9.265
   44    HZ1  LYS   9           3HZ      LYS   9  -3.312  -9.460 -10.044
   45    HZ2  LYS   9           1HZ      LYS   9  -3.734 -10.023  -8.503
   46    HZ3  LYS   9           2HZ      LYS   9  -2.313  -9.124  -8.710
   47    H    GLU  10           H        GLU  10  -7.580  -4.227  -8.927
   48    HA   GLU  10           HA       GLU  10  -5.296  -2.718  -9.736
   49    HB2  GLU  10           1HB      GLU  10  -6.924  -3.747 -11.366
   50    HB3  GLU  10           2HB      GLU  10  -8.187  -2.644 -10.825
   51    HG2  GLU  10           1HG      GLU  10  -6.807  -0.665 -11.674
   52    HG3  GLU  10           2HG      GLU  10  -5.537  -1.765 -12.179
   53    H    ASP  11           H        ASP  11  -8.426  -1.911  -8.305
   54    HA   ASP  11           HA       ASP  11  -8.255   0.947  -8.449
   55    HB2  ASP  11           1HB      ASP  11 -10.406  -0.363  -7.857
   56    HB3  ASP  11           2HB      ASP  11  -9.749  -0.626  -6.257
   57    H    PHE  12           H        PHE  12  -7.177  -1.400  -6.033
   58    HA   PHE  12           HA       PHE  12  -6.337   0.435  -4.006
   59    HB2  PHE  12           1HB      PHE  12  -6.656  -2.097  -3.697
   60    HB3  PHE  12           2HB      PHE  12  -5.187  -2.359  -4.637
   61    HD1  PHE  12           2HD      PHE  12  -6.525  -0.756  -1.493
   62    HD2  PHE  12           1HD      PHE  12  -2.890  -1.969  -3.603
   63    HE1  PHE  12           2HE      PHE  12  -5.162  -0.239   0.528
   64    HE2  PHE  12           1HE      PHE  12  -1.563  -1.416  -1.549
   65    HZ   PHE  12           HZ       PHE  12  -2.692  -0.566   0.497
   66    H    LYS  13           H        LYS  13  -4.466  -1.159  -6.660
   67    HA   LYS  13           HA       LYS  13  -1.964   0.071  -6.152
   68    HB2  LYS  13           1HB      LYS  13  -3.190  -1.152  -8.681
   69    HB3  LYS  13           2HB      LYS  13  -1.500  -0.608  -8.603
   70    HG2  LYS  13           1HG      LYS  13  -1.084  -2.195  -6.647
   71    HG3  LYS  13           2HG      LYS  13  -2.764  -2.750  -6.753
   72    HD2  LYS  13           1HD      LYS  13  -2.334  -3.654  -9.056
   73    HD3  LYS  13           2HD      LYS  13  -0.673  -3.046  -9.008
   74    HE2  LYS  13           1HE      LYS  13  -0.145  -4.596  -7.088
   75    HE3  LYS  13           2HE      LYS  13  -1.801  -5.202  -7.107
   76    HZ1  LYS  13           3HZ      LYS  13  -0.940  -6.680  -8.504
   77    HZ2  LYS  13           1HZ      LYS  13   0.378  -5.697  -8.912
   78    HZ3  LYS  13           2HZ      LYS  13  -1.129  -5.442  -9.648
   79    H    LYS  14           H        LYS  14  -4.613   0.868  -8.230
   80    HA   LYS  14           HA       LYS  14  -3.482   3.014  -9.607
   81    HB2  LYS  14           1HB      LYS  14  -5.679   1.936 -10.247
   82    HB3  LYS  14           2HB      LYS  14  -6.439   2.672  -8.837
   83    HG2  LYS  14           1HG      LYS  14  -5.924   4.994  -9.746
   84    HG3  LYS  14           2HG      LYS  14  -5.101   4.272 -11.134
   85    HD2  LYS  14           1HD      LYS  14  -7.292   3.244 -11.878
   86    HD3  LYS  14           2HD      LYS  14  -8.106   3.982 -10.487
   87    HE2  LYS  14           1HE      LYS  14  -7.538   6.288 -11.371
   88    HE3  LYS  14           2HE      LYS  14  -6.690   5.565 -12.750
   89    HZ1  LYS  14           3HZ      LYS  14  -8.998   6.229 -13.171
   90    HZ2  LYS  14           1HZ      LYS  14  -9.497   5.044 -12.070
   91    HZ3  LYS  14           2HZ      LYS  14  -8.668   4.591 -13.475
   92    H    MET  15           H        MET  15  -5.191   2.834  -6.506
   93    HA   MET  15           HA       MET  15  -5.236   5.678  -6.043
   94    HB2  MET  15           1HB      MET  15  -6.768   4.026  -4.876
   95    HB3  MET  15           2HB      MET  15  -5.396   3.357  -4.021
   96    HG2  MET  15           1HG      MET  15  -6.547   4.959  -2.481
   97    HG3  MET  15           2HG      MET  15  -5.002   5.693  -2.943
   98    HE1  MET  15           3HE      MET  15  -5.737   8.184  -2.404
   99    HE2  MET  15           1HE      MET  15  -7.198   7.470  -1.719
  100    HE3  MET  15           2HE      MET  15  -7.318   8.838  -2.812
  101    H    MET  16           H        MET  16  -3.030   3.056  -5.041
  102    HA   MET  16           HA       MET  16  -1.325   4.491  -3.281
  103    HB2  MET  16           1HB      MET  16  -0.924   2.006  -5.009
  104    HB3  MET  16           2HB      MET  16   0.341   2.558  -3.925
  105    HG2  MET  16           1HG      MET  16  -2.500   1.879  -2.954
  106    HG3  MET  16           2HG      MET  16  -1.176   0.727  -2.931
  107    HE1  MET  16           3HE      MET  16   1.195   1.383  -1.813
  108    HE2  MET  16           1HE      MET  16   0.238   0.411  -0.687
  109    HE3  MET  16           2HE      MET  16   1.126   1.825  -0.125
  110    H    GLU  17           H        GLU  17  -0.981   3.955  -6.767
  111    HA   GLU  17           HA       GLU  17   1.584   5.235  -6.981
  112    HB2  GLU  17           1HB      GLU  17   1.349   4.913  -9.388
  113    HB3  GLU  17           2HB      GLU  17   0.589   3.506  -8.639
  114    HG2  GLU  17           1HG      GLU  17  -1.669   4.684  -8.960
  115    HG3  GLU  17           2HG      GLU  17  -0.870   5.933  -9.855
  116    H    GLU  18           H        GLU  18  -1.794   6.290  -7.308
  117    HA   GLU  18           HA       GLU  18  -1.239   9.025  -8.179
  118    HB2  GLU  18           1HB      GLU  18  -3.841   7.632  -7.270
  119    HB3  GLU  18           2HB      GLU  18  -3.801   9.334  -7.775
  120    HG2  GLU  18           1HG      GLU  18  -3.008   8.631 -10.071
  121    HG3  GLU  18           2HG      GLU  18  -3.009   6.959  -9.581
  122    H    ALA  19           H        ALA  19  -1.522   7.375  -5.124
  123    HA   ALA  19           HA       ALA  19  -2.151   9.798  -3.583
  124    HB1  ALA  19           1HB      ALA  19  -3.222   7.689  -2.858
  125    HB2  ALA  19           2HB      ALA  19  -2.107   8.212  -1.596
  126    HB3  ALA  19           3HB      ALA  19  -1.656   6.904  -2.692
  127    H    LYS  20           H        LYS  20   0.502   8.872  -5.171
  128    HA   LYS  20           HA       LYS  20   2.689   8.246  -3.972
  129    HB2  LYS  20           1HB      LYS  20   2.529   9.698  -6.144
  130    HB3  LYS  20           2HB      LYS  20   2.709  11.110  -5.101
  131    HG2  LYS  20           1HG      LYS  20   5.032  10.746  -5.578
  132    HG3  LYS  20           2HG      LYS  20   4.909   9.723  -4.151
  133    HD2  LYS  20           1HD      LYS  20   5.951   8.134  -5.649
  134    HD3  LYS  20           2HD      LYS  20   4.255   7.759  -6.000
  135    HE2  LYS  20           1HE      LYS  20   5.418   8.076  -8.174
  136    HE3  LYS  20           2HE      LYS  20   4.391   9.502  -7.926
  137    HZ1  LYS  20           3HZ      LYS  20   7.075   9.537  -8.329
  138    HZ2  LYS  20           1HZ      LYS  20   6.929   9.736  -6.655
  139    HZ3  LYS  20           2HZ      LYS  20   6.141  10.812  -7.703
  140    H    PHE  21           H        PHE  21   3.474   8.413  -1.948
  141    HA   PHE  21           HA       PHE  21   3.249  10.957  -0.452
  142    HB2  PHE  21           1HB      PHE  21   2.503   9.672   1.568
  143    HB3  PHE  21           2HB      PHE  21   1.374   9.459   0.222
  144    HD1  PHE  21           1HD      PHE  21   1.417   7.262  -1.199
  145    HD2  PHE  21           2HD      PHE  21   3.785   7.656   2.406
  146    HE1  PHE  21           1HE      PHE  21   1.784   4.787  -1.169
  147    HE2  PHE  21           2HE      PHE  21   4.164   5.175   2.429
  148    HZ   PHE  21           HZ       PHE  21   3.161   3.752   0.631
  149    H    ASN  22           H        ASN  22   4.583  10.708   1.631
  150    HA   ASN  22           HA       ASN  22   7.235  10.556   1.023
  151    HB2  ASN  22           1HB      ASN  22   5.909  10.129   3.745
  152    HB3  ASN  22           2HB      ASN  22   7.642  10.407   3.548
  153   HD21  ASN  22          1HD2      ASN  22   8.050  12.409   1.981
  154   HD22  ASN  22          2HD2      ASN  22   7.149  13.801   2.344
  155    HA   PRO  23           HA       PRO  23   7.694   5.960   0.503
  156    HB2  PRO  23           1HB      PRO  23  10.406   5.835  -0.067
  157    HB3  PRO  23           2HB      PRO  23   9.203   6.442  -1.242
  158    HG2  PRO  23           1HG      PRO  23  11.029   8.045   0.577
  159    HG3  PRO  23           2HG      PRO  23  10.666   8.311  -1.145
  160    HD2  PRO  23           1HD      PRO  23   9.435   9.756   0.852
  161    HD3  PRO  23           2HD      PRO  23   8.597   9.359  -0.675
  162    H    ARG  24           H        ARG  24   9.244   7.891   2.924
  163    HA   ARG  24           HA       ARG  24  10.381   5.603   4.413
  164    HB2  ARG  24           1HB      ARG  24  10.383   8.635   4.978
  165    HB3  ARG  24           2HB      ARG  24  11.241   7.443   5.986
  166    HG2  ARG  24           1HG      ARG  24  12.674   6.785   3.978
  167    HG3  ARG  24           2HG      ARG  24  11.809   7.961   2.980
  168    HD2  ARG  24           1HD      ARG  24  13.426   8.731   5.482
  169    HD3  ARG  24           2HD      ARG  24  14.043   8.851   3.812
  170    HE   ARG  24           HE       ARG  24  11.561  10.223   3.883
  171   HH11  ARG  24          1HH2      ARG  24  14.693  10.461   5.297
  172   HH12  ARG  24          2HH2      ARG  24  14.671  12.184   5.429
  173   HH21  ARG  24          1HH1      ARG  24  11.497  12.500   4.053
  174   HH22  ARG  24          2HH1      ARG  24  12.852  13.351   4.721
  175    H    ALA  25           H        ALA  25   7.374   6.970   4.165
  176    HA   ALA  25           HA       ALA  25   6.559   6.876   6.957
  177    HB1  ALA  25           1HB      ALA  25   4.232   7.070   5.994
  178    HB2  ALA  25           2HB      ALA  25   4.889   6.806   4.378
  179    HB3  ALA  25           3HB      ALA  25   5.313   8.257   5.260
  180    H    THR  26           H        THR  26   5.203   5.266   7.808
  181    HA   THR  26           HA       THR  26   5.822   2.518   6.923
  182    HB   THR  26           HB       THR  26   5.205   1.876   9.268
  183    HG1  THR  26           1HG      THR  26   3.549   3.369   9.598
  184   HG21  THR  26          3HG2      THR  26   6.966   4.409   9.376
  185   HG22  THR  26          1HG2      THR  26   7.571   2.821   8.885
  186   HG23  THR  26          2HG2      THR  26   6.989   3.082  10.539
  187    H    PHE  27           H        PHE  27   4.017   0.999   7.316
  188    HA   PHE  27           HA       PHE  27   1.722   1.543   5.769
  189    HB2  PHE  27           1HB      PHE  27   2.572  -0.766   6.001
  190    HB3  PHE  27           2HB      PHE  27   2.376  -0.709   7.754
  191    HD1  PHE  27           2HD      PHE  27   0.353  -0.268   4.547
  192    HD2  PHE  27           1HD      PHE  27   0.207  -1.492   8.731
  193    HE1  PHE  27           2HE      PHE  27  -2.029  -0.883   4.282
  194    HE2  PHE  27           1HE      PHE  27  -2.201  -2.097   8.442
  195    HZ   PHE  27           HZ       PHE  27  -3.283  -1.815   6.227
  196    H    SER  28           H        SER  28   2.179   1.395   9.313
  197    HA   SER  28           HA       SER  28  -0.525   1.703  10.156
  198    HB2  SER  28           1HB      SER  28   1.366   1.109  11.710
  199    HB3  SER  28           2HB      SER  28   2.049   2.719  11.509
  200    HG   SER  28           HG       SER  28   0.154   3.562  12.429
  201    H    GLU  29           H        GLU  29   1.926   4.159   9.337
  202    HA   GLU  29           HA       GLU  29   0.306   6.479   9.977
  203    HB2  GLU  29           1HB      GLU  29   2.861   6.121   8.272
  204    HB3  GLU  29           2HB      GLU  29   2.165   7.718   8.623
  205    HG2  GLU  29           1HG      GLU  29   3.149   5.722  10.786
  206    HG3  GLU  29           2HG      GLU  29   4.068   7.129  10.233
  207    H    PHE  30           H        PHE  30   1.082   4.783   6.951
  208    HA   PHE  30           HA       PHE  30  -0.335   6.523   5.178
  209    HB2  PHE  30           1HB      PHE  30   1.440   4.913   4.437
  210    HB3  PHE  30           2HB      PHE  30   0.406   3.553   4.902
  211    HD1  PHE  30           1HD      PHE  30   0.565   6.582   2.625
  212    HD2  PHE  30           2HD      PHE  30  -1.459   2.775   3.373
  213    HE1  PHE  30           1HE      PHE  30  -0.726   6.828   0.500
  214    HE2  PHE  30           2HE      PHE  30  -2.715   3.041   1.220
  215    HZ   PHE  30           HZ       PHE  30  -2.347   5.063  -0.203
  216    H    ALA  31           H        ALA  31  -1.245   3.432   6.768
  217    HA   ALA  31           HA       ALA  31  -3.881   3.156   5.672
  218    HB1  ALA  31           1HB      ALA  31  -2.733   1.989   8.294
  219    HB2  ALA  31           2HB      ALA  31  -2.590   1.249   6.713
  220    HB3  ALA  31           3HB      ALA  31  -4.176   1.405   7.455
  221    H    ALA  32           H        ALA  32  -2.630   4.675   8.640
  222    HA   ALA  32           HA       ALA  32  -5.088   5.257   9.989
  223    HB1  ALA  32           1HB      ALA  32  -2.886   5.545  11.132
  224    HB2  ALA  32           2HB      ALA  32  -3.736   7.090  11.153
  225    HB3  ALA  32           3HB      ALA  32  -2.424   6.806   9.995
  226    H    LYS  33           H        LYS  33  -3.333   6.973   7.447
  227    HA   LYS  33           HA       LYS  33  -5.080   9.287   7.464
  228    HB2  LYS  33           1HB      LYS  33  -2.665   9.337   6.629
  229    HB3  LYS  33           2HB      LYS  33  -3.145   8.318   5.267
  230    HG2  LYS  33           1HG      LYS  33  -4.756  10.109   4.453
  231    HG3  LYS  33           2HG      LYS  33  -4.355  11.117   5.849
  232    HD2  LYS  33           1HD      LYS  33  -1.972  11.291   5.008
  233    HD3  LYS  33           2HD      LYS  33  -2.405  10.302   3.606
  234    HE2  LYS  33           1HE      LYS  33  -4.053  12.073   2.851
  235    HE3  LYS  33           2HE      LYS  33  -3.654  13.061   4.267
  236    HZ1  LYS  33           3HZ      LYS  33  -2.456  13.361   1.999
  237    HZ2  LYS  33           1HZ      LYS  33  -1.493  12.107   2.596
  238    HZ3  LYS  33           2HZ      LYS  33  -1.639  13.546   3.477
  239    H    HIS  34           H        HIS  34  -4.861   6.336   5.415
  240    HA   HIS  34           HA       HIS  34  -7.233   7.127   3.827
  241    HB2  HIS  34           1HB      HIS  34  -5.218   4.808   3.561
  242    HB3  HIS  34           2HB      HIS  34  -6.599   5.019   2.465
  243    HD2  HIS  34           2HD      HIS  34  -6.308   7.185   0.644
  244    HE1  HIS  34           1HE      HIS  34  -2.441   8.338   1.834
  245    HE2  HIS  34           2HE      HIS  34  -4.243   8.661   0.077
  246    H    ALA  35           H        ALA  35  -6.775   5.756   6.775
  247    HA   ALA  35           HA       ALA  35  -8.110   3.318   6.918
  248    HB1  ALA  35           1HB      ALA  35  -8.096   5.671   8.901
  249    HB2  ALA  35           2HB      ALA  35  -7.159   4.185   9.003
  250    HB3  ALA  35           3HB      ALA  35  -8.890   4.141   9.296
  251    H    LYS  36           H        LYS  36  -9.553   6.579   6.690
  252    HA   LYS  36           HA       LYS  36 -12.288   5.610   6.893
  253    HB2  LYS  36           1HB      LYS  36 -11.083   8.361   6.132
  254    HB3  LYS  36           2HB      LYS  36 -12.826   8.091   6.380
  255    HG2  LYS  36           1HG      LYS  36 -12.351   7.380   8.777
  256    HG3  LYS  36           2HG      LYS  36 -10.625   7.687   8.516
  257    HD2  LYS  36           1HD      LYS  36 -11.089  10.136   8.123
  258    HD3  LYS  36           2HD      LYS  36 -12.829   9.863   8.307
  259    HE2  LYS  36           1HE      LYS  36 -11.859  10.770  10.463
  260    HE3  LYS  36           2HE      LYS  36 -12.425   9.105  10.717
  261    HZ1  LYS  36           3HZ      LYS  36 -10.011   9.879  11.400
  262    HZ2  LYS  36           1HZ      LYS  36  -9.683   9.479   9.786
  263    HZ3  LYS  36           2HZ      LYS  36 -10.324   8.307  10.832
  264    H    ASP  37           H        ASP  37  -9.993   5.714   4.405
  265    HA   ASP  37           HA       ASP  37 -11.713   6.379   2.196
  266    HB2  ASP  37           1HB      ASP  37  -9.099   6.368   2.176
  267    HB3  ASP  37           2HB      ASP  37  -9.185   4.628   2.035
  268    H    SER  38           H        SER  38 -13.112   5.037   1.120
  269    HA   SER  38           HA       SER  38 -14.098   2.580   2.219
  270    HB2  SER  38           1HB      SER  38 -14.502   3.923  -0.509
  271    HB3  SER  38           2HB      SER  38 -15.419   2.500   0.007
  272    HG   SER  38           HG       SER  38 -16.082   3.723   1.824
  273    H    ARG  39           H        ARG  39 -11.749   3.315  -0.305
  274    HA   ARG  39           HA       ARG  39 -11.427   0.746  -1.537
  275    HB2  ARG  39           1HB      ARG  39  -9.555   3.172  -1.371
  276    HB3  ARG  39           2HB      ARG  39  -9.160   1.719  -2.320
  277    HG2  ARG  39           1HG      ARG  39 -11.255   2.060  -3.735
  278    HG3  ARG  39           2HG      ARG  39 -11.669   3.495  -2.776
  279    HD2  ARG  39           1HD      ARG  39  -9.063   3.252  -4.371
  280    HD3  ARG  39           2HD      ARG  39 -10.506   4.061  -5.008
  281    HE   ARG  39           HE       ARG  39  -8.679   5.062  -2.945
  282   HH11  ARG  39          1HH2      ARG  39 -11.956   5.258  -4.166
  283   HH12  ARG  39          2HH2      ARG  39 -12.218   6.870  -3.585
  284   HH21  ARG  39          1HH1      ARG  39  -9.090   7.161  -2.145
  285   HH22  ARG  39          2HH1      ARG  39 -10.605   7.938  -2.449
  286    H    PHE  40           H        PHE  40 -10.207   2.145   1.371
  287    HA   PHE  40           HA       PHE  40  -8.021   0.306   1.742
  288    HB2  PHE  40           1HB      PHE  40  -8.093   2.525   2.921
  289    HB3  PHE  40           2HB      PHE  40  -9.532   2.027   3.803
  290    HD1  PHE  40           1HD      PHE  40  -5.917   1.133   3.192
  291    HD2  PHE  40           2HD      PHE  40  -9.335   0.655   5.886
  292    HE1  PHE  40           1HE      PHE  40  -4.486  -0.048   4.836
  293    HE2  PHE  40           2HE      PHE  40  -7.867  -0.511   7.521
  294    HZ   PHE  40           HZ       PHE  40  -5.463  -0.866   6.997
  295    H    LYS  41           H        LYS  41 -11.364   0.495   2.957
  296    HA   LYS  41           HA       LYS  41 -11.421  -1.922   4.500
  297    HB2  LYS  41           1HB      LYS  41 -13.747  -0.257   3.331
  298    HB3  LYS  41           2HB      LYS  41 -13.959  -1.507   4.581
  299    HG2  LYS  41           1HG      LYS  41 -12.250   1.063   4.961
  300    HG3  LYS  41           2HG      LYS  41 -13.916   0.890   5.527
  301    HD2  LYS  41           1HD      LYS  41 -13.230  -0.994   7.065
  302    HD3  LYS  41           2HD      LYS  41 -11.567  -0.878   6.513
  303    HE2  LYS  41           1HE      LYS  41 -11.369   1.408   7.476
  304    HE3  LYS  41           2HE      LYS  41 -13.051   1.365   8.001
  305    HZ1  LYS  41           3HZ      LYS  41 -10.721  -0.054   9.027
  306    HZ2  LYS  41           1HZ      LYS  41 -12.203  -0.869   9.052
  307    HZ3  LYS  41           2HZ      LYS  41 -12.043   0.613   9.864
  308    H    ALA  42           H        ALA  42 -11.435  -1.454   1.191
  309    HA   ALA  42           HA       ALA  42 -13.202  -3.538   0.260
  310    HB1  ALA  42           1HB      ALA  42 -10.634  -2.443  -1.062
  311    HB2  ALA  42           2HB      ALA  42 -12.183  -1.622  -1.158
  312    HB3  ALA  42           3HB      ALA  42 -11.994  -3.217  -1.885
  313    H    ILE  43           H        ILE  43  -9.822  -3.444   1.388
  314    HA   ILE  43           HA       ILE  43  -9.373  -6.276   0.712
  315    HB   ILE  43           HB       ILE  43  -7.503  -4.462   2.392
  316   HG12  ILE  43          1HG1      ILE  43  -7.932  -3.215   0.270
  317   HG13  ILE  43          2HG1      ILE  43  -6.311  -3.881   0.192
  318   HG21  ILE  43          1HG2      ILE  43  -5.677  -6.057   1.502
  319   HG22  ILE  43          2HG2      ILE  43  -6.928  -7.012   0.716
  320   HG23  ILE  43          3HG2      ILE  43  -6.899  -6.899   2.471
  321   HD11  ILE  43          3HD1      ILE  43  -7.159  -4.304  -1.984
  322   HD12  ILE  43          1HD1      ILE  43  -8.783  -4.672  -1.378
  323   HD13  ILE  43          2HD1      ILE  43  -7.485  -5.850  -1.185
  324    H    GLU  44           H        GLU  44  -9.958  -7.854   2.016
  325    HA   GLU  44           HA       GLU  44 -11.040  -7.381   4.694
  326    HB2  GLU  44           1HB      GLU  44 -10.785  -9.871   2.876
  327    HB3  GLU  44           2HB      GLU  44 -11.577  -9.908   4.466
  328    HG2  GLU  44           1HG      GLU  44 -13.270  -8.187   3.654
  329    HG3  GLU  44           2HG      GLU  44 -12.476  -8.136   2.082
  330    H    LYS  45           H        LYS  45  -8.367  -9.237   3.163
  331    HA   LYS  45           HA       LYS  45  -7.317 -10.251   5.672
  332    HB2  LYS  45           1HB      LYS  45  -6.182 -10.220   2.809
  333    HB3  LYS  45           2HB      LYS  45  -5.402 -11.062   4.168
  334    HG2  LYS  45           1HG      LYS  45  -7.495 -12.487   4.457
  335    HG3  LYS  45           2HG      LYS  45  -8.247 -11.649   3.087
  336    HD2  LYS  45           1HD      LYS  45  -6.426 -12.518   1.554
  337    HD3  LYS  45           2HD      LYS  45  -5.662 -13.344   2.921
  338    HE2  LYS  45           1HE      LYS  45  -7.717 -14.791   3.199
  339    HE3  LYS  45           2HE      LYS  45  -8.486 -13.962   1.836
  340    HZ1  LYS  45           3HZ      LYS  45  -7.212 -16.123   1.433
  341    HZ2  LYS  45           1HZ      LYS  45  -5.829 -15.155   1.558
  342    HZ3  LYS  45           2HZ      LYS  45  -6.986 -14.821   0.366
  343    H    MET  46           H        MET  46  -6.347  -9.008   7.016
  344    HA   MET  46           HA       MET  46  -5.287  -6.461   6.452
  345    HB2  MET  46           1HB      MET  46  -6.133  -7.119   8.713
  346    HB3  MET  46           2HB      MET  46  -4.812  -8.286   8.878
  347    HG2  MET  46           1HG      MET  46  -3.116  -6.432   8.797
  348    HG3  MET  46           2HG      MET  46  -4.394  -5.246   8.506
  349    HE1  MET  46           3HE      MET  46  -3.126  -4.306  12.042
  350    HE2  MET  46           1HE      MET  46  -3.511  -3.734  10.412
  351    HE3  MET  46           2HE      MET  46  -2.187  -4.874  10.667
  352    H    LYS  47           H        LYS  47  -3.820  -9.658   6.716
  353    HA   LYS  47           HA       LYS  47  -1.059  -9.016   6.746
  354    HB2  LYS  47           1HB      LYS  47  -2.552 -11.476   5.638
  355    HB3  LYS  47           2HB      LYS  47  -0.788 -11.418   5.851
  356    HG2  LYS  47           1HG      LYS  47  -1.110 -11.004   8.339
  357    HG3  LYS  47           2HG      LYS  47  -2.869 -11.083   8.122
  358    HD2  LYS  47           1HD      LYS  47  -2.653 -13.506   7.325
  359    HD3  LYS  47           2HD      LYS  47  -0.904 -13.417   7.582
  360    HE2  LYS  47           1HE      LYS  47  -3.019 -13.092   9.814
  361    HE3  LYS  47           2HE      LYS  47  -2.005 -14.531   9.568
  362    HZ1  LYS  47           3HZ      LYS  47  -1.207 -11.816  10.416
  363    HZ2  LYS  47           1HZ      LYS  47  -0.086 -12.844   9.674
  364    HZ3  LYS  47           2HZ      LYS  47  -0.828 -13.313  11.129
  365    H    ASP  48           H        ASP  48  -3.341  -9.430   4.088
  366    HA   ASP  48           HA       ASP  48  -1.438  -9.446   1.970
  367    HB2  ASP  48           1HB      ASP  48  -3.836 -10.220   1.650
  368    HB3  ASP  48           2HB      ASP  48  -4.408  -8.577   1.936
  369    H    ARG  49           H        ARG  49  -3.059  -6.851   3.768
  370    HA   ARG  49           HA       ARG  49  -2.534  -4.676   1.994
  371    HB2  ARG  49           1HB      ARG  49  -2.668  -4.666   5.065
  372    HB3  ARG  49           2HB      ARG  49  -2.812  -3.247   4.043
  373    HG2  ARG  49           1HG      ARG  49  -4.913  -4.165   3.001
  374    HG3  ARG  49           2HG      ARG  49  -4.783  -5.600   4.017
  375    HD2  ARG  49           1HD      ARG  49  -4.896  -4.039   6.071
  376    HD3  ARG  49           2HD      ARG  49  -5.279  -2.744   4.934
  377    HE   ARG  49           HE       ARG  49  -7.081  -4.819   4.384
  378   HH11  ARG  49          1HH2      ARG  49  -6.257  -2.757   7.031
  379   HH12  ARG  49          2HH2      ARG  49  -7.853  -2.741   7.700
  380   HH21  ARG  49          1HH1      ARG  49  -9.138  -4.838   5.289
  381   HH22  ARG  49          2HH1      ARG  49  -9.483  -3.918   6.703
  382    H    GLU  50           H        GLU  50  -0.684  -6.073   4.680
  383    HA   GLU  50           HA       GLU  50   1.473  -4.202   4.665
  384    HB2  GLU  50           1HB      GLU  50   1.011  -5.823   6.572
  385    HB3  GLU  50           2HB      GLU  50   1.588  -7.146   5.553
  386    HG2  GLU  50           1HG      GLU  50   3.888  -6.041   5.404
  387    HG3  GLU  50           2HG      GLU  50   3.324  -4.697   6.385
  388    H    ALA  51           H        ALA  51   0.990  -7.390   3.002
  389    HA   ALA  51           HA       ALA  51   3.534  -7.773   1.876
  390    HB1  ALA  51           1HB      ALA  51   0.785  -8.539   0.673
  391    HB2  ALA  51           2HB      ALA  51   1.692  -9.510   1.825
  392    HB3  ALA  51           3HB      ALA  51   2.331  -9.258   0.192
  393    H    LEU  52           H        LEU  52   0.679  -6.084   0.491
  394    HA   LEU  52           HA       LEU  52   1.897  -5.234  -1.926
  395    HB2  LEU  52           1HB      LEU  52  -0.653  -4.541  -0.477
  396    HB3  LEU  52           2HB      LEU  52  -0.129  -3.469  -1.787
  397    HG   LEU  52           HG       LEU  52  -1.723  -5.282  -2.616
  398   HD11  LEU  52          1HD1      LEU  52   0.321  -4.287  -4.121
  399   HD12  LEU  52          2HD1      LEU  52  -0.668  -5.609  -4.732
  400   HD13  LEU  52          3HD1      LEU  52   0.921  -5.962  -4.055
  401   HD21  LEU  52          3HD2      LEU  52  -0.843  -7.123  -0.961
  402   HD22  LEU  52          1HD2      LEU  52   0.476  -7.404  -2.098
  403   HD23  LEU  52          2HD2      LEU  52  -1.204  -7.676  -2.581
  404    H    PHE  53           H        PHE  53   1.444  -3.646   1.156
  405    HA   PHE  53           HA       PHE  53   2.377  -1.082   0.451
  406    HB2  PHE  53           1HB      PHE  53   1.196  -1.710   2.600
  407    HB3  PHE  53           2HB      PHE  53   2.639  -2.573   3.121
  408    HD1  PHE  53           1HD      PHE  53   1.286   0.825   2.250
  409    HD2  PHE  53           2HD      PHE  53   4.708  -1.329   3.915
  410    HE1  PHE  53           1HE      PHE  53   2.325   2.975   2.932
  411    HE2  PHE  53           2HE      PHE  53   5.714   0.856   4.611
  412    HZ   PHE  53           HZ       PHE  53   4.522   2.992   4.104
  413    H    ASN  54           H        ASN  54   4.118  -3.892   1.792
  414    HA   ASN  54           HA       ASN  54   6.736  -2.742   1.879
  415    HB2  ASN  54           1HB      ASN  54   5.828  -5.682   1.699
  416    HB3  ASN  54           2HB      ASN  54   7.524  -5.226   1.922
  417   HD21  ASN  54          1HD2      ASN  54   6.347  -6.756   3.888
  418   HD22  ASN  54          2HD2      ASN  54   6.073  -5.838   5.285
  419    H    GLU  55           H        GLU  55   5.004  -4.603  -0.592
  420    HA   GLU  55           HA       GLU  55   7.171  -4.842  -2.427
  421    HB2  GLU  55           1HB      GLU  55   4.966  -6.237  -2.478
  422    HB3  GLU  55           2HB      GLU  55   4.182  -4.831  -3.209
  423    HG2  GLU  55           1HG      GLU  55   4.896  -6.368  -5.064
  424    HG3  GLU  55           2HG      GLU  55   5.901  -4.924  -5.151
  425    H    PHE  56           H        PHE  56   4.492  -2.513  -2.115
  426    HA   PHE  56           HA       PHE  56   4.894  -1.032  -4.456
  427    HB2  PHE  56           1HB      PHE  56   2.828  -0.868  -3.066
  428    HB3  PHE  56           2HB      PHE  56   3.749  -0.163  -1.728
  429    HD1  PHE  56           2HD      PHE  56   2.784   0.401  -5.359
  430    HD2  PHE  56           1HD      PHE  56   4.260   2.319  -1.713
  431    HE1  PHE  56           2HE      PHE  56   2.614   2.647  -6.448
  432    HE2  PHE  56           1HE      PHE  56   4.095   4.552  -2.839
  433    HZ   PHE  56           HZ       PHE  56   3.281   4.705  -5.185
  434    H    VAL  57           H        VAL  57   6.102  -0.473  -1.121
  435    HA   VAL  57           HA       VAL  57   7.589   1.923  -1.623
  436    HB   VAL  57           HB       VAL  57   7.873  -0.229   0.568
  437   HG11  VAL  57          1HG1      VAL  57   9.378   2.481   0.303
  438   HG12  VAL  57          2HG1      VAL  57  10.096   0.885   0.569
  439   HG13  VAL  57          3HG1      VAL  57   9.201   1.671   1.870
  440   HG21  VAL  57          3HG2      VAL  57   5.661   1.113   0.540
  441   HG22  VAL  57          1HG2      VAL  57   6.594   2.598   0.726
  442   HG23  VAL  57          2HG2      VAL  57   6.597   1.393   2.004
  443    H    ALA  58           H        ALA  58   8.564  -1.545  -1.534
  444    HA   ALA  58           HA       ALA  58  11.334  -1.145  -2.035
  445    HB1  ALA  58           1HB      ALA  58  10.405  -3.286  -1.093
  446    HB2  ALA  58           2HB      ALA  58  11.342  -3.629  -2.556
  447    HB3  ALA  58           3HB      ALA  58   9.571  -3.614  -2.615
  448    H    ALA  59           H        ALA  59   8.532  -1.702  -4.208
  449    HA   ALA  59           HA       ALA  59  10.020  -1.896  -6.674
  450    HB1  ALA  59           1HB      ALA  59   7.033  -1.318  -6.142
  451    HB2  ALA  59           2HB      ALA  59   7.732  -2.915  -6.404
  452    HB3  ALA  59           3HB      ALA  59   7.708  -1.740  -7.728
  453    H    ALA  60           H        ALA  60   8.213   0.731  -5.011
  454    HA   ALA  60           HA       ALA  60   8.379   2.724  -7.054
  455    HB1  ALA  60           1HB      ALA  60   8.053   3.036  -3.993
  456    HB2  ALA  60           2HB      ALA  60   6.739   2.915  -5.163
  457    HB3  ALA  60           3HB      ALA  60   7.777   4.345  -5.162
  458    H    ARG  61           H        ARG  61  10.428   1.952  -4.237
  459    HA   ARG  61           HA       ARG  61  12.167   4.194  -4.583
  460    HB2  ARG  61           1HB      ARG  61  11.942   3.014  -2.376
  461    HB3  ARG  61           2HB      ARG  61  12.664   1.552  -3.062
  462    HG2  ARG  61           1HG      ARG  61  14.867   2.803  -3.455
  463    HG3  ARG  61           2HG      ARG  61  14.138   4.285  -2.821
  464    HD2  ARG  61           1HD      ARG  61  14.499   1.694  -1.199
  465    HD3  ARG  61           2HD      ARG  61  15.594   3.106  -1.113
  466    HE   ARG  61           HE       ARG  61  12.945   4.034  -0.692
  467   HH11  ARG  61          1HH2      ARG  61  15.282   2.000   0.805
  468   HH12  ARG  61          2HH2      ARG  61  14.754   2.326   2.419
  469   HH21  ARG  61          1HH1      ARG  61  12.215   4.478   1.411
  470   HH22  ARG  61          2HH1      ARG  61  13.002   3.741   2.767
  Start of MODEL    5
    1    H    ILE   5           H        ILE   5 -13.397 -10.378 -11.278
    2    HA   ILE   5           HA       ILE   5 -11.820  -9.858 -12.869
    3    HB   ILE   5           HB       ILE   5 -13.271  -7.115 -12.941
    4   HG12  ILE   5          1HG1      ILE   5 -13.744  -9.467 -14.876
    5   HG13  ILE   5          2HG1      ILE   5 -14.689  -9.273 -13.413
    6   HG21  ILE   5          1HG2      ILE   5 -11.055  -8.247 -14.734
    7   HG22  ILE   5          2HG2      ILE   5 -11.327  -6.576 -14.257
    8   HG23  ILE   5          3HG2      ILE   5 -12.310  -7.290 -15.513
    9   HD11  ILE   5          3HD1      ILE   5 -15.809  -8.298 -15.448
   10   HD12  ILE   5          1HD1      ILE   5 -14.515  -7.104 -15.560
   11   HD13  ILE   5          2HD1      ILE   5 -15.581  -7.133 -14.149
   12    H    MET   6           H        MET   6 -11.129  -9.599 -10.061
   13    HA   MET   6           HA       MET   6  -9.646  -8.555  -8.524
   14    HB2  MET   6           1HB      MET   6  -8.117  -8.452 -11.210
   15    HB3  MET   6           2HB      MET   6  -7.323  -8.279  -9.632
   16    HG2  MET   6           1HG      MET   6  -8.899 -10.805 -10.509
   17    HG3  MET   6           2HG      MET   6  -7.138 -10.662 -10.555
   18    HE1  MET   6           3HE      MET   6  -8.780 -12.966  -8.985
   19    HE2  MET   6           1HE      MET   6  -7.783 -13.098  -7.529
   20    HE3  MET   6           2HE      MET   6  -7.022 -12.890  -9.100
   21    H    GLN   7           H        GLN   7 -11.625  -6.682  -9.653
   22    HA   GLN   7           HA       GLN   7 -10.561  -4.162 -10.465
   23    HB2  GLN   7           1HB      GLN   7 -13.190  -5.017  -9.120
   24    HB3  GLN   7           2HB      GLN   7 -12.889  -3.291  -9.398
   25    HG2  GLN   7           1HG      GLN   7 -12.724  -5.357 -11.644
   26    HG3  GLN   7           2HG      GLN   7 -14.213  -4.517 -11.278
   27   HE21  GLN   7          1HE2      GLN   7 -11.546  -4.370 -13.360
   28   HE22  GLN   7          2HE2      GLN   7 -11.560  -2.703 -13.688
   29    H    ALA   8           H        ALA   8 -11.175  -5.493  -7.259
   30    HA   ALA   8           HA       ALA   8 -10.725  -3.181  -5.677
   31    HB1  ALA   8           1HB      ALA   8 -10.314  -4.820  -3.827
   32    HB2  ALA   8           2HB      ALA   8 -10.084  -6.119  -5.003
   33    HB3  ALA   8           3HB      ALA   8 -11.670  -5.372  -4.812
   34    H    LYS   9           H        LYS   9  -8.418  -5.764  -6.784
   35    HA   LYS   9           HA       LYS   9  -6.097  -4.629  -5.563
   36    HB2  LYS   9           1HB      LYS   9  -6.289  -7.076  -6.304
   37    HB3  LYS   9           2HB      LYS   9  -6.246  -6.550  -8.001
   38    HG2  LYS   9           1HG      LYS   9  -3.923  -5.558  -7.651
   39    HG3  LYS   9           2HG      LYS   9  -3.968  -6.053  -5.943
   40    HD2  LYS   9           1HD      LYS   9  -4.093  -8.493  -6.672
   41    HD3  LYS   9           2HD      LYS   9  -4.032  -7.982  -8.370
   42    HE2  LYS   9           1HE      LYS   9  -1.745  -6.975  -8.002
   43    HE3  LYS   9           2HE      LYS   9  -1.802  -7.461  -6.291
   44    HZ1  LYS   9           3HZ      LYS   9  -2.025  -9.346  -8.583
   45    HZ2  LYS   9           1HZ      LYS   9  -1.921  -9.750  -6.938
   46    HZ3  LYS   9           2HZ      LYS   9  -0.593  -9.034  -7.722
   47    H    GLU  10           H        GLU  10  -7.452  -4.309  -8.884
   48    HA   GLU  10           HA       GLU  10  -5.324  -2.802 -10.042
   49    HB2  GLU  10           1HB      GLU  10  -8.305  -2.972 -10.758
   50    HB3  GLU  10           2HB      GLU  10  -7.142  -2.087 -11.762
   51    HG2  GLU  10           1HG      GLU  10  -5.853  -4.194 -12.197
   52    HG3  GLU  10           2HG      GLU  10  -6.889  -5.104 -11.110
   53    H    ASP  11           H        ASP  11  -8.210  -1.880  -8.254
   54    HA   ASP  11           HA       ASP  11  -7.944   1.024  -8.482
   55    HB2  ASP  11           1HB      ASP  11  -9.488  -0.724  -6.449
   56    HB3  ASP  11           2HB      ASP  11  -9.663   1.031  -6.588
   57    H    PHE  12           H        PHE  12  -6.603  -1.467  -6.340
   58    HA   PHE  12           HA       PHE  12  -5.700   0.239  -4.193
   59    HB2  PHE  12           1HB      PHE  12  -5.891  -2.406  -4.255
   60    HB3  PHE  12           2HB      PHE  12  -4.308  -2.386  -5.028
   61    HD1  PHE  12           1HD      PHE  12  -6.181  -1.403  -1.936
   62    HD2  PHE  12           2HD      PHE  12  -2.224  -1.794  -3.699
   63    HE1  PHE  12           1HE      PHE  12  -5.133  -0.930   0.216
   64    HE2  PHE  12           2HE      PHE  12  -1.216  -1.323  -1.462
   65    HZ   PHE  12           HZ       PHE  12  -2.674  -0.878   0.505
   66    H    LYS  13           H        LYS  13  -3.837  -1.137  -6.982
   67    HA   LYS  13           HA       LYS  13  -1.351   0.139  -6.450
   68    HB2  LYS  13           1HB      LYS  13  -0.780  -0.491  -8.889
   69    HB3  LYS  13           2HB      LYS  13  -1.415  -1.836  -7.916
   70    HG2  LYS  13           1HG      LYS  13  -3.701  -1.469  -8.918
   71    HG3  LYS  13           2HG      LYS  13  -3.075  -0.153  -9.881
   72    HD2  LYS  13           1HD      LYS  13  -3.219  -2.146 -11.334
   73    HD3  LYS  13           2HD      LYS  13  -1.512  -1.765 -11.097
   74    HE2  LYS  13           1HE      LYS  13  -2.862  -3.835  -9.272
   75    HE3  LYS  13           2HE      LYS  13  -2.303  -4.298 -10.878
   76    HZ1  LYS  13           3HZ      LYS  13  -0.221  -4.312 -10.192
   77    HZ2  LYS  13           1HZ      LYS  13  -0.778  -4.095  -8.608
   78    HZ3  LYS  13           2HZ      LYS  13  -0.337  -2.747  -9.544
   79    H    LYS  14           H        LYS  14  -4.139   1.101  -8.449
   80    HA   LYS  14           HA       LYS  14  -3.102   3.442  -9.684
   81    HB2  LYS  14           1HB      LYS  14  -5.974   2.647  -8.949
   82    HB3  LYS  14           2HB      LYS  14  -5.613   4.139  -9.850
   83    HG2  LYS  14           1HG      LYS  14  -4.539   2.800 -11.693
   84    HG3  LYS  14           2HG      LYS  14  -4.830   1.308 -10.815
   85    HD2  LYS  14           1HD      LYS  14  -7.344   1.682 -10.965
   86    HD3  LYS  14           2HD      LYS  14  -7.050   3.195 -11.846
   87    HE2  LYS  14           1HE      LYS  14  -5.942   1.893 -13.713
   88    HE3  LYS  14           2HE      LYS  14  -6.245   0.378 -12.828
   89    HZ1  LYS  14           3HZ      LYS  14  -8.285   0.344 -13.650
   90    HZ2  LYS  14           1HZ      LYS  14  -7.982   1.768 -14.522
   91    HZ3  LYS  14           2HZ      LYS  14  -8.637   1.856 -12.957
   92    H    MET  15           H        MET  15  -4.810   2.963  -6.601
   93    HA   MET  15           HA       MET  15  -4.847   5.741  -5.892
   94    HB2  MET  15           1HB      MET  15  -6.292   3.819  -4.860
   95    HB3  MET  15           2HB      MET  15  -4.867   3.334  -3.945
   96    HG2  MET  15           1HG      MET  15  -6.222   4.808  -2.471
   97    HG3  MET  15           2HG      MET  15  -4.799   5.738  -2.941
   98    HE1  MET  15           3HE      MET  15  -7.639   8.463  -2.859
   99    HE2  MET  15           1HE      MET  15  -6.035   7.993  -2.273
  100    HE3  MET  15           2HE      MET  15  -7.464   7.076  -1.802
  101    H    MET  16           H        MET  16  -2.616   3.058  -5.038
  102    HA   MET  16           HA       MET  16  -0.880   4.463  -3.258
  103    HB2  MET  16           1HB      MET  16  -0.516   1.988  -5.048
  104    HB3  MET  16           2HB      MET  16   0.750   2.495  -3.934
  105    HG2  MET  16           1HG      MET  16  -2.108   1.790  -3.030
  106    HG3  MET  16           2HG      MET  16  -0.765   0.660  -2.990
  107    HE1  MET  16           3HE      MET  16   0.587   0.412  -0.608
  108    HE2  MET  16           1HE      MET  16   1.503   1.857  -0.216
  109    HE3  MET  16           2HE      MET  16   1.493   1.253  -1.838
  110    H    GLU  17           H        GLU  17  -0.541   3.946  -6.799
  111    HA   GLU  17           HA       GLU  17   2.024   5.255  -7.014
  112    HB2  GLU  17           1HB      GLU  17   1.805   4.936  -9.436
  113    HB3  GLU  17           2HB      GLU  17   1.148   3.487  -8.646
  114    HG2  GLU  17           1HG      GLU  17  -1.173   4.567  -8.920
  115    HG3  GLU  17           2HG      GLU  17  -0.457   5.800  -9.911
  116    H    GLU  18           H        GLU  18  -1.354   6.232  -7.569
  117    HA   GLU  18           HA       GLU  18  -0.809   8.896  -8.495
  118    HB2  GLU  18           1HB      GLU  18  -2.949   7.549  -9.011
  119    HB3  GLU  18           2HB      GLU  18  -3.448   7.740  -7.315
  120    HG2  GLU  18           1HG      GLU  18  -3.483  10.259  -7.613
  121    HG3  GLU  18           2HG      GLU  18  -2.943  10.054  -9.283
  122    H    ALA  19           H        ALA  19  -1.621   7.483  -5.272
  123    HA   ALA  19           HA       ALA  19  -1.944  10.058  -3.967
  124    HB1  ALA  19           1HB      ALA  19  -3.179   8.018  -3.158
  125    HB2  ALA  19           2HB      ALA  19  -2.197   8.704  -1.862
  126    HB3  ALA  19           3HB      ALA  19  -1.651   7.246  -2.710
  127    H    LYS  20           H        LYS  20   0.719   9.014  -5.374
  128    HA   LYS  20           HA       LYS  20   2.833   8.274  -4.104
  129    HB2  LYS  20           1HB      LYS  20   2.833   9.634  -6.340
  130    HB3  LYS  20           2HB      LYS  20   2.996  11.089  -5.363
  131    HG2  LYS  20           1HG      LYS  20   5.289  10.627  -5.909
  132    HG3  LYS  20           2HG      LYS  20   5.163   9.857  -4.323
  133    HD2  LYS  20           1HD      LYS  20   4.701   7.600  -5.569
  134    HD3  LYS  20           2HD      LYS  20   5.061   8.448  -7.081
  135    HE2  LYS  20           1HE      LYS  20   7.030   8.079  -4.726
  136    HE3  LYS  20           2HE      LYS  20   7.121   7.268  -6.297
  137    HZ1  LYS  20           3HZ      LYS  20   8.448   8.986  -6.760
  138    HZ2  LYS  20           1HZ      LYS  20   7.788   9.984  -5.562
  139    HZ3  LYS  20           2HZ      LYS  20   6.992   9.808  -7.051
  140    H    PHE  21           H        PHE  21   3.573   8.403  -2.097
  141    HA   PHE  21           HA       PHE  21   3.370  10.931  -0.543
  142    HB2  PHE  21           1HB      PHE  21   2.561   9.583   1.419
  143    HB3  PHE  21           2HB      PHE  21   1.445   9.433   0.060
  144    HD1  PHE  21           1HD      PHE  21   1.454   7.262  -1.398
  145    HD2  PHE  21           2HD      PHE  21   3.807   7.565   2.226
  146    HE1  PHE  21           1HE      PHE  21   1.780   4.788  -1.394
  147    HE2  PHE  21           2HE      PHE  21   4.133   5.100   2.217
  148    HZ   PHE  21           HZ       PHE  21   3.135   3.703   0.407
  149    H    ASN  22           H        ASN  22   4.720  10.593   1.563
  150    HA   ASN  22           HA       ASN  22   7.389  10.374   0.997
  151    HB2  ASN  22           1HB      ASN  22   5.924   9.919   3.616
  152    HB3  ASN  22           2HB      ASN  22   7.676  10.098   3.543
  153   HD21  ASN  22          1HD2      ASN  22   8.286  12.153   2.085
  154   HD22  ASN  22          2HD2      ASN  22   7.431  13.572   2.449
  155    HA   PRO  23           HA       PRO  23   7.710   5.729   0.329
  156    HB2  PRO  23           1HB      PRO  23  10.404   5.539  -0.242
  157    HB3  PRO  23           2HB      PRO  23   9.234   6.204  -1.417
  158    HG2  PRO  23           1HG      PRO  23  11.101   7.686   0.463
  159    HG3  PRO  23           2HG      PRO  23  10.763   7.990  -1.269
  160    HD2  PRO  23           1HD      PRO  23   9.552   9.471   0.711
  161    HD3  PRO  23           2HD      PRO  23   8.691   9.096  -0.820
  162    H    ARG  24           H        ARG  24   9.318   7.588   2.804
  163    HA   ARG  24           HA       ARG  24  10.381   5.249   4.285
  164    HB2  ARG  24           1HB      ARG  24  10.436   8.292   4.889
  165    HB3  ARG  24           2HB      ARG  24  11.247   7.068   5.909
  166    HG2  ARG  24           1HG      ARG  24  12.709   6.392   3.951
  167    HG3  ARG  24           2HG      ARG  24  11.892   7.571   2.918
  168    HD2  ARG  24           1HD      ARG  24  12.732   9.450   4.416
  169    HD3  ARG  24           2HD      ARG  24  13.579   8.238   5.401
  170    HE   ARG  24           HE       ARG  24  15.204   8.059   3.751
  171   HH11  ARG  24          1HH2      ARG  24  12.396   9.635   2.326
  172   HH12  ARG  24          2HH2      ARG  24  13.221  10.041   0.858
  173   HH21  ARG  24          1HH1      ARG  24  16.222   8.588   1.807
  174   HH22  ARG  24          2HH1      ARG  24  15.374   9.451   0.569
  175    H    ALA  25           H        ALA  25   7.391   6.743   4.032
  176    HA   ALA  25           HA       ALA  25   6.561   6.640   6.823
  177    HB1  ALA  25           1HB      ALA  25   4.229   6.871   5.858
  178    HB2  ALA  25           2HB      ALA  25   4.889   6.626   4.237
  179    HB3  ALA  25           3HB      ALA  25   5.325   8.057   5.152
  180    H    THR  26           H        THR  26   5.057   5.066   7.646
  181    HA   THR  26           HA       THR  26   5.657   2.301   6.725
  182    HB   THR  26           HB       THR  26   4.291   3.022   9.400
  183    HG1  THR  26           1HG      THR  26   6.764   3.794   8.562
  184   HG21  THR  26          3HG2      THR  26   4.685   0.556   8.793
  185   HG22  THR  26          1HG2      THR  26   5.567   1.050  10.245
  186   HG23  THR  26          2HG2      THR  26   6.419   0.891   8.713
  187    H    PHE  27           H        PHE  27   3.816   0.776   6.985
  188    HA   PHE  27           HA       PHE  27   1.530   1.491   5.452
  189    HB2  PHE  27           1HB      PHE  27   2.314  -0.863   5.539
  190    HB3  PHE  27           2HB      PHE  27   2.104  -0.909   7.282
  191    HD1  PHE  27           1HD      PHE  27   0.086  -0.151   4.140
  192    HD2  PHE  27           2HD      PHE  27  -0.032  -1.810   8.149
  193    HE1  PHE  27           1HE      PHE  27  -2.297  -0.689   3.840
  194    HE2  PHE  27           2HE      PHE  27  -2.436  -2.368   7.826
  195    HZ   PHE  27           HZ       PHE  27  -3.573  -1.804   5.679
  196    H    SER  28           H        SER  28   1.974   1.087   8.981
  197    HA   SER  28           HA       SER  28  -0.728   1.425   9.831
  198    HB2  SER  28           1HB      SER  28   0.312   2.006  12.057
  199    HB3  SER  28           2HB      SER  28   1.143   0.627  11.326
  200    HG   SER  28           HG       SER  28   2.566   2.353  10.396
  201    H    GLU  29           H        GLU  29   1.821   3.871   9.188
  202    HA   GLU  29           HA       GLU  29   0.261   6.179  10.010
  203    HB2  GLU  29           1HB      GLU  29   2.770   5.920   8.189
  204    HB3  GLU  29           2HB      GLU  29   2.126   7.479   8.773
  205    HG2  GLU  29           1HG      GLU  29   2.542   6.736  11.162
  206    HG3  GLU  29           2HG      GLU  29   3.172   5.197  10.588
  207    H    PHE  30           H        PHE  30   1.013   4.666   6.824
  208    HA   PHE  30           HA       PHE  30  -0.450   6.530   5.173
  209    HB2  PHE  30           1HB      PHE  30   1.374   4.956   4.352
  210    HB3  PHE  30           2HB      PHE  30   0.287   3.588   4.609
  211    HD1  PHE  30           2HD      PHE  30   0.649   6.838   2.702
  212    HD2  PHE  30           1HD      PHE  30  -1.519   3.069   2.918
  213    HE1  PHE  30           2HE      PHE  30  -0.512   7.369   0.573
  214    HE2  PHE  30           1HE      PHE  30  -2.671   3.625   0.777
  215    HZ   PHE  30           HZ       PHE  30  -2.174   5.780  -0.398
  216    H    ALA  31           H        ALA  31  -1.320   3.372   6.639
  217    HA   ALA  31           HA       ALA  31  -3.944   3.119   5.504
  218    HB1  ALA  31           1HB      ALA  31  -2.660   1.203   6.501
  219    HB2  ALA  31           2HB      ALA  31  -4.225   1.351   7.286
  220    HB3  ALA  31           3HB      ALA  31  -2.765   1.925   8.096
  221    H    ALA  32           H        ALA  32  -2.714   4.606   8.522
  222    HA   ALA  32           HA       ALA  32  -5.207   5.216   9.832
  223    HB1  ALA  32           1HB      ALA  32  -2.984   5.411  10.990
  224    HB2  ALA  32           2HB      ALA  32  -3.845   6.948  11.067
  225    HB3  ALA  32           3HB      ALA  32  -2.530   6.731   9.913
  226    H    LYS  33           H        LYS  33  -3.390   6.976   7.300
  227    HA   LYS  33           HA       LYS  33  -5.108   9.323   7.201
  228    HB2  LYS  33           1HB      LYS  33  -3.026   8.151   5.246
  229    HB3  LYS  33           2HB      LYS  33  -3.773   9.724   5.005
  230    HG2  LYS  33           1HG      LYS  33  -2.085   9.007   7.497
  231    HG3  LYS  33           2HG      LYS  33  -1.413   9.823   6.069
  232    HD2  LYS  33           1HD      LYS  33  -2.980  11.763   6.420
  233    HD3  LYS  33           2HD      LYS  33  -3.705  10.966   7.809
  234    HE2  LYS  33           1HE      LYS  33  -1.547  11.059   9.060
  235    HE3  LYS  33           2HE      LYS  33  -0.759  11.825   7.658
  236    HZ1  LYS  33           3HZ      LYS  33  -2.106  13.733   7.880
  237    HZ2  LYS  33           1HZ      LYS  33  -1.631  13.360   9.466
  238    HZ3  LYS  33           2HZ      LYS  33  -3.197  12.968   8.936
  239    H    HIS  34           H        HIS  34  -4.921   6.305   5.301
  240    HA   HIS  34           HA       HIS  34  -7.260   7.101   3.681
  241    HB2  HIS  34           1HB      HIS  34  -5.276   4.757   3.472
  242    HB3  HIS  34           2HB      HIS  34  -6.621   5.002   2.341
  243    HD2  HIS  34           2HD      HIS  34  -5.921   6.750   0.233
  244    HE1  HIS  34           1HE      HIS  34  -2.567   8.543   2.035
  245    HE2  HIS  34           2HE      HIS  34  -3.974   8.451  -0.074
  246    H    ALA  35           H        ALA  35  -6.784   5.655   6.658
  247    HA   ALA  35           HA       ALA  35  -8.177   3.240   6.736
  248    HB1  ALA  35           1HB      ALA  35  -7.969   5.479   8.834
  249    HB2  ALA  35           2HB      ALA  35  -7.148   3.922   8.836
  250    HB3  ALA  35           3HB      ALA  35  -8.860   3.996   9.192
  251    H    LYS  36           H        LYS  36  -9.542   6.555   6.651
  252    HA   LYS  36           HA       LYS  36 -12.263   5.740   7.094
  253    HB2  LYS  36           1HB      LYS  36 -11.010   8.380   6.012
  254    HB3  LYS  36           2HB      LYS  36 -12.723   8.224   6.487
  255    HG2  LYS  36           1HG      LYS  36 -12.007   7.687   8.864
  256    HG3  LYS  36           2HG      LYS  36 -10.299   7.841   8.391
  257    HD2  LYS  36           1HD      LYS  36 -10.664  10.290   7.801
  258    HD3  LYS  36           2HD      LYS  36 -12.387  10.150   8.243
  259    HE2  LYS  36           1HE      LYS  36 -11.068  11.164  10.140
  260    HE3  LYS  36           2HE      LYS  36 -11.701   9.586  10.634
  261    HZ1  LYS  36           3HZ      LYS  36  -9.054   9.720   9.364
  262    HZ2  LYS  36           1HZ      LYS  36  -9.647   8.632  10.522
  263    HZ3  LYS  36           2HZ      LYS  36  -9.208  10.205  10.985
  264    H    ASP  37           H        ASP  37 -10.184   5.607   4.353
  265    HA   ASP  37           HA       ASP  37 -12.066   6.144   2.237
  266    HB2  ASP  37           1HB      ASP  37  -9.516   4.400   2.184
  267    HB3  ASP  37           2HB      ASP  37 -10.387   4.953   0.774
  268    H    SER  38           H        SER  38 -13.413   4.682   1.149
  269    HA   SER  38           HA       SER  38 -14.489   2.472   2.630
  270    HB2  SER  38           1HB      SER  38 -14.977   3.583  -0.166
  271    HB3  SER  38           2HB      SER  38 -15.875   2.190   0.445
  272    HG   SER  38           HG       SER  38 -16.001   3.910   2.370
  273    H    ARG  39           H        ARG  39 -11.930   2.780   0.371
  274    HA   ARG  39           HA       ARG  39 -11.834   0.077  -0.713
  275    HB2  ARG  39           1HB      ARG  39  -9.726   2.330  -0.540
  276    HB3  ARG  39           2HB      ARG  39  -9.467   0.796  -1.415
  277    HG2  ARG  39           1HG      ARG  39 -11.460   1.322  -2.916
  278    HG3  ARG  39           2HG      ARG  39 -11.698   2.854  -2.052
  279    HD2  ARG  39           1HD      ARG  39  -9.401   3.622  -2.793
  280    HD3  ARG  39           2HD      ARG  39  -9.182   2.083  -3.669
  281    HE   ARG  39           HE       ARG  39 -11.606   3.194  -4.579
  282   HH11  ARG  39          1HH2      ARG  39  -8.242   4.024  -4.545
  283   HH12  ARG  39          2HH2      ARG  39  -8.298   4.908  -6.032
  284   HH21  ARG  39          1HH1      ARG  39 -11.677   4.355  -6.532
  285   HH22  ARG  39          2HH1      ARG  39 -10.243   5.096  -7.156
  286    H    PHE  40           H        PHE  40 -10.755   1.625   2.238
  287    HA   PHE  40           HA       PHE  40  -8.671  -0.198   2.877
  288    HB2  PHE  40           1HB      PHE  40  -8.741   2.000   4.042
  289    HB3  PHE  40           2HB      PHE  40 -10.343   1.641   4.679
  290    HD1  PHE  40           1HD      PHE  40  -6.715   0.631   4.912
  291    HD2  PHE  40           2HD      PHE  40 -10.648   0.196   6.719
  292    HE1  PHE  40           1HE      PHE  40  -5.719  -0.614   6.814
  293    HE2  PHE  40           2HE      PHE  40  -9.620  -1.025   8.626
  294    HZ   PHE  40           HZ       PHE  40  -7.154  -1.438   8.679
  295    H    LYS  41           H        LYS  41 -12.025   0.006   4.035
  296    HA   LYS  41           HA       LYS  41 -12.039  -2.461   5.541
  297    HB2  LYS  41           1HB      LYS  41 -14.454  -1.986   5.935
  298    HB3  LYS  41           2HB      LYS  41 -13.586  -0.435   6.006
  299    HG2  LYS  41           1HG      LYS  41 -14.254   0.052   3.608
  300    HG3  LYS  41           2HG      LYS  41 -15.119  -1.485   3.506
  301    HD2  LYS  41           1HD      LYS  41 -16.684  -0.692   5.362
  302    HD3  LYS  41           2HD      LYS  41 -15.851   0.871   5.368
  303    HE2  LYS  41           1HE      LYS  41 -16.552   1.242   2.955
  304    HE3  LYS  41           2HE      LYS  41 -17.375  -0.322   2.947
  305    HZ1  LYS  41           3HZ      LYS  41 -18.710   1.801   3.464
  306    HZ2  LYS  41           1HZ      LYS  41 -18.016   1.695   5.006
  307    HZ3  LYS  41           2HZ      LYS  41 -18.971   0.419   4.415
  308    H    ALA  42           H        ALA  42 -12.385  -1.754   2.158
  309    HA   ALA  42           HA       ALA  42 -14.166  -3.843   1.282
  310    HB1  ALA  42           1HB      ALA  42 -13.197  -3.366  -0.978
  311    HB2  ALA  42           2HB      ALA  42 -11.861  -2.485  -0.242
  312    HB3  ALA  42           3HB      ALA  42 -13.498  -1.842  -0.139
  313    H    ILE  43           H        ILE  43 -10.699  -3.714   1.963
  314    HA   ILE  43           HA       ILE  43 -10.312  -6.552   1.125
  315    HB   ILE  43           HB       ILE  43  -8.235  -4.649   2.412
  316   HG12  ILE  43          1HG1      ILE  43  -9.014  -3.421   0.420
  317   HG13  ILE  43          2HG1      ILE  43  -7.442  -4.090   0.033
  318   HG21  ILE  43          1HG2      ILE  43  -7.615  -7.085   2.356
  319   HG22  ILE  43          2HG2      ILE  43  -6.562  -6.170   1.282
  320   HG23  ILE  43          3HG2      ILE  43  -7.875  -7.140   0.612
  321   HD11  ILE  43          3HD1      ILE  43  -8.708  -4.489  -1.878
  322   HD12  ILE  43          1HD1      ILE  43 -10.164  -4.891  -0.995
  323   HD13  ILE  43          2HD1      ILE  43  -8.832  -6.050  -1.089
  324    H    GLU  44           H        GLU  44 -10.883  -8.002   2.584
  325    HA   GLU  44           HA       GLU  44 -11.451  -7.522   5.360
  326    HB2  GLU  44           1HB      GLU  44 -12.621  -9.273   3.907
  327    HB3  GLU  44           2HB      GLU  44 -11.110 -10.198   3.809
  328    HG2  GLU  44           1HG      GLU  44 -11.152 -10.544   6.323
  329    HG3  GLU  44           2HG      GLU  44 -12.636  -9.595   6.438
  330    H    LYS  45           H        LYS  45  -8.762  -9.098   3.559
  331    HA   LYS  45           HA       LYS  45  -7.261  -9.833   5.967
  332    HB2  LYS  45           1HB      LYS  45  -6.584 -10.068   2.952
  333    HB3  LYS  45           2HB      LYS  45  -5.570 -10.731   4.264
  334    HG2  LYS  45           1HG      LYS  45  -7.518 -12.209   5.016
  335    HG3  LYS  45           2HG      LYS  45  -8.516 -11.559   3.687
  336    HD2  LYS  45           1HD      LYS  45  -6.862 -12.500   1.989
  337    HD3  LYS  45           2HD      LYS  45  -5.870 -13.147   3.310
  338    HE2  LYS  45           1HE      LYS  45  -7.774 -14.644   4.015
  339    HE3  LYS  45           2HE      LYS  45  -8.772 -13.994   2.690
  340    HZ1  LYS  45           3HZ      LYS  45  -6.093 -15.109   2.113
  341    HZ2  LYS  45           1HZ      LYS  45  -7.443 -14.975   1.093
  342    HZ3  LYS  45           2HZ      LYS  45  -7.419 -16.152   2.319
  343    H    MET  46           H        MET  46  -6.316  -8.222   7.043
  344    HA   MET  46           HA       MET  46  -5.291  -5.775   5.961
  345    HB2  MET  46           1HB      MET  46  -5.130  -7.181   8.682
  346    HB3  MET  46           2HB      MET  46  -4.163  -5.726   8.389
  347    HG2  MET  46           1HG      MET  46  -6.297  -5.020   9.457
  348    HG3  MET  46           2HG      MET  46  -6.329  -4.455   7.784
  349    HE1  MET  46           3HE      MET  46  -8.938  -4.168   7.641
  350    HE2  MET  46           1HE      MET  46  -8.947  -4.488   9.384
  351    HE3  MET  46           2HE      MET  46 -10.086  -5.314   8.327
  352    H    LYS  47           H        LYS  47  -3.927  -8.946   6.614
  353    HA   LYS  47           HA       LYS  47  -1.132  -8.420   6.490
  354    HB2  LYS  47           1HB      LYS  47  -2.764 -10.934   5.707
  355    HB3  LYS  47           2HB      LYS  47  -0.984 -10.912   5.871
  356    HG2  LYS  47           1HG      LYS  47  -1.238 -10.205   8.319
  357    HG3  LYS  47           2HG      LYS  47  -3.012 -10.282   8.143
  358    HD2  LYS  47           1HD      LYS  47  -2.857 -12.762   7.602
  359    HD3  LYS  47           2HD      LYS  47  -1.090 -12.695   7.754
  360    HE2  LYS  47           1HE      LYS  47  -1.322 -12.045  10.185
  361    HE3  LYS  47           2HE      LYS  47  -3.094 -12.131  10.032
  362    HZ1  LYS  47           3HZ      LYS  47  -1.182 -14.371   9.563
  363    HZ2  LYS  47           1HZ      LYS  47  -2.865 -14.463   9.364
  364    HZ3  LYS  47           2HZ      LYS  47  -2.205 -14.190  10.906
  365    H    ASP  48           H        ASP  48  -3.560  -9.052   3.923
  366    HA   ASP  48           HA       ASP  48  -1.699  -9.292   1.752
  367    HB2  ASP  48           1HB      ASP  48  -4.097 -10.103   1.601
  368    HB3  ASP  48           2HB      ASP  48  -4.677  -8.442   1.737
  369    H    ARG  49           H        ARG  49  -3.356  -6.535   3.290
  370    HA   ARG  49           HA       ARG  49  -2.738  -4.526   1.333
  371    HB2  ARG  49           1HB      ARG  49  -3.110  -4.195   4.380
  372    HB3  ARG  49           2HB      ARG  49  -3.165  -2.898   3.194
  373    HG2  ARG  49           1HG      ARG  49  -5.190  -3.949   2.101
  374    HG3  ARG  49           2HG      ARG  49  -5.146  -5.250   3.309
  375    HD2  ARG  49           1HD      ARG  49  -6.808  -3.548   4.063
  376    HD3  ARG  49           2HD      ARG  49  -5.446  -3.476   5.150
  377    HE   ARG  49           HE       ARG  49  -4.942  -1.360   4.372
  378   HH11  ARG  49          1HH2      ARG  49  -7.108  -2.890   2.071
  379   HH12  ARG  49          2HH2      ARG  49  -7.346  -1.437   1.157
  380   HH21  ARG  49          1HH1      ARG  49  -5.231   0.489   3.123
  381   HH22  ARG  49          2HH1      ARG  49  -6.289   0.460   1.753
  382    H    GLU  50           H        GLU  50  -1.013  -5.722   4.262
  383    HA   GLU  50           HA       GLU  50   1.174  -3.871   4.284
  384    HB2  GLU  50           1HB      GLU  50   0.544  -5.383   6.245
  385    HB3  GLU  50           2HB      GLU  50   1.164  -6.786   5.349
  386    HG2  GLU  50           1HG      GLU  50   3.482  -5.712   5.295
  387    HG3  GLU  50           2HG      GLU  50   2.866  -4.315   6.176
  388    H    ALA  51           H        ALA  51   0.731  -7.104   2.718
  389    HA   ALA  51           HA       ALA  51   3.338  -7.575   1.758
  390    HB1  ALA  51           1HB      ALA  51   1.441  -9.252   1.621
  391    HB2  ALA  51           2HB      ALA  51   2.250  -9.064   0.059
  392    HB3  ALA  51           3HB      ALA  51   0.689  -8.288   0.350
  393    H    LEU  52           H        LEU  52   0.603  -5.890   0.092
  394    HA   LEU  52           HA       LEU  52   2.050  -5.115  -2.246
  395    HB2  LEU  52           1HB      LEU  52  -0.572  -4.265  -1.001
  396    HB3  LEU  52           2HB      LEU  52   0.074  -3.281  -2.300
  397    HG   LEU  52           HG       LEU  52  -1.570  -5.043  -3.155
  398   HD11  LEU  52          1HD1      LEU  52   1.113  -5.855  -4.373
  399   HD12  LEU  52          2HD1      LEU  52   0.566  -4.192  -4.552
  400   HD13  LEU  52          3HD1      LEU  52  -0.423  -5.508  -5.144
  401   HD21  LEU  52          3HD2      LEU  52   0.517  -7.170  -2.402
  402   HD22  LEU  52          1HD2      LEU  52  -1.104  -7.403  -3.031
  403   HD23  LEU  52          2HD2      LEU  52  -0.878  -6.806  -1.421
  404    H    PHE  53           H        PHE  53   1.454  -3.443   0.839
  405    HA   PHE  53           HA       PHE  53   2.524  -0.892   0.184
  406    HB2  PHE  53           1HB      PHE  53   1.176  -1.504   2.274
  407    HB3  PHE  53           2HB      PHE  53   2.593  -2.333   2.899
  408    HD1  PHE  53           1HD      PHE  53   4.654  -1.056   3.645
  409    HD2  PHE  53           2HD      PHE  53   1.190   1.022   2.045
  410    HE1  PHE  53           1HE      PHE  53   5.604   1.117   4.371
  411    HE2  PHE  53           2HE      PHE  53   2.170   3.170   2.756
  412    HZ   PHE  53           HZ       PHE  53   4.357   3.231   3.931
  413    H    ASN  54           H        ASN  54   4.089  -3.781   1.593
  414    HA   ASN  54           HA       ASN  54   6.732  -2.716   1.888
  415    HB2  ASN  54           1HB      ASN  54   5.728  -5.607   1.500
  416    HB3  ASN  54           2HB      ASN  54   7.410  -5.226   1.888
  417   HD21  ASN  54          1HD2      ASN  54   5.904  -6.840   3.654
  418   HD22  ASN  54          2HD2      ASN  54   5.598  -5.976   5.089
  419    H    GLU  55           H        GLU  55   5.161  -4.473  -0.829
  420    HA   GLU  55           HA       GLU  55   7.458  -4.614  -2.583
  421    HB2  GLU  55           1HB      GLU  55   4.428  -4.836  -3.137
  422    HB3  GLU  55           2HB      GLU  55   5.651  -5.103  -4.397
  423    HG2  GLU  55           1HG      GLU  55   6.607  -7.023  -3.092
  424    HG3  GLU  55           2HG      GLU  55   5.479  -6.740  -1.781
  425    H    PHE  56           H        PHE  56   4.714  -2.308  -2.216
  426    HA   PHE  56           HA       PHE  56   5.187  -0.722  -4.508
  427    HB2  PHE  56           1HB      PHE  56   3.073  -0.575  -3.157
  428    HB3  PHE  56           2HB      PHE  56   3.971   0.056  -1.774
  429    HD1  PHE  56           2HD      PHE  56   3.154   0.787  -5.398
  430    HD2  PHE  56           1HD      PHE  56   4.454   2.520  -1.626
  431    HE1  PHE  56           2HE      PHE  56   3.054   3.050  -6.386
  432    HE2  PHE  56           1HE      PHE  56   4.350   4.793  -2.642
  433    HZ   PHE  56           HZ       PHE  56   3.656   5.066  -5.028
  434    H    VAL  57           H        VAL  57   6.318  -0.259  -1.079
  435    HA   VAL  57           HA       VAL  57   7.885   2.124  -1.513
  436    HB   VAL  57           HB       VAL  57   8.054  -0.101   0.653
  437   HG11  VAL  57          1HG1      VAL  57  10.259   0.990   0.737
  438   HG12  VAL  57          2HG1      VAL  57   9.331   1.727   2.036
  439   HG13  VAL  57          3HG1      VAL  57   9.565   2.599   0.519
  440   HG21  VAL  57          3HG2      VAL  57   6.809   2.742   0.773
  441   HG22  VAL  57          1HG2      VAL  57   6.830   1.568   2.092
  442   HG23  VAL  57          2HG2      VAL  57   5.900   1.244   0.636
  443    H    ALA  58           H        ALA  58   8.771  -1.382  -1.476
  444    HA   ALA  58           HA       ALA  58  11.572  -1.033  -1.925
  445    HB1  ALA  58           1HB      ALA  58  11.525  -3.508  -2.488
  446    HB2  ALA  58           2HB      ALA  58   9.760  -3.442  -2.588
  447    HB3  ALA  58           3HB      ALA  58  10.557  -3.168  -1.041
  448    H    ALA  59           H        ALA  59   8.797  -1.443  -4.177
  449    HA   ALA  59           HA       ALA  59  10.347  -1.591  -6.630
  450    HB1  ALA  59           1HB      ALA  59   8.053  -1.365  -7.711
  451    HB2  ALA  59           2HB      ALA  59   7.357  -1.001  -6.123
  452    HB3  ALA  59           3HB      ALA  59   8.048  -2.596  -6.438
  453    H    ALA  60           H        ALA  60   8.503   1.006  -4.919
  454    HA   ALA  60           HA       ALA  60   8.777   3.079  -6.889
  455    HB1  ALA  60           1HB      ALA  60   8.122   4.628  -4.965
  456    HB2  ALA  60           2HB      ALA  60   8.346   3.281  -3.833
  457    HB3  ALA  60           3HB      ALA  60   7.068   3.206  -5.049
  458    H    ARG  61           H        ARG  61  10.715   2.224  -3.951
  459    HA   ARG  61           HA       ARG  61  12.559   4.436  -4.232
  460    HB2  ARG  61           1HB      ARG  61  12.172   3.268  -2.003
  461    HB3  ARG  61           2HB      ARG  61  12.897   1.777  -2.643
  462    HG2  ARG  61           1HG      ARG  61  15.125   2.970  -2.951
  463    HG3  ARG  61           2HG      ARG  61  14.403   4.486  -2.361
  464    HD2  ARG  61           1HD      ARG  61  15.687   3.388  -0.540
  465    HD3  ARG  61           2HD      ARG  61  13.960   3.345  -0.121
  466    HE   ARG  61           HE       ARG  61  14.701   0.966  -1.569
  467   HH11  ARG  61          1HH2      ARG  61  15.039   2.485   1.542
  468   HH12  ARG  61          2HH2      ARG  61  15.225   0.996   2.404
  469   HH21  ARG  61          1HH1      ARG  61  14.951  -0.996  -0.427
  470   HH22  ARG  61          2HH1      ARG  61  15.176  -0.976   1.291
  Start of MODEL    6
    1    H    ILE   5           H        ILE   5 -13.499 -10.394 -11.926
    2    HA   ILE   5           HA       ILE   5 -11.845  -9.875 -13.475
    3    HB   ILE   5           HB       ILE   5 -13.212  -7.085 -13.538
    4   HG12  ILE   5          1HG1      ILE   5 -13.762  -9.393 -15.540
    5   HG13  ILE   5          2HG1      ILE   5 -14.715  -9.202 -14.091
    6   HG21  ILE   5          1HG2      ILE   5 -11.013  -8.266 -15.340
    7   HG22  ILE   5          2HG2      ILE   5 -11.217  -6.594 -14.792
    8   HG23  ILE   5          3HG2      ILE   5 -12.220  -7.214 -16.094
    9   HD11  ILE   5          3HD1      ILE   5 -14.443  -6.981 -16.157
   10   HD12  ILE   5          1HD1      ILE   5 -15.536  -7.027 -14.769
   11   HD13  ILE   5          2HD1      ILE   5 -15.777  -8.136 -16.123
   12    H    MET   6           H        MET   6 -11.288  -9.634 -10.613
   13    HA   MET   6           HA       MET   6  -9.848  -8.613  -9.012
   14    HB2  MET   6           1HB      MET   6  -8.220  -8.515 -11.645
   15    HB3  MET   6           2HB      MET   6  -7.495  -8.311 -10.043
   16    HG2  MET   6           1HG      MET   6  -8.295 -10.628  -9.390
   17    HG3  MET   6           2HG      MET   6  -8.987 -10.827 -11.011
   18    HE1  MET   6           3HE      MET   6  -5.962 -13.245 -11.149
   19    HE2  MET   6           1HE      MET   6  -7.660 -13.002 -11.580
   20    HE3  MET   6           2HE      MET   6  -7.157 -12.955  -9.888
   21    H    GLN   7           H        GLN   7 -11.751  -6.757 -10.413
   22    HA   GLN   7           HA       GLN   7 -10.538  -4.313 -11.185
   23    HB2  GLN   7           1HB      GLN   7 -12.962  -4.921 -11.645
   24    HB3  GLN   7           2HB      GLN   7 -13.340  -4.738  -9.928
   25    HG2  GLN   7           1HG      GLN   7 -12.696  -2.284 -10.046
   26    HG3  GLN   7           2HG      GLN   7 -12.267  -2.465 -11.747
   27   HE21  GLN   7          1HE2      GLN   7 -13.917  -1.792 -13.119
   28   HE22  GLN   7          2HE2      GLN   7 -15.574  -1.785 -12.745
   29    H    ALA   8           H        ALA   8 -11.598  -5.513  -8.003
   30    HA   ALA   8           HA       ALA   8 -11.284  -3.145  -6.448
   31    HB1  ALA   8           1HB      ALA   8 -11.227  -4.712  -4.488
   32    HB2  ALA   8           2HB      ALA   8 -10.879  -6.067  -5.563
   33    HB3  ALA   8           3HB      ALA   8 -12.448  -5.265  -5.648
   34    H    LYS   9           H        LYS   9  -8.918  -5.743  -7.262
   35    HA   LYS   9           HA       LYS   9  -6.744  -4.744  -5.718
   36    HB2  LYS   9           1HB      LYS   9  -6.827  -6.573  -8.221
   37    HB3  LYS   9           2HB      LYS   9  -5.366  -6.320  -7.263
   38    HG2  LYS   9           1HG      LYS   9  -6.522  -7.286  -5.235
   39    HG3  LYS   9           2HG      LYS   9  -7.991  -7.537  -6.189
   40    HD2  LYS   9           1HD      LYS   9  -6.733  -9.156  -7.704
   41    HD3  LYS   9           2HD      LYS   9  -5.272  -8.920  -6.731
   42    HE2  LYS   9           1HE      LYS   9  -7.921 -10.111  -5.669
   43    HE3  LYS   9           2HE      LYS   9  -6.444 -11.035  -6.013
   44    HZ1  LYS   9           3HZ      LYS   9  -6.048 -10.605  -3.854
   45    HZ2  LYS   9           1HZ      LYS   9  -7.053  -9.240  -3.812
   46    HZ3  LYS   9           2HZ      LYS   9  -5.486  -9.119  -4.450
   47    H    GLU  10           H        GLU  10  -7.665  -4.260  -9.120
   48    HA   GLU  10           HA       GLU  10  -5.376  -2.741  -9.929
   49    HB2  GLU  10           1HB      GLU  10  -8.263  -2.881 -11.019
   50    HB3  GLU  10           2HB      GLU  10  -6.973  -1.972 -11.831
   51    HG2  GLU  10           1HG      GLU  10  -5.647  -4.087 -12.142
   52    HG3  GLU  10           2HG      GLU  10  -6.855  -5.011 -11.276
   53    H    ASP  11           H        ASP  11  -8.574  -1.866  -8.643
   54    HA   ASP  11           HA       ASP  11  -8.347   0.991  -8.752
   55    HB2  ASP  11           1HB      ASP  11 -10.058  -0.821  -6.934
   56    HB3  ASP  11           2HB      ASP  11 -10.215   0.938  -6.980
   57    H    PHE  12           H        PHE  12  -7.512  -1.426  -6.275
   58    HA   PHE  12           HA       PHE  12  -6.752   0.413  -4.195
   59    HB2  PHE  12           1HB      PHE  12  -7.214  -2.099  -3.869
   60    HB3  PHE  12           2HB      PHE  12  -5.685  -2.442  -4.677
   61    HD1  PHE  12           1HD      PHE  12  -7.179  -0.569  -1.757
   62    HD2  PHE  12           2HD      PHE  12  -3.522  -2.261  -3.375
   63    HE1  PHE  12           1HE      PHE  12  -6.011  -0.076   0.371
   64    HE2  PHE  12           2HE      PHE  12  -2.366  -1.792  -1.187
   65    HZ   PHE  12           HZ       PHE  12  -3.610  -0.678   0.668
   66    H    LYS  13           H        LYS  13  -4.733  -1.309  -6.664
   67    HA   LYS  13           HA       LYS  13  -2.203  -0.182  -6.006
   68    HB2  LYS  13           1HB      LYS  13  -3.343  -1.374  -8.610
   69    HB3  LYS  13           2HB      LYS  13  -1.640  -0.914  -8.446
   70    HG2  LYS  13           1HG      LYS  13  -1.392  -2.515  -6.499
   71    HG3  LYS  13           2HG      LYS  13  -3.082  -2.972  -6.661
   72    HD2  LYS  13           1HD      LYS  13  -2.635  -3.915  -8.962
   73    HD3  LYS  13           2HD      LYS  13  -0.939  -3.409  -8.850
   74    HE2  LYS  13           1HE      LYS  13  -1.178  -5.867  -8.287
   75    HE3  LYS  13           2HE      LYS  13  -0.619  -4.972  -6.870
   76    HZ1  LYS  13           3HZ      LYS  13  -2.563  -5.265  -5.808
   77    HZ2  LYS  13           1HZ      LYS  13  -2.704  -6.607  -6.834
   78    HZ3  LYS  13           2HZ      LYS  13  -3.496  -5.156  -7.223
   79    H    LYS  14           H        LYS  14  -4.714   0.758  -8.229
   80    HA   LYS  14           HA       LYS  14  -3.435   2.864  -9.575
   81    HB2  LYS  14           1HB      LYS  14  -5.662   1.921 -10.274
   82    HB3  LYS  14           2HB      LYS  14  -6.432   2.676  -8.893
   83    HG2  LYS  14           1HG      LYS  14  -5.911   4.948  -9.740
   84    HG3  LYS  14           2HG      LYS  14  -4.918   4.309 -11.051
   85    HD2  LYS  14           1HD      LYS  14  -7.901   3.560 -10.853
   86    HD3  LYS  14           2HD      LYS  14  -7.427   5.093 -11.570
   87    HE2  LYS  14           1HE      LYS  14  -6.101   3.935 -13.320
   88    HE3  LYS  14           2HE      LYS  14  -6.400   2.367 -12.570
   89    HZ1  LYS  14           3HZ      LYS  14  -8.005   3.747 -14.376
   90    HZ2  LYS  14           1HZ      LYS  14  -8.845   3.643 -12.910
   91    HZ3  LYS  14           2HZ      LYS  14  -8.274   2.230 -13.660
   92    H    MET  15           H        MET  15  -5.175   2.725  -6.496
   93    HA   MET  15           HA       MET  15  -5.114   5.546  -5.996
   94    HB2  MET  15           1HB      MET  15  -6.640   3.771  -4.806
   95    HB3  MET  15           2HB      MET  15  -5.229   3.324  -3.850
   96    HG2  MET  15           1HG      MET  15  -6.504   4.952  -2.504
   97    HG3  MET  15           2HG      MET  15  -5.069   5.795  -3.066
   98    HE1  MET  15           3HE      MET  15  -6.291   8.120  -2.542
   99    HE2  MET  15           1HE      MET  15  -7.748   7.250  -2.017
  100    HE3  MET  15           2HE      MET  15  -7.870   8.569  -3.178
  101    H    MET  16           H        MET  16  -2.938   2.843  -5.041
  102    HA   MET  16           HA       MET  16  -1.184   4.226  -3.283
  103    HB2  MET  16           1HB      MET  16  -0.595   1.823  -5.144
  104    HB3  MET  16           2HB      MET  16   0.415   2.300  -3.778
  105    HG2  MET  16           1HG      MET  16  -1.536   1.836  -2.214
  106    HG3  MET  16           2HG      MET  16  -2.483   1.348  -3.580
  107    HE1  MET  16           3HE      MET  16   1.116   0.730  -2.049
  108    HE2  MET  16           1HE      MET  16   1.017  -0.989  -1.700
  109    HE3  MET  16           2HE      MET  16  -0.030   0.133  -0.860
  110    H    GLU  17           H        GLU  17  -0.839   3.749  -6.826
  111    HA   GLU  17           HA       GLU  17   1.734   5.034  -7.024
  112    HB2  GLU  17           1HB      GLU  17   1.383   4.831  -9.492
  113    HB3  GLU  17           2HB      GLU  17   0.883   3.329  -8.698
  114    HG2  GLU  17           1HG      GLU  17  -1.511   4.207  -8.785
  115    HG3  GLU  17           2HG      GLU  17  -0.958   5.546  -9.748
  116    H    GLU  18           H        GLU  18  -1.669   6.118  -7.341
  117    HA   GLU  18           HA       GLU  18  -1.086   8.864  -8.167
  118    HB2  GLU  18           1HB      GLU  18  -3.708   7.475  -7.270
  119    HB3  GLU  18           2HB      GLU  18  -3.646   9.176  -7.777
  120    HG2  GLU  18           1HG      GLU  18  -2.854   8.472 -10.062
  121    HG3  GLU  18           2HG      GLU  18  -2.875   6.809  -9.575
  122    H    ALA  19           H        ALA  19  -1.368   7.172  -5.124
  123    HA   ALA  19           HA       ALA  19  -1.995   9.573  -3.528
  124    HB1  ALA  19           1HB      ALA  19  -1.501   6.650  -2.701
  125    HB2  ALA  19           2HB      ALA  19  -3.061   7.455  -2.817
  126    HB3  ALA  19           3HB      ALA  19  -1.927   7.943  -1.564
  127    H    LYS  20           H        LYS  20   0.669   8.495  -5.110
  128    HA   LYS  20           HA       LYS  20   2.826   7.871  -3.841
  129    HB2  LYS  20           1HB      LYS  20   2.786   9.082  -6.157
  130    HB3  LYS  20           2HB      LYS  20   2.939  10.602  -5.284
  131    HG2  LYS  20           1HG      LYS  20   5.249  10.145  -5.809
  132    HG3  LYS  20           2HG      LYS  20   5.145   9.483  -4.186
  133    HD2  LYS  20           1HD      LYS  20   4.751   7.146  -5.238
  134    HD3  LYS  20           2HD      LYS  20   5.028   7.866  -6.820
  135    HE2  LYS  20           1HE      LYS  20   7.154   6.804  -6.037
  136    HE3  LYS  20           2HE      LYS  20   7.383   8.564  -6.007
  137    HZ1  LYS  20           3HZ      LYS  20   6.430   7.025  -3.665
  138    HZ2  LYS  20           1HZ      LYS  20   7.005   8.616  -3.702
  139    HZ3  LYS  20           2HZ      LYS  20   8.078   7.321  -3.952
  140    H    PHE  21           H        PHE  21   3.605   8.172  -1.827
  141    HA   PHE  21           HA       PHE  21   3.459  10.836  -0.528
  142    HB2  PHE  21           1HB      PHE  21   2.635   9.734   1.566
  143    HB3  PHE  21           2HB      PHE  21   1.502   9.485   0.235
  144    HD1  PHE  21           1HD      PHE  21   1.443   7.186  -1.006
  145    HD2  PHE  21           2HD      PHE  21   3.797   7.736   2.583
  146    HE1  PHE  21           1HE      PHE  21   1.649   4.717  -0.773
  147    HE2  PHE  21           2HE      PHE  21   4.000   5.257   2.810
  148    HZ   PHE  21           HZ       PHE  21   2.927   3.750   1.126
  149    H    ASN  22           H        ASN  22   4.775  10.681   1.608
  150    HA   ASN  22           HA       ASN  22   7.433  10.399   1.099
  151    HB2  ASN  22           1HB      ASN  22   5.978  10.105   3.750
  152    HB3  ASN  22           2HB      ASN  22   7.733  10.269   3.655
  153   HD21  ASN  22          1HD2      ASN  22   4.754  11.884   2.439
  154   HD22  ASN  22          2HD2      ASN  22   5.361  13.463   2.572
  155    HA   PRO  23           HA       PRO  23   7.742   5.765   0.696
  156    HB2  PRO  23           1HB      PRO  23  10.440   5.541   0.130
  157    HB3  PRO  23           2HB      PRO  23   9.262   6.137  -1.073
  158    HG2  PRO  23           1HG      PRO  23  11.147   7.731   0.680
  159    HG3  PRO  23           2HG      PRO  23  10.776   7.946  -1.048
  160    HD2  PRO  23           1HD      PRO  23   9.600   9.511   0.909
  161    HD3  PRO  23           2HD      PRO  23   8.729   9.087  -0.611
  162    H    ARG  24           H        ARG  24   9.394   7.742   3.034
  163    HA   ARG  24           HA       ARG  24  10.467   5.492   4.610
  164    HB2  ARG  24           1HB      ARG  24  10.529   8.550   5.067
  165    HB3  ARG  24           2HB      ARG  24  11.388   7.379   6.091
  166    HG2  ARG  24           1HG      ARG  24  12.789   6.651   4.129
  167    HG3  ARG  24           2HG      ARG  24  11.901   7.744   3.062
  168    HD2  ARG  24           1HD      ARG  24  14.062   8.792   3.721
  169    HD3  ARG  24           2HD      ARG  24  12.718   9.729   4.415
  170    HE   ARG  24           HE       ARG  24  13.553   7.684   6.244
  171   HH11  ARG  24          1HH2      ARG  24  14.534  10.755   4.977
  172   HH12  ARG  24          2HH2      ARG  24  15.464  11.185   6.369
  173   HH21  ARG  24          1HH1      ARG  24  14.748   8.249   8.078
  174   HH22  ARG  24          2HH1      ARG  24  15.589   9.762   8.136
  175    H    ALA  25           H        ALA  25   7.491   6.969   4.347
  176    HA   ALA  25           HA       ALA  25   6.685   6.985   7.146
  177    HB1  ALA  25           1HB      ALA  25   4.348   7.186   6.184
  178    HB2  ALA  25           2HB      ALA  25   5.010   6.910   4.568
  179    HB3  ALA  25           3HB      ALA  25   5.444   8.358   5.452
  180    H    THR  26           H        THR  26   5.233   5.423   8.049
  181    HA   THR  26           HA       THR  26   5.821   2.640   7.206
  182    HB   THR  26           HB       THR  26   4.519   3.675   9.820
  183    HG1  THR  26           1HG      THR  26   7.212   3.298   9.077
  184   HG21  THR  26          3HG2      THR  26   5.779   0.946   9.070
  185   HG22  THR  26          1HG2      THR  26   4.142   1.234   9.683
  186   HG23  THR  26          2HG2      THR  26   5.538   1.451  10.741
  187    H    PHE  27           H        PHE  27   4.010   1.127   7.477
  188    HA   PHE  27           HA       PHE  27   1.796   1.728   5.810
  189    HB2  PHE  27           1HB      PHE  27   2.662  -0.592   6.070
  190    HB3  PHE  27           2HB      PHE  27   2.284  -0.584   7.783
  191    HD1  PHE  27           1HD      PHE  27   0.628  -0.079   4.402
  192    HD2  PHE  27           2HD      PHE  27   0.033  -1.387   8.503
  193    HE1  PHE  27           1HE      PHE  27  -1.711  -0.682   3.868
  194    HE2  PHE  27           2HE      PHE  27  -2.321  -2.016   7.943
  195    HZ   PHE  27           HZ       PHE  27  -3.184  -1.669   5.629
  196    H    SER  28           H        SER  28   2.096   1.477   9.368
  197    HA   SER  28           HA       SER  28  -0.651   1.790  10.111
  198    HB2  SER  28           1HB      SER  28   1.190   1.114  11.718
  199    HB3  SER  28           2HB      SER  28   1.860   2.740  11.615
  200    HG   SER  28           HG       SER  28   0.533   2.783  13.356
  201    H    GLU  29           H        GLU  29   1.862   4.237   9.432
  202    HA   GLU  29           HA       GLU  29   0.248   6.556  10.088
  203    HB2  GLU  29           1HB      GLU  29   2.809   6.237   8.383
  204    HB3  GLU  29           2HB      GLU  29   2.131   7.816   8.819
  205    HG2  GLU  29           1HG      GLU  29   3.133   5.689  10.839
  206    HG3  GLU  29           2HG      GLU  29   4.031   7.133  10.367
  207    H    PHE  30           H        PHE  30   1.060   4.890   7.023
  208    HA   PHE  30           HA       PHE  30  -0.367   6.642   5.250
  209    HB2  PHE  30           1HB      PHE  30   1.435   5.058   4.488
  210    HB3  PHE  30           2HB      PHE  30   0.423   3.687   4.938
  211    HD1  PHE  30           2HD      PHE  30   0.518   6.741   2.704
  212    HD2  PHE  30           1HD      PHE  30  -1.380   2.876   3.376
  213    HE1  PHE  30           2HE      PHE  30  -0.753   6.974   0.574
  214    HE2  PHE  30           1HE      PHE  30  -2.647   3.140   1.236
  215    HZ   PHE  30           HZ       PHE  30  -2.333   5.191  -0.161
  216    H    ALA  31           H        ALA  31  -1.256   3.523   6.824
  217    HA   ALA  31           HA       ALA  31  -3.871   3.217   5.684
  218    HB1  ALA  31           1HB      ALA  31  -4.156   1.495   7.542
  219    HB2  ALA  31           2HB      ALA  31  -2.681   2.080   8.300
  220    HB3  ALA  31           3HB      ALA  31  -2.604   1.302   6.726
  221    H    ALA  32           H        ALA  32  -2.693   4.726   8.698
  222    HA   ALA  32           HA       ALA  32  -5.179   5.323   9.992
  223    HB1  ALA  32           1HB      ALA  32  -2.514   6.877  10.028
  224    HB2  ALA  32           2HB      ALA  32  -2.991   5.627  11.175
  225    HB3  ALA  32           3HB      ALA  32  -3.849   7.170  11.150
  226    H    LYS  33           H        LYS  33  -3.390   7.003   7.433
  227    HA   LYS  33           HA       LYS  33  -5.152   9.319   7.379
  228    HB2  LYS  33           1HB      LYS  33  -2.710   9.370   6.577
  229    HB3  LYS  33           2HB      LYS  33  -3.168   8.344   5.214
  230    HG2  LYS  33           1HG      LYS  33  -4.773  10.117   4.370
  231    HG3  LYS  33           2HG      LYS  33  -4.397  11.137   5.768
  232    HD2  LYS  33           1HD      LYS  33  -1.993  11.308   4.974
  233    HD3  LYS  33           2HD      LYS  33  -2.396  10.310   3.569
  234    HE2  LYS  33           1HE      LYS  33  -4.028  12.065   2.769
  235    HE3  LYS  33           2HE      LYS  33  -3.657  13.065   4.189
  236    HZ1  LYS  33           3HZ      LYS  33  -1.289  12.920   3.451
  237    HZ2  LYS  33           1HZ      LYS  33  -2.312  13.844   2.468
  238    HZ3  LYS  33           2HZ      LYS  33  -1.856  12.279   1.987
  239    H    HIS  34           H        HIS  34  -4.894   6.309   5.383
  240    HA   HIS  34           HA       HIS  34  -7.263   7.066   3.765
  241    HB2  HIS  34           1HB      HIS  34  -5.205   4.779   3.548
  242    HB3  HIS  34           2HB      HIS  34  -6.590   4.914   2.454
  243    HD2  HIS  34           2HD      HIS  34  -6.322   6.938   0.474
  244    HE1  HIS  34           1HE      HIS  34  -2.593   8.428   1.753
  245    HE2  HIS  34           2HE      HIS  34  -4.344   8.543  -0.076
  246    H    ALA  35           H        ALA  35  -6.797   5.662   6.730
  247    HA   ALA  35           HA       ALA  35  -8.120   3.215   6.858
  248    HB1  ALA  35           1HB      ALA  35  -8.844   4.024   9.279
  249    HB2  ALA  35           2HB      ALA  35  -8.023   5.533   8.875
  250    HB3  ALA  35           3HB      ALA  35  -7.121   4.022   8.940
  251    H    LYS  36           H        LYS  36  -9.578   6.455   6.734
  252    HA   LYS  36           HA       LYS  36 -12.299   5.550   7.032
  253    HB2  LYS  36           1HB      LYS  36 -12.834   8.021   6.647
  254    HB3  LYS  36           2HB      LYS  36 -11.476   7.887   7.773
  255    HG2  LYS  36           1HG      LYS  36  -9.842   8.280   5.835
  256    HG3  LYS  36           2HG      LYS  36 -11.201   8.463   4.730
  257    HD2  LYS  36           1HD      LYS  36 -11.972  10.513   6.005
  258    HD3  LYS  36           2HD      LYS  36 -10.612  10.334   7.119
  259    HE2  LYS  36           1HE      LYS  36 -10.088  12.082   5.345
  260    HE3  LYS  36           2HE      LYS  36  -8.987  10.701   5.178
  261    HZ1  LYS  36           3HZ      LYS  36 -10.193  11.603   3.104
  262    HZ2  LYS  36           1HZ      LYS  36 -11.538  10.765   3.706
  263    HZ3  LYS  36           2HZ      LYS  36 -10.115   9.921   3.341
  264    H    ASP  37           H        ASP  37 -10.064   5.592   4.409
  265    HA   ASP  37           HA       ASP  37 -11.805   6.202   2.218
  266    HB2  ASP  37           1HB      ASP  37  -9.178   6.045   2.139
  267    HB3  ASP  37           2HB      ASP  37  -9.372   4.309   2.011
  268    H    SER  38           H        SER  38 -13.103   4.837   0.973
  269    HA   SER  38           HA       SER  38 -14.383   2.605   2.213
  270    HB2  SER  38           1HB      SER  38 -15.530   4.109   0.612
  271    HB3  SER  38           2HB      SER  38 -14.482   3.554  -0.690
  272    HG   SER  38           HG       SER  38 -15.501   1.670  -0.722
  273    H    ARG  39           H        ARG  39 -11.815   2.871  -0.200
  274    HA   ARG  39           HA       ARG  39 -11.688   0.144  -1.151
  275    HB2  ARG  39           1HB      ARG  39  -9.560   2.392  -1.113
  276    HB3  ARG  39           2HB      ARG  39  -9.339   0.852  -1.969
  277    HG2  ARG  39           1HG      ARG  39 -11.386   1.374  -3.382
  278    HG3  ARG  39           2HG      ARG  39 -11.558   2.918  -2.548
  279    HD2  ARG  39           1HD      ARG  39  -9.268   3.611  -3.427
  280    HD3  ARG  39           2HD      ARG  39  -9.182   2.077  -4.305
  281    HE   ARG  39           HE       ARG  39 -10.736   2.877  -5.850
  282   HH11  ARG  39          1HH2      ARG  39 -10.813   4.976  -3.032
  283   HH12  ARG  39          2HH2      ARG  39 -11.766   6.194  -3.817
  284   HH21  ARG  39          1HH1      ARG  39 -12.005   4.455  -6.809
  285   HH22  ARG  39          2HH1      ARG  39 -12.436   5.892  -5.950
  286    H    PHE  40           H        PHE  40 -10.486   1.745   1.697
  287    HA   PHE  40           HA       PHE  40  -8.339  -0.079   2.272
  288    HB2  PHE  40           1HB      PHE  40  -8.532   2.262   3.265
  289    HB3  PHE  40           2HB      PHE  40  -9.898   1.734   4.237
  290    HD1  PHE  40           1HD      PHE  40  -6.220   1.301   3.659
  291    HD2  PHE  40           2HD      PHE  40  -9.558   0.219   6.247
  292    HE1  PHE  40           1HE      PHE  40  -4.662   0.287   5.270
  293    HE2  PHE  40           2HE      PHE  40  -7.952  -0.797   7.865
  294    HZ   PHE  40           HZ       PHE  40  -5.503  -0.777   7.371
  295    H    LYS  41           H        LYS  41 -11.637   0.238   3.603
  296    HA   LYS  41           HA       LYS  41 -11.635  -2.164   5.210
  297    HB2  LYS  41           1HB      LYS  41 -14.105  -1.591   5.560
  298    HB3  LYS  41           2HB      LYS  41 -13.054  -0.199   5.847
  299    HG2  LYS  41           1HG      LYS  41 -13.580   0.702   3.563
  300    HG3  LYS  41           2HG      LYS  41 -14.558  -0.701   3.184
  301    HD2  LYS  41           1HD      LYS  41 -16.142   1.062   3.745
  302    HD3  LYS  41           2HD      LYS  41 -16.141  -0.029   5.131
  303    HE2  LYS  41           1HE      LYS  41 -14.631   1.566   6.372
  304    HE3  LYS  41           2HE      LYS  41 -14.609   2.639   4.966
  305    HZ1  LYS  41           3HZ      LYS  41 -16.468   3.528   5.745
  306    HZ2  LYS  41           1HZ      LYS  41 -16.562   2.389   6.994
  307    HZ3  LYS  41           2HZ      LYS  41 -17.266   2.050   5.484
  308    H    ALA  42           H        ALA  42 -12.139  -1.551   1.844
  309    HA   ALA  42           HA       ALA  42 -14.072  -3.585   1.160
  310    HB1  ALA  42           1HB      ALA  42 -11.800  -2.375  -0.543
  311    HB2  ALA  42           2HB      ALA  42 -13.403  -1.661  -0.391
  312    HB3  ALA  42           3HB      ALA  42 -13.202  -3.230  -1.178
  313    H    ILE  43           H        ILE  43 -10.570  -3.577   1.615
  314    HA   ILE  43           HA       ILE  43 -10.297  -6.434   0.858
  315    HB   ILE  43           HB       ILE  43  -8.193  -4.466   2.034
  316   HG12  ILE  43          1HG1      ILE  43  -8.528  -5.309  -0.933
  317   HG13  ILE  43          2HG1      ILE  43  -9.133  -3.789  -0.299
  318   HG21  ILE  43          1HG2      ILE  43  -7.670  -6.950   2.366
  319   HG22  ILE  43          2HG2      ILE  43  -6.502  -6.195   1.303
  320   HG23  ILE  43          3HG2      ILE  43  -7.781  -7.207   0.635
  321   HD11  ILE  43          3HD1      ILE  43  -6.865  -3.047   0.269
  322   HD12  ILE  43          1HD1      ILE  43  -6.953  -3.529  -1.421
  323   HD13  ILE  43          2HD1      ILE  43  -6.192  -4.592  -0.265
  324    H    GLU  44           H        GLU  44 -10.810  -7.902   2.333
  325    HA   GLU  44           HA       GLU  44 -11.392  -7.330   5.105
  326    HB2  GLU  44           1HB      GLU  44 -12.561  -9.124   3.704
  327    HB3  GLU  44           2HB      GLU  44 -11.056 -10.044   3.652
  328    HG2  GLU  44           1HG      GLU  44 -11.106 -10.318   6.161
  329    HG3  GLU  44           2HG      GLU  44 -12.564  -9.331   6.263
  330    H    LYS  45           H        LYS  45  -8.745  -9.097   3.373
  331    HA   LYS  45           HA       LYS  45  -7.261  -9.786   5.768
  332    HB2  LYS  45           1HB      LYS  45  -6.496  -9.957   2.769
  333    HB3  LYS  45           2HB      LYS  45  -5.516 -10.638   4.081
  334    HG2  LYS  45           1HG      LYS  45  -7.440 -12.160   4.730
  335    HG3  LYS  45           2HG      LYS  45  -8.422 -11.483   3.425
  336    HD2  LYS  45           1HD      LYS  45  -6.725 -12.350   1.713
  337    HD3  LYS  45           2HD      LYS  45  -5.786 -13.065   3.035
  338    HE2  LYS  45           1HE      LYS  45  -8.688 -13.851   2.313
  339    HE3  LYS  45           2HE      LYS  45  -7.244 -14.823   1.967
  340    HZ1  LYS  45           3HZ      LYS  45  -7.057 -14.216   4.620
  341    HZ2  LYS  45           1HZ      LYS  45  -7.552 -15.700   3.968
  342    HZ3  LYS  45           2HZ      LYS  45  -8.710 -14.533   4.403
  343    H    MET  46           H        MET  46  -5.905  -8.555   6.784
  344    HA   MET  46           HA       MET  46  -5.054  -5.945   5.849
  345    HB2  MET  46           1HB      MET  46  -4.069  -5.821   8.226
  346    HB3  MET  46           2HB      MET  46  -5.816  -6.079   8.175
  347    HG2  MET  46           1HG      MET  46  -5.532  -8.520   8.619
  348    HG3  MET  46           2HG      MET  46  -3.776  -8.372   8.536
  349    HE1  MET  46           3HE      MET  46  -3.521  -9.578  10.866
  350    HE2  MET  46           1HE      MET  46  -5.280  -9.768  10.958
  351    HE3  MET  46           2HE      MET  46  -4.384  -9.122  12.335
  352    H    LYS  47           H        LYS  47  -3.774  -9.159   6.141
  353    HA   LYS  47           HA       LYS  47  -0.977  -8.635   6.164
  354    HB2  LYS  47           1HB      LYS  47  -2.558 -11.086   5.120
  355    HB3  LYS  47           2HB      LYS  47  -0.790 -11.074   5.307
  356    HG2  LYS  47           1HG      LYS  47  -1.076 -10.614   7.794
  357    HG3  LYS  47           2HG      LYS  47  -2.837 -10.670   7.591
  358    HD2  LYS  47           1HD      LYS  47  -2.682 -13.100   6.865
  359    HD3  LYS  47           2HD      LYS  47  -0.916 -13.047   7.023
  360    HE2  LYS  47           1HE      LYS  47  -1.955 -14.100   9.074
  361    HE3  LYS  47           2HE      LYS  47  -1.171 -12.573   9.516
  362    HZ1  LYS  47           3HZ      LYS  47  -3.136 -11.566   9.873
  363    HZ2  LYS  47           1HZ      LYS  47  -3.670 -13.151  10.156
  364    HZ3  LYS  47           2HZ      LYS  47  -3.943 -12.420   8.649
  365    H    ASP  48           H        ASP  48  -3.328  -9.028   3.527
  366    HA   ASP  48           HA       ASP  48  -1.435  -9.116   1.392
  367    HB2  ASP  48           1HB      ASP  48  -3.840  -9.889   1.114
  368    HB3  ASP  48           2HB      ASP  48  -4.409  -8.244   1.382
  369    H    ARG  49           H        ARG  49  -3.111  -6.478   3.086
  370    HA   ARG  49           HA       ARG  49  -2.325  -4.374   1.291
  371    HB2  ARG  49           1HB      ARG  49  -3.137  -4.254   4.258
  372    HB3  ARG  49           2HB      ARG  49  -2.791  -2.828   3.285
  373    HG2  ARG  49           1HG      ARG  49  -4.668  -3.690   1.634
  374    HG3  ARG  49           2HG      ARG  49  -5.102  -4.813   2.932
  375    HD2  ARG  49           1HD      ARG  49  -5.039  -1.745   3.238
  376    HD3  ARG  49           2HD      ARG  49  -6.511  -2.689   2.974
  377    HE   ARG  49           HE       ARG  49  -4.918  -2.523   5.435
  378   HH11  ARG  49          1HH2      ARG  49  -7.378  -4.367   3.759
  379   HH12  ARG  49          2HH2      ARG  49  -8.071  -4.991   5.217
  380   HH21  ARG  49          1HH1      ARG  49  -5.779  -3.433   7.287
  381   HH22  ARG  49          2HH1      ARG  49  -7.159  -4.471   7.203
  382    H    GLU  50           H        GLU  50  -0.887  -5.742   4.247
  383    HA   GLU  50           HA       GLU  50   1.296  -3.908   4.482
  384    HB2  GLU  50           1HB      GLU  50   0.668  -5.379   6.382
  385    HB3  GLU  50           2HB      GLU  50   1.040  -6.824   5.445
  386    HG2  GLU  50           1HG      GLU  50   3.285  -4.743   5.872
  387    HG3  GLU  50           2HG      GLU  50   2.889  -5.820   7.196
  388    H    ALA  51           H        ALA  51   0.937  -7.079   2.790
  389    HA   ALA  51           HA       ALA  51   3.587  -7.449   1.873
  390    HB1  ALA  51           1HB      ALA  51   1.801  -9.228   1.765
  391    HB2  ALA  51           2HB      ALA  51   2.549  -9.003   0.179
  392    HB3  ALA  51           3HB      ALA  51   0.957  -8.314   0.509
  393    H    LEU  52           H        LEU  52   0.808  -5.828   0.260
  394    HA   LEU  52           HA       LEU  52   2.083  -5.054  -2.166
  395    HB2  LEU  52           1HB      LEU  52  -0.360  -4.007  -0.623
  396    HB3  LEU  52           2HB      LEU  52   0.059  -3.362  -2.214
  397    HG   LEU  52           HG       LEU  52  -0.397  -6.385  -1.788
  398   HD11  LEU  52          1HD1      LEU  52  -2.511  -5.380  -1.098
  399   HD12  LEU  52          2HD1      LEU  52  -2.757  -6.015  -2.715
  400   HD13  LEU  52          3HD1      LEU  52  -2.515  -4.291  -2.477
  401   HD21  LEU  52          3HD2      LEU  52  -0.777  -6.409  -4.279
  402   HD22  LEU  52          1HD2      LEU  52   0.795  -5.692  -3.942
  403   HD23  LEU  52          2HD2      LEU  52  -0.562  -4.662  -4.347
  404    H    PHE  53           H        PHE  53   1.579  -3.351   0.878
  405    HA   PHE  53           HA       PHE  53   2.720  -0.849   0.204
  406    HB2  PHE  53           1HB      PHE  53   1.459  -0.985   2.250
  407    HB3  PHE  53           2HB      PHE  53   2.384  -2.353   2.830
  408    HD1  PHE  53           2HD      PHE  53   2.800   1.292   1.882
  409    HD2  PHE  53           1HD      PHE  53   4.398  -1.992   4.243
  410    HE1  PHE  53           2HE      PHE  53   4.510   2.799   2.899
  411    HE2  PHE  53           1HE      PHE  53   6.097  -0.460   5.226
  412    HZ   PHE  53           HZ       PHE  53   6.153   1.931   4.551
  413    H    ASN  54           H        ASN  54   4.188  -3.758   1.684
  414    HA   ASN  54           HA       ASN  54   6.816  -2.726   2.006
  415    HB2  ASN  54           1HB      ASN  54   5.777  -4.943   2.963
  416    HB3  ASN  54           2HB      ASN  54   6.239  -5.700   1.444
  417   HD21  ASN  54          1HD2      ASN  54   7.333  -5.722   4.444
  418   HD22  ASN  54          2HD2      ASN  54   9.004  -5.605   4.225
  419    H    GLU  55           H        GLU  55   5.335  -4.543  -0.684
  420    HA   GLU  55           HA       GLU  55   7.647  -4.703  -2.395
  421    HB2  GLU  55           1HB      GLU  55   4.631  -5.033  -2.953
  422    HB3  GLU  55           2HB      GLU  55   5.867  -5.309  -4.195
  423    HG2  GLU  55           1HG      GLU  55   6.889  -7.138  -2.801
  424    HG3  GLU  55           2HG      GLU  55   5.720  -6.858  -1.533
  425    H    PHE  56           H        PHE  56   4.907  -2.430  -2.105
  426    HA   PHE  56           HA       PHE  56   5.295  -0.963  -4.476
  427    HB2  PHE  56           1HB      PHE  56   3.230  -0.757  -3.073
  428    HB3  PHE  56           2HB      PHE  56   4.156  -0.051  -1.759
  429    HD1  PHE  56           1HD      PHE  56   3.136   0.481  -5.353
  430    HD2  PHE  56           2HD      PHE  56   4.700   2.413  -1.770
  431    HE1  PHE  56           1HE      PHE  56   2.978   2.694  -6.462
  432    HE2  PHE  56           2HE      PHE  56   4.522   4.634  -2.909
  433    HZ   PHE  56           HZ       PHE  56   3.670   4.768  -5.257
  434    H    VAL  57           H        VAL  57   6.522  -0.366  -1.121
  435    HA   VAL  57           HA       VAL  57   8.059   2.003  -1.683
  436    HB   VAL  57           HB       VAL  57   8.319  -0.123   0.557
  437   HG11  VAL  57          1HG1      VAL  57   9.653   1.774   1.822
  438   HG12  VAL  57          2HG1      VAL  57   9.846   2.561   0.255
  439   HG13  VAL  57          3HG1      VAL  57  10.537   0.958   0.520
  440   HG21  VAL  57          3HG2      VAL  57   6.143   1.201   0.561
  441   HG22  VAL  57          1HG2      VAL  57   7.057   2.712   0.614
  442   HG23  VAL  57          2HG2      VAL  57   7.125   1.589   1.962
  443    H    ALA  58           H        ALA  58   8.973  -1.495  -1.521
  444    HA   ALA  58           HA       ALA  58  11.750  -1.153  -2.045
  445    HB1  ALA  58           1HB      ALA  58  11.717  -3.640  -2.525
  446    HB2  ALA  58           2HB      ALA  58   9.951  -3.594  -2.596
  447    HB3  ALA  58           3HB      ALA  58  10.773  -3.265  -1.072
  448    H    ALA  59           H        ALA  59   8.946  -1.674  -4.223
  449    HA   ALA  59           HA       ALA  59  10.445  -1.909  -6.682
  450    HB1  ALA  59           1HB      ALA  59   7.458  -1.308  -6.184
  451    HB2  ALA  59           2HB      ALA  59   8.149  -2.918  -6.393
  452    HB3  ALA  59           3HB      ALA  59   8.149  -1.783  -7.747
  453    H    ALA  60           H        ALA  60   8.600   0.732  -5.072
  454    HA   ALA  60           HA       ALA  60   8.832   2.726  -7.122
  455    HB1  ALA  60           1HB      ALA  60   7.101   2.904  -5.316
  456    HB2  ALA  60           2HB      ALA  60   8.130   4.340  -5.266
  457    HB3  ALA  60           3HB      ALA  60   8.363   3.040  -4.083
  458    H    ARG  61           H        ARG  61  10.739   1.993  -4.200
  459    HA   ARG  61           HA       ARG  61  12.509   4.229  -4.478
  460    HB2  ARG  61           1HB      ARG  61  12.132   3.058  -2.260
  461    HB3  ARG  61           2HB      ARG  61  12.895   1.592  -2.883
  462    HG2  ARG  61           1HG      ARG  61  15.095   2.815  -3.133
  463    HG3  ARG  61           2HG      ARG  61  14.341   4.316  -2.589
  464    HD2  ARG  61           1HD      ARG  61  13.872   3.265  -0.347
  465    HD3  ARG  61           2HD      ARG  61  14.633   1.751  -0.909
  466    HE   ARG  61           HE       ARG  61  16.503   3.835  -1.319
  467   HH11  ARG  61          1HH2      ARG  61  14.867   2.271   1.291
  468   HH12  ARG  61          2HH2      ARG  61  16.130   2.554   2.440
  469   HH21  ARG  61          1HH1      ARG  61  18.152   4.221   0.151
  470   HH22  ARG  61          2HH1      ARG  61  18.011   3.671   1.785
  Start of MODEL    7
    1    H    ILE   5           H        ILE   5 -12.470 -10.030 -12.254
    2    HA   ILE   5           HA       ILE   5 -11.245  -9.312 -14.004
    3    HB   ILE   5           HB       ILE   5 -12.860  -6.666 -13.710
    4   HG12  ILE   5          1HG1      ILE   5 -14.499  -8.560 -13.678
    5   HG13  ILE   5          2HG1      ILE   5 -14.618  -7.766 -15.223
    6   HG21  ILE   5          1HG2      ILE   5 -11.432  -7.946 -16.143
    7   HG22  ILE   5          2HG2      ILE   5 -11.158  -6.356 -15.439
    8   HG23  ILE   5          3HG2      ILE   5 -12.637  -6.676 -16.315
    9   HD11  ILE   5          3HD1      ILE   5 -14.684 -10.029 -15.802
   10   HD12  ILE   5          1HD1      ILE   5 -13.536 -10.501 -14.561
   11   HD13  ILE   5          2HD1      ILE   5 -12.979  -9.707 -16.039
   12    H    MET   6           H        MET   6 -10.240  -9.057 -11.345
   13    HA   MET   6           HA       MET   6  -8.634  -8.011  -9.974
   14    HB2  MET   6           1HB      MET   6  -7.580  -7.420 -12.829
   15    HB3  MET   6           2HB      MET   6  -6.594  -7.236 -11.370
   16    HG2  MET   6           1HG      MET   6  -6.875  -9.692 -10.854
   17    HG3  MET   6           2HG      MET   6  -7.877  -9.879 -12.306
   18    HE1  MET   6           3HE      MET   6  -5.577 -11.758 -11.839
   19    HE2  MET   6           1HE      MET   6  -4.656 -11.750 -13.351
   20    HE3  MET   6           2HE      MET   6  -6.415 -11.748 -13.391
   21    H    GLN   7           H        GLN   7 -11.006  -6.349 -11.088
   22    HA   GLN   7           HA       GLN   7 -10.204  -3.679 -11.602
   23    HB2  GLN   7           1HB      GLN   7 -12.549  -4.650 -12.033
   24    HB3  GLN   7           2HB      GLN   7 -12.849  -4.652 -10.285
   25    HG2  GLN   7           1HG      GLN   7 -12.525  -2.121 -10.241
   26    HG3  GLN   7           2HG      GLN   7 -12.247  -2.133 -11.982
   27   HE21  GLN   7          1HE2      GLN   7 -14.341  -0.613 -10.752
   28   HE22  GLN   7          2HE2      GLN   7 -15.838  -1.251 -11.254
   29    H    ALA   8           H        ALA   8 -11.246  -5.265  -8.556
   30    HA   ALA   8           HA       ALA   8 -10.994  -3.039  -6.808
   31    HB1  ALA   8           1HB      ALA   8 -10.927  -4.781  -4.978
   32    HB2  ALA   8           2HB      ALA   8 -10.652  -6.046  -6.193
   33    HB3  ALA   8           3HB      ALA   8 -12.180  -5.166  -6.171
   34    H    LYS   9           H        LYS   9  -8.713  -5.669  -7.675
   35    HA   LYS   9           HA       LYS   9  -6.589  -4.732  -6.029
   36    HB2  LYS   9           1HB      LYS   9  -6.918  -7.110  -7.190
   37    HB3  LYS   9           2HB      LYS   9  -6.189  -6.383  -8.626
   38    HG2  LYS   9           1HG      LYS   9  -4.097  -5.831  -7.336
   39    HG3  LYS   9           2HG      LYS   9  -4.826  -6.453  -5.842
   40    HD2  LYS   9           1HD      LYS   9  -4.978  -8.783  -6.919
   41    HD3  LYS   9           2HD      LYS   9  -4.140  -8.140  -8.347
   42    HE2  LYS   9           1HE      LYS   9  -2.935  -8.116  -5.495
   43    HE3  LYS   9           2HE      LYS   9  -2.546  -9.313  -6.739
   44    HZ1  LYS   9           3HZ      LYS   9  -2.318  -6.823  -7.914
   45    HZ2  LYS   9           1HZ      LYS   9  -1.071  -7.902  -7.522
   46    HZ3  LYS   9           2HZ      LYS   9  -1.539  -6.710  -6.407
   47    H    GLU  10           H        GLU  10  -7.382  -4.125  -9.455
   48    HA   GLU  10           HA       GLU  10  -5.025  -2.644 -10.130
   49    HB2  GLU  10           1HB      GLU  10  -6.651  -3.618 -11.846
   50    HB3  GLU  10           2HB      GLU  10  -7.867  -2.452 -11.348
   51    HG2  GLU  10           1HG      GLU  10  -6.739  -1.619 -13.407
   52    HG3  GLU  10           2HG      GLU  10  -6.311  -0.547 -12.096
   53    H    ASP  11           H        ASP  11  -8.197  -1.751  -8.812
   54    HA   ASP  11           HA       ASP  11  -7.969   1.112  -8.893
   55    HB2  ASP  11           1HB      ASP  11  -9.630  -0.716  -7.045
   56    HB3  ASP  11           2HB      ASP  11  -9.766   1.042  -7.015
   57    H    PHE  12           H        PHE  12  -6.970  -1.304  -6.504
   58    HA   PHE  12           HA       PHE  12  -6.170   0.509  -4.419
   59    HB2  PHE  12           1HB      PHE  12  -6.475  -2.004  -4.103
   60    HB3  PHE  12           2HB      PHE  12  -5.067  -2.279  -5.107
   61    HD1  PHE  12           2HD      PHE  12  -6.186  -0.544  -1.958
   62    HD2  PHE  12           1HD      PHE  12  -2.765  -2.118  -4.128
   63    HE1  PHE  12           2HE      PHE  12  -4.717  -0.077  -0.030
   64    HE2  PHE  12           1HE      PHE  12  -1.334  -1.631  -2.159
   65    HZ   PHE  12           HZ       PHE  12  -2.291  -0.609  -0.105
   66    H    LYS  13           H        LYS  13  -4.232  -1.044  -7.060
   67    HA   LYS  13           HA       LYS  13  -1.731   0.197  -6.480
   68    HB2  LYS  13           1HB      LYS  13  -2.888  -0.970  -9.087
   69    HB3  LYS  13           2HB      LYS  13  -1.199  -0.438  -8.933
   70    HG2  LYS  13           1HG      LYS  13  -0.862  -2.073  -7.030
   71    HG3  LYS  13           2HG      LYS  13  -2.547  -2.608  -7.204
   72    HD2  LYS  13           1HD      LYS  13  -2.054  -3.423  -9.553
   73    HD3  LYS  13           2HD      LYS  13  -0.368  -2.867  -9.398
   74    HE2  LYS  13           1HE      LYS  13  -1.643  -4.961  -7.540
   75    HE3  LYS  13           2HE      LYS  13  -0.607  -5.358  -8.915
   76    HZ1  LYS  13           3HZ      LYS  13   0.714  -3.411  -7.461
   77    HZ2  LYS  13           1HZ      LYS  13   1.111  -5.056  -7.574
   78    HZ3  LYS  13           2HZ      LYS  13   0.116  -4.511  -6.313
   79    H    LYS  14           H        LYS  14  -4.381   1.053  -8.595
   80    HA   LYS  14           HA       LYS  14  -3.223   3.207  -9.960
   81    HB2  LYS  14           1HB      LYS  14  -5.463   2.148 -10.566
   82    HB3  LYS  14           2HB      LYS  14  -6.200   2.924  -9.149
   83    HG2  LYS  14           1HG      LYS  14  -5.606   5.217 -10.072
   84    HG3  LYS  14           2HG      LYS  14  -4.823   4.458 -11.475
   85    HD2  LYS  14           1HD      LYS  14  -7.053   3.475 -12.172
   86    HD3  LYS  14           2HD      LYS  14  -7.826   4.250 -10.777
   87    HE2  LYS  14           1HE      LYS  14  -7.201   6.524 -11.676
   88    HE3  LYS  14           2HE      LYS  14  -6.399   5.761 -13.067
   89    HZ1  LYS  14           3HZ      LYS  14  -8.879   4.618 -12.967
   90    HZ2  LYS  14           1HZ      LYS  14  -8.363   5.819 -14.045
   91    HZ3  LYS  14           2HZ      LYS  14  -9.167   6.254 -12.611
   92    H    MET  15           H        MET  15  -4.918   3.025  -6.830
   93    HA   MET  15           HA       MET  15  -4.862   5.850  -6.329
   94    HB2  MET  15           1HB      MET  15  -6.413   4.101  -5.158
   95    HB3  MET  15           2HB      MET  15  -5.005   3.600  -4.208
   96    HG2  MET  15           1HG      MET  15  -6.216   5.270  -2.853
   97    HG3  MET  15           2HG      MET  15  -4.791   6.076  -3.400
   98    HE1  MET  15           3HE      MET  15  -5.977   8.386  -2.795
   99    HE2  MET  15           1HE      MET  15  -7.450   7.525  -2.302
  100    HE3  MET  15           2HE      MET  15  -7.546   8.881  -3.421
  101    H    MET  16           H        MET  16  -2.703   3.141  -5.358
  102    HA   MET  16           HA       MET  16  -0.982   4.550  -3.591
  103    HB2  MET  16           1HB      MET  16  -0.375   2.126  -5.410
  104    HB3  MET  16           2HB      MET  16   0.643   2.622  -4.060
  105    HG2  MET  16           1HG      MET  16  -2.103   2.259  -3.044
  106    HG3  MET  16           2HG      MET  16  -1.668   0.851  -3.983
  107    HE1  MET  16           3HE      MET  16  -1.346   2.511  -0.553
  108    HE2  MET  16           1HE      MET  16  -0.098   3.374  -1.441
  109    HE3  MET  16           2HE      MET  16   0.333   2.324  -0.111
  110    H    GLU  17           H        GLU  17  -0.601   4.025  -7.112
  111    HA   GLU  17           HA       GLU  17   1.976   5.297  -7.301
  112    HB2  GLU  17           1HB      GLU  17   1.674   5.045  -9.750
  113    HB3  GLU  17           2HB      GLU  17   1.080   3.576  -8.950
  114    HG2  GLU  17           1HG      GLU  17  -1.269   4.601  -9.100
  115    HG3  GLU  17           2HG      GLU  17  -0.604   5.867 -10.095
  116    H    GLU  18           H        GLU  18  -1.408   6.392  -7.662
  117    HA   GLU  18           HA       GLU  18  -0.776   9.131  -8.497
  118    HB2  GLU  18           1HB      GLU  18  -3.422   7.772  -7.617
  119    HB3  GLU  18           2HB      GLU  18  -3.336   9.467  -8.144
  120    HG2  GLU  18           1HG      GLU  18  -2.519   8.738 -10.404
  121    HG3  GLU  18           2HG      GLU  18  -2.554   7.078  -9.900
  122    H    ALA  19           H        ALA  19  -1.131   7.457  -5.448
  123    HA   ALA  19           HA       ALA  19  -1.736   9.883  -3.883
  124    HB1  ALA  19           1HB      ALA  19  -1.284   6.968  -3.017
  125    HB2  ALA  19           2HB      ALA  19  -2.836   7.790  -3.169
  126    HB3  ALA  19           3HB      ALA  19  -1.721   8.279  -1.904
  127    H    LYS  20           H        LYS  20   0.942   8.884  -5.443
  128    HA   LYS  20           HA       LYS  20   3.097   8.237  -4.218
  129    HB2  LYS  20           1HB      LYS  20   3.049   9.622  -6.424
  130    HB3  LYS  20           2HB      LYS  20   3.139  11.073  -5.442
  131    HG2  LYS  20           1HG      LYS  20   5.463  10.729  -5.965
  132    HG3  LYS  20           2HG      LYS  20   5.366   9.964  -4.383
  133    HD2  LYS  20           1HD      LYS  20   5.046   7.697  -5.563
  134    HD3  LYS  20           2HD      LYS  20   5.266   8.510  -7.106
  135    HE2  LYS  20           1HE      LYS  20   7.599   9.216  -6.389
  136    HE3  LYS  20           2HE      LYS  20   7.371   8.330  -4.860
  137    HZ1  LYS  20           3HZ      LYS  20   6.638   6.503  -6.704
  138    HZ2  LYS  20           1HZ      LYS  20   8.182   6.600  -6.005
  139    HZ3  LYS  20           2HZ      LYS  20   7.889   7.313  -7.520
  140    H    PHE  21           H        PHE  21   3.844   8.375  -2.184
  141    HA   PHE  21           HA       PHE  21   3.618  10.921  -0.667
  142    HB2  PHE  21           1HB      PHE  21   2.819   9.614   1.315
  143    HB3  PHE  21           2HB      PHE  21   1.695   9.462  -0.034
  144    HD1  PHE  21           1HD      PHE  21   1.738   7.302  -1.510
  145    HD2  PHE  21           2HD      PHE  21   3.990   7.578   2.165
  146    HE1  PHE  21           1HE      PHE  21   2.034   4.831  -1.503
  147    HE2  PHE  21           2HE      PHE  21   4.291   5.106   2.162
  148    HZ   PHE  21           HZ       PHE  21   3.314   3.716   0.329
  149    H    ASN  22           H        ASN  22   4.923  10.617   1.466
  150    HA   ASN  22           HA       ASN  22   7.595  10.385   0.930
  151    HB2  ASN  22           1HB      ASN  22   6.153  10.024   3.569
  152    HB3  ASN  22           2HB      ASN  22   7.900  10.231   3.464
  153   HD21  ASN  22          1HD2      ASN  22   8.456  12.221   1.905
  154   HD22  ASN  22          2HD2      ASN  22   7.593  13.645   2.228
  155    HA   PRO  23           HA       PRO  23   7.940   5.773   0.453
  156    HB2  PRO  23           1HB      PRO  23  10.657   5.564   0.028
  157    HB3  PRO  23           2HB      PRO  23   9.550   6.200  -1.220
  158    HG2  PRO  23           1HG      PRO  23  11.339   7.724   0.687
  159    HG3  PRO  23           2HG      PRO  23  11.058   7.996  -1.052
  160    HD2  PRO  23           1HD      PRO  23   9.784   9.500   0.891
  161    HD3  PRO  23           2HD      PRO  23   8.996   9.126  -0.693
  162    H    ARG  24           H        ARG  24   9.432   7.675   2.942
  163    HA   ARG  24           HA       ARG  24  10.423   5.366   4.493
  164    HB2  ARG  24           1HB      ARG  24  10.464   8.406   5.057
  165    HB3  ARG  24           2HB      ARG  24  11.257   7.193   6.091
  166    HG2  ARG  24           1HG      ARG  24  12.771   6.520   4.196
  167    HG3  ARG  24           2HG      ARG  24  11.949   7.652   3.109
  168    HD2  ARG  24           1HD      ARG  24  14.059   8.667   3.933
  169    HD3  ARG  24           2HD      ARG  24  12.682   9.591   4.572
  170    HE   ARG  24           HE       ARG  24  13.405   7.488   6.387
  171   HH11  ARG  24          1HH2      ARG  24  14.459  10.596   5.256
  172   HH12  ARG  24          2HH2      ARG  24  15.301  10.989   6.716
  173   HH21  ARG  24          1HH1      ARG  24  14.488   8.010   8.301
  174   HH22  ARG  24          2HH1      ARG  24  15.319   9.522   8.445
  175    H    ALA  25           H        ALA  25   7.465   6.826   4.101
  176    HA   ALA  25           HA       ALA  25   6.501   6.775   6.839
  177    HB1  ALA  25           1HB      ALA  25   5.363   8.134   5.049
  178    HB2  ALA  25           2HB      ALA  25   4.236   6.981   5.758
  179    HB3  ALA  25           3HB      ALA  25   4.964   6.660   4.181
  180    H    THR  26           H        THR  26   5.114   5.207   7.703
  181    HA   THR  26           HA       THR  26   5.705   2.428   6.857
  182    HB   THR  26           HB       THR  26   4.995   1.839   9.180
  183    HG1  THR  26           1HG      THR  26   3.561   3.144   9.965
  184   HG21  THR  26          3HG2      THR  26   6.824   4.313   9.308
  185   HG22  THR  26          1HG2      THR  26   7.393   2.703   8.838
  186   HG23  THR  26          2HG2      THR  26   6.768   2.992  10.469
  187    H    PHE  27           H        PHE  27   3.886   0.906   7.139
  188    HA   PHE  27           HA       PHE  27   1.623   1.583   5.558
  189    HB2  PHE  27           1HB      PHE  27   2.424  -0.767   5.712
  190    HB3  PHE  27           2HB      PHE  27   2.173  -0.783   7.451
  191    HD1  PHE  27           1HD      PHE  27   0.240  -0.088   4.251
  192    HD2  PHE  27           2HD      PHE  27   0.014  -1.677   8.281
  193    HE1  PHE  27           1HE      PHE  27  -2.127  -0.660   3.883
  194    HE2  PHE  27           2HE      PHE  27  -2.377  -2.272   7.888
  195    HZ   PHE  27           HZ       PHE  27  -3.455  -1.763   5.692
  196    H    SER  28           H        SER  28   2.024   1.251   9.105
  197    HA   SER  28           HA       SER  28  -0.689   1.564   9.908
  198    HB2  SER  28           1HB      SER  28   0.297   2.188  12.139
  199    HB3  SER  28           2HB      SER  28   1.146   0.799  11.457
  200    HG   SER  28           HG       SER  28   2.888   1.963  11.341
  201    H    GLU  29           H        GLU  29   1.823   3.988   9.223
  202    HA   GLU  29           HA       GLU  29   0.235   6.255  10.025
  203    HB2  GLU  29           1HB      GLU  29   2.783   6.307   9.922
  204    HB3  GLU  29           2HB      GLU  29   2.720   6.073   8.167
  205    HG2  GLU  29           1HG      GLU  29   1.508   8.251   7.922
  206    HG3  GLU  29           2HG      GLU  29   1.509   8.503   9.658
  207    H    PHE  30           H        PHE  30   0.986   4.703   6.868
  208    HA   PHE  30           HA       PHE  30  -0.487   6.529   5.203
  209    HB2  PHE  30           1HB      PHE  30   1.312   4.892   4.411
  210    HB3  PHE  30           2HB      PHE  30   0.191   3.567   4.682
  211    HD1  PHE  30           1HD      PHE  30   0.830   6.640   2.594
  212    HD2  PHE  30           2HD      PHE  30  -1.827   3.242   3.167
  213    HE1  PHE  30           1HE      PHE  30  -0.329   7.165   0.458
  214    HE2  PHE  30           2HE      PHE  30  -2.960   3.783   1.019
  215    HZ   PHE  30           HZ       PHE  30  -2.220   5.742  -0.340
  216    H    ALA  31           H        ALA  31  -1.353   3.386   6.694
  217    HA   ALA  31           HA       ALA  31  -3.982   3.125   5.597
  218    HB1  ALA  31           1HB      ALA  31  -2.782   1.960   8.196
  219    HB2  ALA  31           2HB      ALA  31  -2.680   1.215   6.606
  220    HB3  ALA  31           3HB      ALA  31  -4.247   1.372   7.403
  221    H    ALA  32           H        ALA  32  -2.725   4.599   8.610
  222    HA   ALA  32           HA       ALA  32  -5.190   5.180   9.960
  223    HB1  ALA  32           1HB      ALA  32  -2.529   6.728   9.976
  224    HB2  ALA  32           2HB      ALA  32  -2.975   5.450  11.101
  225    HB3  ALA  32           3HB      ALA  32  -3.843   6.986  11.128
  226    H    LYS  33           H        LYS  33  -3.416   6.938   7.428
  227    HA   LYS  33           HA       LYS  33  -5.196   9.238   7.450
  228    HB2  LYS  33           1HB      LYS  33  -2.772   9.317   6.593
  229    HB3  LYS  33           2HB      LYS  33  -3.248   8.296   5.223
  230    HG2  LYS  33           1HG      LYS  33  -4.899  10.064   4.442
  231    HG3  LYS  33           2HG      LYS  33  -4.481  11.081   5.840
  232    HD2  LYS  33           1HD      LYS  33  -2.096  11.252   4.981
  233    HD3  LYS  33           2HD      LYS  33  -2.538  10.255   3.582
  234    HE2  LYS  33           1HE      LYS  33  -4.194  12.006   2.839
  235    HE3  LYS  33           2HE      LYS  33  -3.783  13.003   4.253
  236    HZ1  LYS  33           3HZ      LYS  33  -1.629  13.328   3.474
  237    HZ2  LYS  33           1HZ      LYS  33  -2.603  13.513   2.100
  238    HZ3  LYS  33           2HZ      LYS  33  -1.735  12.071   2.335
  239    H    HIS  34           H        HIS  34  -4.967   6.271   5.400
  240    HA   HIS  34           HA       HIS  34  -7.378   7.068   3.866
  241    HB2  HIS  34           1HB      HIS  34  -5.368   4.752   3.542
  242    HB3  HIS  34           2HB      HIS  34  -6.764   4.974   2.473
  243    HD2  HIS  34           2HD      HIS  34  -6.504   7.136   0.626
  244    HE1  HIS  34           1HE      HIS  34  -2.632   8.327   1.802
  245    HE2  HIS  34           2HE      HIS  34  -4.462   8.662   0.077
  246    H    ALA  35           H        ALA  35  -6.862   5.635   6.787
  247    HA   ALA  35           HA       ALA  35  -8.189   3.193   6.895
  248    HB1  ALA  35           1HB      ALA  35  -8.062   5.490   8.938
  249    HB2  ALA  35           2HB      ALA  35  -7.180   3.966   8.982
  250    HB3  ALA  35           3HB      ALA  35  -8.891   3.979   9.330
  251    H    LYS  36           H        LYS  36  -9.621   6.459   6.742
  252    HA   LYS  36           HA       LYS  36 -12.336   5.563   7.126
  253    HB2  LYS  36           1HB      LYS  36 -11.134   8.246   6.097
  254    HB3  LYS  36           2HB      LYS  36 -12.854   8.032   6.505
  255    HG2  LYS  36           1HG      LYS  36 -12.217   7.491   8.892
  256    HG3  LYS  36           2HG      LYS  36 -10.502   7.708   8.491
  257    HD2  LYS  36           1HD      LYS  36 -10.950  10.146   7.878
  258    HD3  LYS  36           2HD      LYS  36 -12.661   9.928   8.320
  259    HE2  LYS  36           1HE      LYS  36 -10.279   9.606  10.263
  260    HE3  LYS  36           2HE      LYS  36 -11.412  10.967  10.232
  261    HZ1  LYS  36           3HZ      LYS  36 -12.212   9.517  11.861
  262    HZ2  LYS  36           1HZ      LYS  36 -11.957   8.140  10.907
  263    HZ3  LYS  36           2HZ      LYS  36 -13.204   9.226  10.516
  264    H    ASP  37           H        ASP  37 -10.184   5.495   4.488
  265    HA   ASP  37           HA       ASP  37 -12.004   6.001   2.325
  266    HB2  ASP  37           1HB      ASP  37  -9.385   5.914   2.206
  267    HB3  ASP  37           2HB      ASP  37  -9.539   4.162   2.145
  268    H    SER  38           H        SER  38 -13.346   4.550   1.233
  269    HA   SER  38           HA       SER  38 -14.418   2.308   2.632
  270    HB2  SER  38           1HB      SER  38 -15.732   3.681   1.032
  271    HB3  SER  38           2HB      SER  38 -14.723   3.121  -0.302
  272    HG   SER  38           HG       SER  38 -16.734   1.830   1.114
  273    H    ARG  39           H        ARG  39 -11.782   2.609   0.438
  274    HA   ARG  39           HA       ARG  39 -11.612  -0.087  -0.601
  275    HB2  ARG  39           1HB      ARG  39  -9.604   2.240  -0.363
  276    HB3  ARG  39           2HB      ARG  39  -9.193   0.707  -1.140
  277    HG2  ARG  39           1HG      ARG  39 -10.917   1.036  -2.880
  278    HG3  ARG  39           2HG      ARG  39 -11.576   2.457  -2.038
  279    HD2  ARG  39           1HD      ARG  39  -9.953   2.914  -4.060
  280    HD3  ARG  39           2HD      ARG  39  -9.656   3.831  -2.588
  281    HE   ARG  39           HE       ARG  39  -8.088   1.472  -3.553
  282   HH11  ARG  39          1HH2      ARG  39  -8.347   4.139  -1.242
  283   HH12  ARG  39          2HH2      ARG  39  -6.686   4.041  -0.771
  284   HH21  ARG  39          1HH1      ARG  39  -5.935   1.362  -2.800
  285   HH22  ARG  39          2HH1      ARG  39  -5.351   2.490  -1.638
  286    H    PHE  40           H        PHE  40 -10.663   1.444   2.396
  287    HA   PHE  40           HA       PHE  40  -8.613  -0.439   3.106
  288    HB2  PHE  40           1HB      PHE  40  -8.723   1.845   4.172
  289    HB3  PHE  40           2HB      PHE  40 -10.296   1.476   4.867
  290    HD1  PHE  40           2HD      PHE  40  -6.671   0.440   4.918
  291    HD2  PHE  40           1HD      PHE  40 -10.481   0.160   6.995
  292    HE1  PHE  40           2HE      PHE  40  -5.570  -0.713   6.814
  293    HE2  PHE  40           1HE      PHE  40  -9.348  -0.995   8.889
  294    HZ   PHE  40           HZ       PHE  40  -6.887  -1.434   8.800
  295    H    LYS  41           H        LYS  41 -12.011  -0.069   4.202
  296    HA   LYS  41           HA       LYS  41 -12.071  -2.486   5.782
  297    HB2  LYS  41           1HB      LYS  41 -14.462  -1.945   6.181
  298    HB3  LYS  41           2HB      LYS  41 -13.575  -0.404   6.176
  299    HG2  LYS  41           1HG      LYS  41 -14.253  -0.027   3.758
  300    HG3  LYS  41           2HG      LYS  41 -15.145  -1.547   3.748
  301    HD2  LYS  41           1HD      LYS  41 -16.663  -0.648   5.575
  302    HD3  LYS  41           2HD      LYS  41 -15.806   0.896   5.495
  303    HE2  LYS  41           1HE      LYS  41 -16.529   1.175   3.084
  304    HE3  LYS  41           2HE      LYS  41 -17.365  -0.380   3.142
  305    HZ1  LYS  41           3HZ      LYS  41 -18.207   2.165   4.092
  306    HZ2  LYS  41           1HZ      LYS  41 -18.247   1.009   5.334
  307    HZ3  LYS  41           2HZ      LYS  41 -19.101   0.733   3.892
  308    H    ALA  42           H        ALA  42 -12.370  -1.869   2.404
  309    HA   ALA  42           HA       ALA  42 -14.218  -3.922   1.563
  310    HB1  ALA  42           1HB      ALA  42 -11.839  -2.648   0.059
  311    HB2  ALA  42           2HB      ALA  42 -13.478  -2.004   0.050
  312    HB3  ALA  42           3HB      ALA  42 -13.137  -3.567  -0.697
  313    H    ILE  43           H        ILE  43 -10.769  -3.901   2.326
  314    HA   ILE  43           HA       ILE  43 -10.506  -6.779   1.576
  315    HB   ILE  43           HB       ILE  43  -8.318  -4.971   2.768
  316   HG12  ILE  43          1HG1      ILE  43  -9.118  -3.720   0.776
  317   HG13  ILE  43          2HG1      ILE  43  -7.587  -4.440   0.361
  318   HG21  ILE  43          1HG2      ILE  43  -6.771  -6.581   1.614
  319   HG22  ILE  43          2HG2      ILE  43  -8.140  -7.463   0.950
  320   HG23  ILE  43          3HG2      ILE  43  -7.867  -7.448   2.685
  321   HD11  ILE  43          3HD1      ILE  43  -9.077  -6.376  -0.690
  322   HD12  ILE  43          1HD1      ILE  43  -8.908  -4.837  -1.530
  323   HD13  ILE  43          2HD1      ILE  43 -10.355  -5.167  -0.596
  324    H    GLU  44           H        GLU  44 -10.965  -8.221   3.064
  325    HA   GLU  44           HA       GLU  44 -11.526  -7.678   5.835
  326    HB2  GLU  44           1HB      GLU  44 -11.216 -10.307   4.219
  327    HB3  GLU  44           2HB      GLU  44 -11.780 -10.258   5.889
  328    HG2  GLU  44           1HG      GLU  44 -13.785 -10.368   4.481
  329    HG3  GLU  44           2HG      GLU  44 -13.730  -8.727   5.112
  330    H    LYS  45           H        LYS  45  -8.812  -9.238   4.067
  331    HA   LYS  45           HA       LYS  45  -7.224  -9.646   6.536
  332    HB2  LYS  45           1HB      LYS  45  -6.764 -10.493   3.599
  333    HB3  LYS  45           2HB      LYS  45  -5.664 -10.896   4.943
  334    HG2  LYS  45           1HG      LYS  45  -7.560 -12.134   6.114
  335    HG3  LYS  45           2HG      LYS  45  -8.642 -11.757   4.755
  336    HD2  LYS  45           1HD      LYS  45  -7.131 -13.055   3.190
  337    HD3  LYS  45           2HD      LYS  45  -6.044 -13.428   4.537
  338    HE2  LYS  45           1HE      LYS  45  -7.895 -14.699   5.688
  339    HE3  LYS  45           2HE      LYS  45  -8.989 -14.328   4.334
  340    HZ1  LYS  45           3HZ      LYS  45  -6.378 -15.543   3.748
  341    HZ2  LYS  45           1HZ      LYS  45  -7.853 -15.696   2.922
  342    HZ3  LYS  45           2HZ      LYS  45  -7.607 -16.531   4.382
  343    H    MET  46           H        MET  46  -6.200  -7.885   7.187
  344    HA   MET  46           HA       MET  46  -5.248  -5.760   5.500
  345    HB2  MET  46           1HB      MET  46  -4.746  -6.454   8.463
  346    HB3  MET  46           2HB      MET  46  -4.215  -4.947   7.698
  347    HG2  MET  46           1HG      MET  46  -6.308  -4.360   8.770
  348    HG3  MET  46           2HG      MET  46  -6.751  -4.548   7.082
  349    HE1  MET  46           3HE      MET  46  -9.924  -5.870   8.953
  350    HE2  MET  46           1HE      MET  46  -9.304  -4.802   7.683
  351    HE3  MET  46           2HE      MET  46  -8.882  -4.515   9.375
  352    H    LYS  47           H        LYS  47  -4.091  -8.867   6.181
  353    HA   LYS  47           HA       LYS  47  -1.270  -8.471   6.312
  354    HB2  LYS  47           1HB      LYS  47  -2.953 -10.886   5.352
  355    HB3  LYS  47           2HB      LYS  47  -1.190 -10.955   5.592
  356    HG2  LYS  47           1HG      LYS  47  -1.509 -10.329   8.036
  357    HG3  LYS  47           2HG      LYS  47  -3.267 -10.291   7.789
  358    HD2  LYS  47           1HD      LYS  47  -3.254 -12.753   7.197
  359    HD3  LYS  47           2HD      LYS  47  -1.486 -12.804   7.391
  360    HE2  LYS  47           1HE      LYS  47  -2.620 -13.664   9.467
  361    HE3  LYS  47           2HE      LYS  47  -1.757 -12.167   9.846
  362    HZ1  LYS  47           3HZ      LYS  47  -4.481 -11.838   8.911
  363    HZ2  LYS  47           1HZ      LYS  47  -3.656 -11.055  10.167
  364    HZ3  LYS  47           2HZ      LYS  47  -4.322 -12.599  10.420
  365    H    ASP  48           H        ASP  48  -3.547  -8.969   3.612
  366    HA   ASP  48           HA       ASP  48  -1.580  -9.184   1.544
  367    HB2  ASP  48           1HB      ASP  48  -3.973  -9.947   1.236
  368    HB3  ASP  48           2HB      ASP  48  -4.531  -8.283   1.376
  369    H    ARG  49           H        ARG  49  -3.263  -6.459   3.041
  370    HA   ARG  49           HA       ARG  49  -2.486  -4.411   1.184
  371    HB2  ARG  49           1HB      ARG  49  -3.213  -4.251   4.176
  372    HB3  ARG  49           2HB      ARG  49  -2.983  -2.842   3.145
  373    HG2  ARG  49           1HG      ARG  49  -4.876  -3.591   1.653
  374    HG3  ARG  49           2HG      ARG  49  -5.099  -5.022   2.687
  375    HD2  ARG  49           1HD      ARG  49  -6.749  -3.262   3.327
  376    HD3  ARG  49           2HD      ARG  49  -5.629  -3.471   4.644
  377    HE   ARG  49           HE       ARG  49  -4.783  -1.353   4.261
  378   HH11  ARG  49          1HH2      ARG  49  -6.710  -2.323   1.494
  379   HH12  ARG  49          2HH2      ARG  49  -6.703  -0.742   0.784
  380   HH21  ARG  49          1HH1      ARG  49  -4.753   0.675   3.282
  381   HH22  ARG  49          2HH1      ARG  49  -5.597   0.946   1.797
  382    H    GLU  50           H        GLU  50  -1.037  -5.689   4.201
  383    HA   GLU  50           HA       GLU  50   1.157  -3.854   4.404
  384    HB2  GLU  50           1HB      GLU  50   0.386  -5.402   6.287
  385    HB3  GLU  50           2HB      GLU  50   1.040  -6.787   5.401
  386    HG2  GLU  50           1HG      GLU  50   3.369  -5.763   5.519
  387    HG3  GLU  50           2HG      GLU  50   2.719  -4.369   6.383
  388    H    ALA  51           H        ALA  51   0.833  -7.083   2.821
  389    HA   ALA  51           HA       ALA  51   3.500  -7.479   1.957
  390    HB1  ALA  51           1HB      ALA  51   1.729  -9.254   1.864
  391    HB2  ALA  51           2HB      ALA  51   2.478  -9.051   0.273
  392    HB3  ALA  51           3HB      ALA  51   0.883  -8.361   0.595
  393    H    LEU  52           H        LEU  52   0.743  -5.925   0.268
  394    HA   LEU  52           HA       LEU  52   2.081  -5.185  -2.137
  395    HB2  LEU  52           1HB      LEU  52  -0.432  -4.123  -0.730
  396    HB3  LEU  52           2HB      LEU  52   0.045  -3.568  -2.329
  397    HG   LEU  52           HG       LEU  52  -0.464  -6.544  -1.725
  398   HD11  LEU  52          1HD1      LEU  52  -2.594  -5.390  -1.295
  399   HD12  LEU  52          2HD1      LEU  52  -2.723  -6.217  -2.841
  400   HD13  LEU  52          3HD1      LEU  52  -2.462  -4.467  -2.804
  401   HD21  LEU  52          3HD2      LEU  52   0.886  -6.168  -3.786
  402   HD22  LEU  52          1HD2      LEU  52  -0.284  -4.999  -4.392
  403   HD23  LEU  52          2HD2      LEU  52  -0.705  -6.702  -4.240
  404    H    PHE  53           H        PHE  53   1.456  -3.447   0.898
  405    HA   PHE  53           HA       PHE  53   2.481  -0.887   0.181
  406    HB2  PHE  53           1HB      PHE  53   1.131  -1.421   2.270
  407    HB3  PHE  53           2HB      PHE  53   2.507  -2.273   2.932
  408    HD1  PHE  53           1HD      PHE  53   1.224   1.105   1.958
  409    HD2  PHE  53           2HD      PHE  53   4.571  -1.022   3.728
  410    HE1  PHE  53           1HE      PHE  53   2.233   3.252   2.655
  411    HE2  PHE  53           2HE      PHE  53   5.555   1.146   4.441
  412    HZ   PHE  53           HZ       PHE  53   4.387   3.278   3.900
  413    H    ASN  54           H        ASN  54   4.060  -3.683   1.734
  414    HA   ASN  54           HA       ASN  54   6.684  -2.566   2.003
  415    HB2  ASN  54           1HB      ASN  54   5.730  -5.493   1.725
  416    HB3  ASN  54           2HB      ASN  54   7.403  -5.058   2.106
  417   HD21  ASN  54          1HD2      ASN  54   5.793  -6.608   3.910
  418   HD22  ASN  54          2HD2      ASN  54   5.517  -5.679   5.306
  419    H    GLU  55           H        GLU  55   5.093  -4.434  -0.601
  420    HA   GLU  55           HA       GLU  55   7.399  -4.665  -2.297
  421    HB2  GLU  55           1HB      GLU  55   5.135  -6.048  -2.449
  422    HB3  GLU  55           2HB      GLU  55   4.475  -4.667  -3.309
  423    HG2  GLU  55           1HG      GLU  55   5.302  -6.227  -5.029
  424    HG3  GLU  55           2HG      GLU  55   6.426  -4.885  -5.024
  425    H    PHE  56           H        PHE  56   4.694  -2.332  -2.105
  426    HA   PHE  56           HA       PHE  56   5.211  -0.846  -4.444
  427    HB2  PHE  56           1HB      PHE  56   3.084  -0.650  -3.111
  428    HB3  PHE  56           2HB      PHE  56   3.964   0.064  -1.771
  429    HD1  PHE  56           2HD      PHE  56   3.072   0.591  -5.408
  430    HD2  PHE  56           1HD      PHE  56   4.523   2.518  -1.787
  431    HE1  PHE  56           2HE      PHE  56   2.950   2.806  -6.522
  432    HE2  PHE  56           1HE      PHE  56   4.402   4.731  -2.928
  433    HZ   PHE  56           HZ       PHE  56   3.622   4.878  -5.300
  434    H    VAL  57           H        VAL  57   6.290  -0.272  -1.039
  435    HA   VAL  57           HA       VAL  57   7.856   2.092  -1.532
  436    HB   VAL  57           HB       VAL  57   8.006  -0.059   0.704
  437   HG11  VAL  57          1HG1      VAL  57   9.518   2.632   0.473
  438   HG12  VAL  57          2HG1      VAL  57  10.206   1.029   0.763
  439   HG13  VAL  57          3HG1      VAL  57   9.274   1.821   2.024
  440   HG21  VAL  57          3HG2      VAL  57   6.745   1.634   2.067
  441   HG22  VAL  57          1HG2      VAL  57   5.844   1.292   0.592
  442   HG23  VAL  57          2HG2      VAL  57   6.759   2.784   0.732
  443    H    ALA  58           H        ALA  58   8.744  -1.406  -1.364
  444    HA   ALA  58           HA       ALA  58  11.541  -1.065  -1.786
  445    HB1  ALA  58           1HB      ALA  58  10.518  -3.174  -0.859
  446    HB2  ALA  58           2HB      ALA  58  11.510  -3.546  -2.277
  447    HB3  ALA  58           3HB      ALA  58   9.743  -3.496  -2.415
  448    H    ALA  59           H        ALA  59   8.805  -1.570  -4.054
  449    HA   ALA  59           HA       ALA  59  10.395  -1.801  -6.463
  450    HB1  ALA  59           1HB      ALA  59   7.404  -1.161  -6.044
  451    HB2  ALA  59           2HB      ALA  59   8.086  -2.775  -6.272
  452    HB3  ALA  59           3HB      ALA  59   8.136  -1.606  -7.599
  453    H    ALA  60           H        ALA  60   8.585   0.869  -4.865
  454    HA   ALA  60           HA       ALA  60   8.857   2.848  -6.909
  455    HB1  ALA  60           1HB      ALA  60   8.268   4.489  -5.036
  456    HB2  ALA  60           2HB      ALA  60   8.477   3.180  -3.861
  457    HB3  ALA  60           3HB      ALA  60   7.183   3.088  -5.058
  458    H    ARG  61           H        ARG  61  10.859   2.022  -4.062
  459    HA   ARG  61           HA       ARG  61  12.647   4.238  -4.389
  460    HB2  ARG  61           1HB      ARG  61  12.278   2.912  -2.179
  461    HB3  ARG  61           2HB      ARG  61  13.229   1.585  -2.863
  462    HG2  ARG  61           1HG      ARG  61  15.237   3.145  -3.089
  463    HG3  ARG  61           2HG      ARG  61  14.277   4.473  -2.399
  464    HD2  ARG  61           1HD      ARG  61  15.701   3.481  -0.627
  465    HD3  ARG  61           2HD      ARG  61  14.003   3.102  -0.256
  466    HE   ARG  61           HE       ARG  61  15.160   1.011  -1.848
  467   HH11  ARG  61          1HH2      ARG  61  15.198   2.338   1.353
  468   HH12  ARG  61          2HH2      ARG  61  15.646   0.852   2.118
  469   HH21  ARG  61          1HH1      ARG  61  15.748  -0.951  -0.848
  470   HH22  ARG  61          2HH1      ARG  61  15.959  -1.017   0.871
  Start of MODEL    8
    1    H    ILE   5           H        ILE   5 -13.048  -9.872 -12.689
    2    HA   ILE   5           HA       ILE   5 -11.361  -9.397 -14.187
    3    HB   ILE   5           HB       ILE   5 -12.697  -6.598 -14.338
    4   HG12  ILE   5          1HG1      ILE   5 -13.207  -8.940 -16.284
    5   HG13  ILE   5          2HG1      ILE   5 -14.218  -8.653 -14.889
    6   HG21  ILE   5          1HG2      ILE   5 -10.629  -6.210 -15.521
    7   HG22  ILE   5          2HG2      ILE   5 -11.631  -6.782 -16.841
    8   HG23  ILE   5          3HG2      ILE   5 -10.509  -7.885 -16.065
    9   HD11  ILE   5          3HD1      ILE   5 -15.180  -7.664 -16.968
   10   HD12  ILE   5          1HD1      ILE   5 -13.786  -6.585 -17.086
   11   HD13  ILE   5          2HD1      ILE   5 -14.896  -6.458 -15.717
   12    H    MET   6           H        MET   6 -10.732  -9.254 -11.435
   13    HA   MET   6           HA       MET   6  -9.292  -8.332  -9.793
   14    HB2  MET   6           1HB      MET   6  -7.700  -8.053 -12.417
   15    HB3  MET   6           2HB      MET   6  -6.953  -7.932 -10.813
   16    HG2  MET   6           1HG      MET   6  -7.707 -10.304 -10.289
   17    HG3  MET   6           2HG      MET   6  -8.447 -10.418 -11.896
   18    HE1  MET   6           3HE      MET   6  -7.119 -12.543 -12.637
   19    HE2  MET   6           1HE      MET   6  -6.551 -12.596 -10.960
   20    HE3  MET   6           2HE      MET   6  -5.412 -12.792 -12.289
   21    H    GLN   7           H        GLN   7 -11.249  -6.392 -10.827
   22    HA   GLN   7           HA       GLN   7 -10.139  -3.809 -11.382
   23    HB2  GLN   7           1HB      GLN   7 -12.866  -4.779 -10.388
   24    HB3  GLN   7           2HB      GLN   7 -12.551  -3.037 -10.474
   25    HG2  GLN   7           1HG      GLN   7 -12.116  -4.875 -12.882
   26    HG3  GLN   7           2HG      GLN   7 -13.667  -4.100 -12.593
   27   HE21  GLN   7          1HE2      GLN   7 -10.793  -3.695 -14.332
   28   HE22  GLN   7          2HE2      GLN   7 -10.824  -2.003 -14.499
   29    H    ALA   8           H        ALA   8 -11.110  -5.398  -8.366
   30    HA   ALA   8           HA       ALA   8 -10.815  -3.226  -6.563
   31    HB1  ALA   8           1HB      ALA   8 -10.584  -5.033  -4.809
   32    HB2  ALA   8           2HB      ALA   8 -10.305  -6.232  -6.088
   33    HB3  ALA   8           3HB      ALA   8 -11.873  -5.436  -5.956
   34    H    LYS   9           H        LYS   9  -8.447  -5.766  -7.579
   35    HA   LYS   9           HA       LYS   9  -6.271  -4.753  -6.046
   36    HB2  LYS   9           1HB      LYS   9  -6.539  -7.151  -7.069
   37    HB3  LYS   9           2HB      LYS   9  -5.988  -6.460  -8.610
   38    HG2  LYS   9           1HG      LYS   9  -3.817  -5.733  -7.525
   39    HG3  LYS   9           2HG      LYS   9  -4.373  -6.350  -5.955
   40    HD2  LYS   9           1HD      LYS   9  -4.457  -8.710  -6.931
   41    HD3  LYS   9           2HD      LYS   9  -3.854  -8.079  -8.474
   42    HE2  LYS   9           1HE      LYS   9  -1.721  -7.355  -7.352
   43    HE3  LYS   9           2HE      LYS   9  -2.324  -7.938  -5.795
   44    HZ1  LYS   9           3HZ      LYS   9  -0.850  -9.408  -7.382
   45    HZ2  LYS   9           1HZ      LYS   9  -2.362  -9.795  -8.044
   46    HZ3  LYS   9           2HZ      LYS   9  -2.059 -10.078  -6.395
   47    H    GLU  10           H        GLU  10  -7.245  -4.226  -9.445
   48    HA   GLU  10           HA       GLU  10  -4.971  -2.717 -10.318
   49    HB2  GLU  10           1HB      GLU  10  -6.690  -3.797 -11.860
   50    HB3  GLU  10           2HB      GLU  10  -7.889  -2.615 -11.325
   51    HG2  GLU  10           1HG      GLU  10  -6.489  -0.729 -12.281
   52    HG3  GLU  10           2HG      GLU  10  -5.254  -1.889 -12.773
   53    H    ASP  11           H        ASP  11  -8.066  -1.856  -8.822
   54    HA   ASP  11           HA       ASP  11  -7.878   1.029  -8.926
   55    HB2  ASP  11           1HB      ASP  11  -9.455  -0.791  -6.995
   56    HB3  ASP  11           2HB      ASP  11  -9.603   0.967  -6.990
   57    H    PHE  12           H        PHE  12  -6.702  -1.446  -6.694
   58    HA   PHE  12           HA       PHE  12  -5.856   0.271  -4.590
   59    HB2  PHE  12           1HB      PHE  12  -6.088  -2.405  -4.699
   60    HB3  PHE  12           2HB      PHE  12  -4.384  -2.313  -5.168
   61    HD1  PHE  12           1HD      PHE  12  -2.778  -0.860  -3.639
   62    HD2  PHE  12           2HD      PHE  12  -6.681  -2.193  -2.314
   63    HE1  PHE  12           1HE      PHE  12  -2.129  -0.434  -1.269
   64    HE2  PHE  12           2HE      PHE  12  -6.000  -1.766   0.001
   65    HZ   PHE  12           HZ       PHE  12  -3.745  -0.888   0.560
   66    H    LYS  13           H        LYS  13  -4.013  -1.098  -7.318
   67    HA   LYS  13           HA       LYS  13  -1.528   0.180  -6.743
   68    HB2  LYS  13           1HB      LYS  13  -2.740  -0.882  -9.363
   69    HB3  LYS  13           2HB      LYS  13  -1.054  -0.333  -9.221
   70    HG2  LYS  13           1HG      LYS  13  -0.638  -2.070  -7.411
   71    HG3  LYS  13           2HG      LYS  13  -2.326  -2.629  -7.576
   72    HD2  LYS  13           1HD      LYS  13  -1.879  -3.296  -9.982
   73    HD3  LYS  13           2HD      LYS  13  -0.207  -2.710  -9.847
   74    HE2  LYS  13           1HE      LYS  13   0.253  -4.425  -8.058
   75    HE3  LYS  13           2HE      LYS  13  -1.413  -5.002  -8.197
   76    HZ1  LYS  13           3HZ      LYS  13  -1.009  -5.993 -10.156
   77    HZ2  LYS  13           1HZ      LYS  13   0.582  -6.028  -9.570
   78    HZ3  LYS  13           2HZ      LYS  13   0.110  -4.818 -10.663
   79    H    LYS  14           H        LYS  14  -4.302   1.073  -8.724
   80    HA   LYS  14           HA       LYS  14  -3.255   3.357  -9.974
   81    HB2  LYS  14           1HB      LYS  14  -5.444   2.224 -10.633
   82    HB3  LYS  14           2HB      LYS  14  -6.187   2.866  -9.161
   83    HG2  LYS  14           1HG      LYS  14  -5.763   5.233  -9.933
   84    HG3  LYS  14           2HG      LYS  14  -4.941   4.626 -11.384
   85    HD2  LYS  14           1HD      LYS  14  -7.125   3.583 -12.163
   86    HD3  LYS  14           2HD      LYS  14  -7.940   4.207 -10.711
   87    HE2  LYS  14           1HE      LYS  14  -8.326   5.751 -12.685
   88    HE3  LYS  14           2HE      LYS  14  -7.382   6.585 -11.437
   89    HZ1  LYS  14           3HZ      LYS  14  -5.402   6.244 -12.635
   90    HZ2  LYS  14           1HZ      LYS  14  -6.531   6.748 -13.794
   91    HZ3  LYS  14           2HZ      LYS  14  -6.113   5.107 -13.680
   92    H    MET  15           H        MET  15  -4.947   2.924  -6.857
   93    HA   MET  15           HA       MET  15  -5.027   5.710  -6.155
   94    HB2  MET  15           1HB      MET  15  -6.489   3.808  -5.150
   95    HB3  MET  15           2HB      MET  15  -5.065   3.307  -4.229
   96    HG2  MET  15           1HG      MET  15  -6.425   4.767  -2.744
   97    HG3  MET  15           2HG      MET  15  -5.002   5.706  -3.195
   98    HE1  MET  15           3HE      MET  15  -6.276   7.926  -2.484
   99    HE2  MET  15           1HE      MET  15  -7.704   6.978  -2.045
  100    HE3  MET  15           2HE      MET  15  -7.869   8.394  -3.075
  101    H    MET  16           H        MET  16  -2.772   3.064  -5.260
  102    HA   MET  16           HA       MET  16  -1.088   4.472  -3.444
  103    HB2  MET  16           1HB      MET  16  -0.642   2.010  -5.201
  104    HB3  MET  16           2HB      MET  16   0.591   2.564  -4.076
  105    HG2  MET  16           1HG      MET  16  -2.255   1.765  -3.213
  106    HG3  MET  16           2HG      MET  16  -0.858   0.689  -3.130
  107    HE1  MET  16           3HE      MET  16   1.409   1.490  -1.885
  108    HE2  MET  16           1HE      MET  16   0.431   0.436  -0.859
  109    HE3  MET  16           2HE      MET  16   1.199   1.870  -0.190
  110    H    GLU  17           H        GLU  17  -0.708   4.009  -6.982
  111    HA   GLU  17           HA       GLU  17   1.873   5.301  -7.146
  112    HB2  GLU  17           1HB      GLU  17   1.662   5.033  -9.570
  113    HB3  GLU  17           2HB      GLU  17   0.927   3.596  -8.835
  114    HG2  GLU  17           1HG      GLU  17  -1.346   4.774  -9.101
  115    HG3  GLU  17           2HG      GLU  17  -0.546   6.010 -10.034
  116    H    GLU  18           H        GLU  18  -1.533   6.381  -7.528
  117    HA   GLU  18           HA       GLU  18  -0.937   9.145  -8.301
  118    HB2  GLU  18           1HB      GLU  18  -3.555   7.745  -7.458
  119    HB3  GLU  18           2HB      GLU  18  -3.492   9.448  -7.945
  120    HG2  GLU  18           1HG      GLU  18  -2.671   8.772 -10.235
  121    HG3  GLU  18           2HG      GLU  18  -2.679   7.088  -9.758
  122    H    ALA  19           H        ALA  19  -1.379   7.404  -5.258
  123    HA   ALA  19           HA       ALA  19  -1.991   9.812  -3.666
  124    HB1  ALA  19           1HB      ALA  19  -1.987   8.174  -1.709
  125    HB2  ALA  19           2HB      ALA  19  -1.537   6.889  -2.829
  126    HB3  ALA  19           3HB      ALA  19  -3.090   7.683  -3.003
  127    H    LYS  20           H        LYS  20   0.718   8.743  -5.198
  128    HA   LYS  20           HA       LYS  20   2.849   8.100  -3.877
  129    HB2  LYS  20           1HB      LYS  20   2.875   9.312  -6.186
  130    HB3  LYS  20           2HB      LYS  20   3.012  10.832  -5.304
  131    HG2  LYS  20           1HG      LYS  20   5.339  10.352  -5.769
  132    HG3  LYS  20           2HG      LYS  20   5.178   9.661  -4.143
  133    HD2  LYS  20           1HD      LYS  20   4.776   7.348  -5.239
  134    HD3  LYS  20           2HD      LYS  20   5.046   8.085  -6.817
  135    HE2  LYS  20           1HE      LYS  20   7.403   8.697  -6.106
  136    HE3  LYS  20           2HE      LYS  20   7.117   7.903  -4.544
  137    HZ1  LYS  20           3HZ      LYS  20   6.915   6.590  -7.209
  138    HZ2  LYS  20           1HZ      LYS  20   6.672   5.838  -5.708
  139    HZ3  LYS  20           2HZ      LYS  20   8.212   6.423  -6.124
  140    H    PHE  21           H        PHE  21   3.559   8.360  -1.858
  141    HA   PHE  21           HA       PHE  21   3.409  11.002  -0.508
  142    HB2  PHE  21           1HB      PHE  21   2.569   9.818   1.564
  143    HB3  PHE  21           2HB      PHE  21   1.446   9.630   0.213
  144    HD1  PHE  21           2HD      PHE  21   1.336   7.372  -1.080
  145    HD2  PHE  21           1HD      PHE  21   3.756   7.796   2.482
  146    HE1  PHE  21           2HE      PHE  21   1.524   4.904  -0.926
  147    HE2  PHE  21           1HE      PHE  21   3.955   5.313   2.629
  148    HZ   PHE  21           HZ       PHE  21   2.829   3.870   0.918
  149    H    ASN  22           H        ASN  22   4.711  10.817   1.631
  150    HA   ASN  22           HA       ASN  22   7.377  10.575   1.145
  151    HB2  ASN  22           1HB      ASN  22   5.873  10.150   3.765
  152    HB3  ASN  22           2HB      ASN  22   7.624  10.361   3.699
  153   HD21  ASN  22          1HD2      ASN  22   8.265  12.420   2.314
  154   HD22  ASN  22          2HD2      ASN  22   7.348  13.819   2.599
  155    HA   PRO  23           HA       PRO  23   7.740   5.940   0.599
  156    HB2  PRO  23           1HB      PRO  23  10.444   5.751   0.047
  157    HB3  PRO  23           2HB      PRO  23   9.266   6.378  -1.143
  158    HG2  PRO  23           1HG      PRO  23  11.115   7.929   0.684
  159    HG3  PRO  23           2HG      PRO  23  10.773   8.190  -1.042
  160    HD2  PRO  23           1HD      PRO  23   9.555   9.690   0.918
  161    HD3  PRO  23           2HD      PRO  23   8.714   9.298  -0.602
  162    H    ARG  24           H        ARG  24   9.339   7.866   3.015
  163    HA   ARG  24           HA       ARG  24  10.422   5.567   4.527
  164    HB2  ARG  24           1HB      ARG  24  10.420   8.600   5.091
  165    HB3  ARG  24           2HB      ARG  24  11.277   7.404   6.099
  166    HG2  ARG  24           1HG      ARG  24  12.743   6.766   4.146
  167    HG3  ARG  24           2HG      ARG  24  11.854   7.871   3.085
  168    HD2  ARG  24           1HD      ARG  24  13.984   8.945   3.828
  169    HD3  ARG  24           2HD      ARG  24  12.594   9.834   4.507
  170    HE   ARG  24           HE       ARG  24  13.431   7.762   6.314
  171   HH11  ARG  24          1HH2      ARG  24  14.395  10.903   5.138
  172   HH12  ARG  24          2HH2      ARG  24  15.265  11.317   6.579
  173   HH21  ARG  24          1HH1      ARG  24  14.543   8.325   8.188
  174   HH22  ARG  24          2HH1      ARG  24  15.346   9.854   8.305
  175    H    ALA  25           H        ALA  25   7.420   7.049   4.274
  176    HA   ALA  25           HA       ALA  25   6.575   6.917   7.063
  177    HB1  ALA  25           1HB      ALA  25   4.934   6.939   4.462
  178    HB2  ALA  25           2HB      ALA  25   5.345   8.353   5.415
  179    HB3  ALA  25           3HB      ALA  25   4.246   7.143   6.077
  180    H    THR  26           H        THR  26   5.190   5.283   7.912
  181    HA   THR  26           HA       THR  26   5.768   2.552   6.919
  182    HB   THR  26           HB       THR  26   5.049   1.841   9.201
  183    HG1  THR  26           1HG      THR  26   3.443   3.438   9.457
  184   HG21  THR  26          3HG2      THR  26   6.886   4.311   9.432
  185   HG22  THR  26          1HG2      THR  26   7.450   2.704   8.938
  186   HG23  THR  26          2HG2      THR  26   6.804   2.964  10.565
  187    H    PHE  27           H        PHE  27   3.930   1.001   7.203
  188    HA   PHE  27           HA       PHE  27   1.678   1.673   5.594
  189    HB2  PHE  27           1HB      PHE  27   2.476  -0.665   5.770
  190    HB3  PHE  27           2HB      PHE  27   2.156  -0.689   7.501
  191    HD1  PHE  27           1HD      PHE  27   0.395  -0.050   4.184
  192    HD2  PHE  27           2HD      PHE  27  -0.071  -1.457   8.276
  193    HE1  PHE  27           1HE      PHE  27  -1.977  -0.594   3.734
  194    HE2  PHE  27           2HE      PHE  27  -2.445  -2.018   7.798
  195    HZ   PHE  27           HZ       PHE  27  -3.397  -1.582   5.538
  196    H    SER  28           H        SER  28   2.046   1.401   9.140
  197    HA   SER  28           HA       SER  28  -0.674   1.716   9.935
  198    HB2  SER  28           1HB      SER  28   1.189   1.026  11.479
  199    HB3  SER  28           2HB      SER  28   1.872   2.652  11.383
  200    HG   SER  28           HG       SER  28  -0.823   2.531  11.999
  201    H    GLU  29           H        GLU  29   1.838   4.181   9.258
  202    HA   GLU  29           HA       GLU  29   0.216   6.489   9.941
  203    HB2  GLU  29           1HB      GLU  29   2.770   6.171   8.232
  204    HB3  GLU  29           2HB      GLU  29   2.073   7.757   8.627
  205    HG2  GLU  29           1HG      GLU  29   3.055   5.706  10.735
  206    HG3  GLU  29           2HG      GLU  29   3.983   7.117  10.207
  207    H    PHE  30           H        PHE  30   0.996   4.837   6.834
  208    HA   PHE  30           HA       PHE  30  -0.455   6.626   5.107
  209    HB2  PHE  30           1HB      PHE  30   1.325   5.043   4.286
  210    HB3  PHE  30           2HB      PHE  30   0.309   3.665   4.732
  211    HD1  PHE  30           2HD      PHE  30   0.389   6.756   2.545
  212    HD2  PHE  30           1HD      PHE  30  -1.507   2.884   3.188
  213    HE1  PHE  30           2HE      PHE  30  -0.898   7.016   0.430
  214    HE2  PHE  30           1HE      PHE  30  -2.785   3.175   1.071
  215    HZ   PHE  30           HZ       PHE  30  -2.482   5.236  -0.306
  216    H    ALA  31           H        ALA  31  -1.329   3.514   6.688
  217    HA   ALA  31           HA       ALA  31  -3.966   3.229   5.604
  218    HB1  ALA  31           1HB      ALA  31  -2.657   1.336   6.612
  219    HB2  ALA  31           2HB      ALA  31  -4.229   1.484   7.392
  220    HB3  ALA  31           3HB      ALA  31  -2.771   2.077   8.201
  221    H    ALA  32           H        ALA  32  -2.707   4.787   8.558
  222    HA   ALA  32           HA       ALA  32  -5.168   5.372   9.915
  223    HB1  ALA  32           1HB      ALA  32  -2.938   5.682  11.006
  224    HB2  ALA  32           2HB      ALA  32  -3.829   7.205  11.045
  225    HB3  ALA  32           3HB      ALA  32  -2.536   6.961   9.867
  226    H    LYS  33           H        LYS  33  -3.483   7.133   7.276
  227    HA   LYS  33           HA       LYS  33  -5.296   9.418   7.216
  228    HB2  LYS  33           1HB      LYS  33  -3.248   8.317   5.186
  229    HB3  LYS  33           2HB      LYS  33  -4.112   9.845   4.967
  230    HG2  LYS  33           1HG      LYS  33  -3.106  10.745   7.107
  231    HG3  LYS  33           2HG      LYS  33  -2.250   9.210   7.345
  232    HD2  LYS  33           1HD      LYS  33  -0.939   9.593   5.197
  233    HD3  LYS  33           2HD      LYS  33  -1.812  11.123   4.938
  234    HE2  LYS  33           1HE      LYS  33   0.442  11.563   5.985
  235    HE3  LYS  33           2HE      LYS  33  -0.844  12.017   7.117
  236    HZ1  LYS  33           3HZ      LYS  33   1.209  10.243   7.569
  237    HZ2  LYS  33           1HZ      LYS  33  -0.157   9.260   7.363
  238    HZ3  LYS  33           2HZ      LYS  33  -0.158  10.483   8.546
  239    H    HIS  34           H        HIS  34  -5.054   6.343   5.346
  240    HA   HIS  34           HA       HIS  34  -7.465   7.035   3.777
  241    HB2  HIS  34           1HB      HIS  34  -5.423   4.743   3.569
  242    HB3  HIS  34           2HB      HIS  34  -6.825   4.887   2.491
  243    HD2  HIS  34           2HD      HIS  34  -6.516   6.861   0.452
  244    HE1  HIS  34           1HE      HIS  34  -2.782   8.360   1.725
  245    HE2  HIS  34           2HE      HIS  34  -4.530   8.457  -0.112
  246    H    ALA  35           H        ALA  35  -6.878   5.685   6.775
  247    HA   ALA  35           HA       ALA  35  -8.204   3.239   6.986
  248    HB1  ALA  35           1HB      ALA  35  -7.110   4.042   9.001
  249    HB2  ALA  35           2HB      ALA  35  -8.812   4.049   9.422
  250    HB3  ALA  35           3HB      ALA  35  -8.006   5.557   8.983
  251    H    LYS  36           H        LYS  36  -9.652   6.516   6.948
  252    HA   LYS  36           HA       LYS  36 -12.352   5.600   7.385
  253    HB2  LYS  36           1HB      LYS  36 -12.927   8.047   7.017
  254    HB3  LYS  36           2HB      LYS  36 -11.495   7.939   8.058
  255    HG2  LYS  36           1HG      LYS  36  -9.978   8.329   6.024
  256    HG3  LYS  36           2HG      LYS  36 -11.409   8.476   4.991
  257    HD2  LYS  36           1HD      LYS  36 -12.159  10.511   6.346
  258    HD3  LYS  36           2HD      LYS  36 -10.662  10.394   7.295
  259    HE2  LYS  36           1HE      LYS  36 -10.790  10.884   4.240
  260    HE3  LYS  36           2HE      LYS  36 -10.385  12.106   5.453
  261    HZ1  LYS  36           3HZ      LYS  36  -8.511  10.632   6.120
  262    HZ2  LYS  36           1HZ      LYS  36  -8.379  11.281   4.558
  263    HZ3  LYS  36           2HZ      LYS  36  -8.851   9.661   4.767
  264    H    ASP  37           H        ASP  37 -10.239   5.659   4.639
  265    HA   ASP  37           HA       ASP  37 -12.117   6.208   2.534
  266    HB2  ASP  37           1HB      ASP  37  -9.495   6.148   2.346
  267    HB3  ASP  37           2HB      ASP  37  -9.637   4.396   2.204
  268    H    SER  38           H        SER  38 -13.481   4.812   1.414
  269    HA   SER  38           HA       SER  38 -14.549   2.535   2.730
  270    HB2  SER  38           1HB      SER  38 -16.005   3.757   1.228
  271    HB3  SER  38           2HB      SER  38 -14.849   3.641  -0.099
  272    HG   SER  38           HG       SER  38 -15.261   1.430  -0.205
  273    H    ARG  39           H        ARG  39 -11.918   2.875   0.565
  274    HA   ARG  39           HA       ARG  39 -11.697   0.215  -0.533
  275    HB2  ARG  39           1HB      ARG  39  -9.795   2.592  -0.247
  276    HB3  ARG  39           2HB      ARG  39  -9.240   1.063  -0.918
  277    HG2  ARG  39           1HG      ARG  39 -10.735   1.214  -2.842
  278    HG3  ARG  39           2HG      ARG  39 -11.696   2.507  -2.095
  279    HD2  ARG  39           1HD      ARG  39  -9.905   3.191  -3.974
  280    HD3  ARG  39           2HD      ARG  39 -10.031   4.182  -2.526
  281    HE   ARG  39           HE       ARG  39  -7.861   3.617  -2.026
  282   HH11  ARG  39          1HH2      ARG  39  -9.137   1.107  -4.085
  283   HH12  ARG  39          2HH2      ARG  39  -7.670   0.191  -4.077
  284   HH21  ARG  39          1HH1      ARG  39  -5.997   2.423  -1.970
  285   HH22  ARG  39          2HH1      ARG  39  -5.872   0.947  -2.860
  286    H    PHE  40           H        PHE  40 -10.770   1.702   2.512
  287    HA   PHE  40           HA       PHE  40  -8.710  -0.143   3.204
  288    HB2  PHE  40           1HB      PHE  40  -8.835   2.071   4.331
  289    HB3  PHE  40           2HB      PHE  40 -10.416   1.660   5.000
  290    HD1  PHE  40           2HD      PHE  40  -6.773   0.641   5.043
  291    HD2  PHE  40           1HD      PHE  40 -10.599   0.315   7.107
  292    HE1  PHE  40           2HE      PHE  40  -5.680  -0.552   6.930
  293    HE2  PHE  40           1HE      PHE  40  -9.474  -0.877   8.979
  294    HZ   PHE  40           HZ       PHE  40  -7.016  -1.306   8.893
  295    H    LYS  41           H        LYS  41 -12.108   0.077   4.229
  296    HA   LYS  41           HA       LYS  41 -12.117  -2.409   5.731
  297    HB2  LYS  41           1HB      LYS  41 -14.503  -1.930   6.179
  298    HB3  LYS  41           2HB      LYS  41 -13.663  -0.370   6.209
  299    HG2  LYS  41           1HG      LYS  41 -14.411   0.083   3.816
  300    HG3  LYS  41           2HG      LYS  41 -15.254  -1.468   3.779
  301    HD2  LYS  41           1HD      LYS  41 -16.711  -0.607   5.760
  302    HD3  LYS  41           2HD      LYS  41 -15.982   0.991   5.495
  303    HE2  LYS  41           1HE      LYS  41 -17.627  -0.597   3.402
  304    HE3  LYS  41           2HE      LYS  41 -18.171   0.854   4.252
  305    HZ1  LYS  41           3HZ      LYS  41 -15.822   0.706   2.441
  306    HZ2  LYS  41           1HZ      LYS  41 -16.407   2.096   3.216
  307    HZ3  LYS  41           2HZ      LYS  41 -17.348   1.331   2.029
  308    H    ALA  42           H        ALA  42 -12.392  -1.666   2.356
  309    HA   ALA  42           HA       ALA  42 -14.209  -3.706   1.425
  310    HB1  ALA  42           1HB      ALA  42 -11.846  -2.355  -0.020
  311    HB2  ALA  42           2HB      ALA  42 -13.479  -1.712   0.030
  312    HB3  ALA  42           3HB      ALA  42 -13.166  -3.228  -0.813
  313    H    ILE  43           H        ILE  43 -10.762  -3.666   2.187
  314    HA   ILE  43           HA       ILE  43 -10.428  -6.500   1.329
  315    HB   ILE  43           HB       ILE  43  -8.312  -4.656   2.599
  316   HG12  ILE  43          1HG1      ILE  43  -9.080  -3.384   0.606
  317   HG13  ILE  43          2HG1      ILE  43  -7.523  -4.105   0.203
  318   HG21  ILE  43          1HG2      ILE  43  -6.680  -6.199   1.455
  319   HG22  ILE  43          2HG2      ILE  43  -8.014  -7.124   0.763
  320   HG23  ILE  43          3HG2      ILE  43  -7.758  -7.119   2.506
  321   HD11  ILE  43          3HD1      ILE  43 -10.285  -4.858  -0.796
  322   HD12  ILE  43          1HD1      ILE  43  -8.963  -6.026  -0.901
  323   HD13  ILE  43          2HD1      ILE  43  -8.837  -4.471  -1.720
  324    H    GLU  44           H        GLU  44 -10.965  -7.982   2.774
  325    HA   GLU  44           HA       GLU  44 -11.533  -7.555   5.562
  326    HB2  GLU  44           1HB      GLU  44 -11.241 -10.094   3.830
  327    HB3  GLU  44           2HB      GLU  44 -11.827 -10.121   5.506
  328    HG2  GLU  44           1HG      GLU  44 -13.784  -8.638   4.846
  329    HG3  GLU  44           2HG      GLU  44 -13.187  -8.575   3.183
  330    H    LYS  45           H        LYS  45  -8.860  -9.157   3.758
  331    HA   LYS  45           HA       LYS  45  -7.310  -9.775   6.202
  332    HB2  LYS  45           1HB      LYS  45  -6.792 -10.365   3.208
  333    HB3  LYS  45           2HB      LYS  45  -5.746 -10.927   4.539
  334    HG2  LYS  45           1HG      LYS  45  -7.717 -12.214   5.524
  335    HG3  LYS  45           2HG      LYS  45  -8.734 -11.676   4.165
  336    HD2  LYS  45           1HD      LYS  45  -7.209 -12.902   2.536
  337    HD3  LYS  45           2HD      LYS  45  -6.172 -13.422   3.886
  338    HE2  LYS  45           1HE      LYS  45  -7.761 -15.269   3.235
  339    HE3  LYS  45           2HE      LYS  45  -8.138 -14.702   4.872
  340    HZ1  LYS  45           3HZ      LYS  45  -9.459 -13.526   2.504
  341    HZ2  LYS  45           1HZ      LYS  45  -9.979 -13.537   4.118
  342    HZ3  LYS  45           2HZ      LYS  45 -10.035 -14.965   3.202
  343    H    MET  46           H        MET  46  -6.267  -8.076   7.022
  344    HA   MET  46           HA       MET  46  -5.192  -5.862   5.541
  345    HB2  MET  46           1HB      MET  46  -4.888  -6.783   8.450
  346    HB3  MET  46           2HB      MET  46  -4.243  -5.242   7.847
  347    HG2  MET  46           1HG      MET  46  -6.594  -4.512   7.203
  348    HG3  MET  46           2HG      MET  46  -7.224  -6.053   7.805
  349    HE1  MET  46           3HE      MET  46  -8.494  -3.467   8.743
  350    HE2  MET  46           1HE      MET  46  -8.546  -3.605  10.505
  351    HE3  MET  46           2HE      MET  46  -8.915  -5.001   9.498
  352    H    LYS  47           H        LYS  47  -4.131  -9.036   6.080
  353    HA   LYS  47           HA       LYS  47  -1.299  -8.707   6.319
  354    HB2  LYS  47           1HB      LYS  47  -2.995 -11.048   5.216
  355    HB3  LYS  47           2HB      LYS  47  -1.242 -11.165   5.514
  356    HG2  LYS  47           1HG      LYS  47  -1.636 -10.630   7.975
  357    HG3  LYS  47           2HG      LYS  47  -3.390 -10.542   7.665
  358    HD2  LYS  47           1HD      LYS  47  -3.404 -12.987   6.986
  359    HD3  LYS  47           2HD      LYS  47  -1.643 -13.084   7.241
  360    HE2  LYS  47           1HE      LYS  47  -2.875 -14.001   9.244
  361    HE3  LYS  47           2HE      LYS  47  -1.990 -12.534   9.700
  362    HZ1  LYS  47           3HZ      LYS  47  -4.630 -12.968  10.096
  363    HZ2  LYS  47           1HZ      LYS  47  -4.639 -12.026   8.688
  364    HZ3  LYS  47           2HZ      LYS  47  -3.878 -11.446  10.094
  365    H    ASP  48           H        ASP  48  -3.504  -9.063   3.537
  366    HA   ASP  48           HA       ASP  48  -1.503  -9.200   1.487
  367    HB2  ASP  48           1HB      ASP  48  -3.973  -9.897   1.226
  368    HB3  ASP  48           2HB      ASP  48  -4.416  -8.185   1.204
  369    H    ARG  49           H        ARG  49  -3.139  -6.540   3.122
  370    HA   ARG  49           HA       ARG  49  -2.396  -4.390   1.354
  371    HB2  ARG  49           1HB      ARG  49  -2.911  -4.316   4.390
  372    HB3  ARG  49           2HB      ARG  49  -2.883  -2.915   3.326
  373    HG2  ARG  49           1HG      ARG  49  -4.873  -3.819   2.057
  374    HG3  ARG  49           2HG      ARG  49  -4.915  -5.220   3.136
  375    HD2  ARG  49           1HD      ARG  49  -6.566  -3.681   4.090
  376    HD3  ARG  49           2HD      ARG  49  -5.155  -3.464   5.112
  377    HE   ARG  49           HE       ARG  49  -4.815  -1.340   4.207
  378   HH11  ARG  49          1HH2      ARG  49  -7.264  -3.015   2.352
  379   HH12  ARG  49          2HH2      ARG  49  -7.719  -1.606   1.457
  380   HH21  ARG  49          1HH1      ARG  49  -5.406   0.462   3.004
  381   HH22  ARG  49          2HH1      ARG  49  -6.674   0.349   1.830
  382    H    GLU  50           H        GLU  50  -0.900  -5.853   4.297
  383    HA   GLU  50           HA       GLU  50   1.348  -4.074   4.527
  384    HB2  GLU  50           1HB      GLU  50   0.549  -5.612   6.394
  385    HB3  GLU  50           2HB      GLU  50   1.168  -7.006   5.487
  386    HG2  GLU  50           1HG      GLU  50   3.526  -6.019   5.603
  387    HG3  GLU  50           2HG      GLU  50   2.910  -4.637   6.506
  388    H    ALA  51           H        ALA  51   0.930  -7.291   2.931
  389    HA   ALA  51           HA       ALA  51   3.567  -7.743   2.023
  390    HB1  ALA  51           1HB      ALA  51   2.467  -9.272   0.333
  391    HB2  ALA  51           2HB      ALA  51   0.896  -8.534   0.698
  392    HB3  ALA  51           3HB      ALA  51   1.733  -9.466   1.937
  393    H    LEU  52           H        LEU  52   0.792  -6.165   0.361
  394    HA   LEU  52           HA       LEU  52   2.133  -5.524  -2.048
  395    HB2  LEU  52           1HB      LEU  52  -0.450  -5.502  -1.532
  396    HB3  LEU  52           2HB      LEU  52  -0.177  -3.857  -0.934
  397    HG   LEU  52           HG       LEU  52   1.085  -3.540  -3.360
  398   HD11  LEU  52          1HD1      LEU  52   0.783  -5.996  -4.004
  399   HD12  LEU  52          2HD1      LEU  52   0.144  -4.868  -5.186
  400   HD13  LEU  52          3HD1      LEU  52  -0.957  -5.718  -4.097
  401   HD21  LEU  52          3HD2      LEU  52  -1.115  -2.774  -4.370
  402   HD22  LEU  52          1HD2      LEU  52  -0.804  -2.164  -2.746
  403   HD23  LEU  52          2HD2      LEU  52  -1.952  -3.491  -2.985
  404    H    PHE  53           H        PHE  53   1.631  -3.693   0.943
  405    HA   PHE  53           HA       PHE  53   2.691  -1.158   0.212
  406    HB2  PHE  53           1HB      PHE  53   1.449  -1.395   2.304
  407    HB3  PHE  53           2HB      PHE  53   2.542  -2.637   2.881
  408    HD1  PHE  53           1HD      PHE  53   2.433   1.025   1.946
  409    HD2  PHE  53           2HD      PHE  53   4.622  -2.051   4.117
  410    HE1  PHE  53           1HE      PHE  53   3.985   2.732   2.878
  411    HE2  PHE  53           2HE      PHE  53   6.134  -0.315   5.038
  412    HZ   PHE  53           HZ       PHE  53   5.818   2.057   4.396
  413    H    ASN  54           H        ASN  54   4.307  -4.008   1.656
  414    HA   ASN  54           HA       ASN  54   6.939  -2.915   1.882
  415    HB2  ASN  54           1HB      ASN  54   5.993  -5.826   1.519
  416    HB3  ASN  54           2HB      ASN  54   7.660  -5.393   1.926
  417   HD21  ASN  54          1HD2      ASN  54   5.532  -6.892   3.553
  418   HD22  ASN  54          2HD2      ASN  54   5.463  -6.061   5.032
  419    H    GLU  55           H        GLU  55   5.316  -4.712  -0.761
  420    HA   GLU  55           HA       GLU  55   7.564  -4.856  -2.572
  421    HB2  GLU  55           1HB      GLU  55   4.531  -5.123  -3.041
  422    HB3  GLU  55           2HB      GLU  55   5.733  -5.396  -4.325
  423    HG2  GLU  55           1HG      GLU  55   6.743  -7.282  -3.003
  424    HG3  GLU  55           2HG      GLU  55   5.632  -6.987  -1.674
  425    H    PHE  56           H        PHE  56   4.807  -2.569  -2.162
  426    HA   PHE  56           HA       PHE  56   5.182  -1.034  -4.499
  427    HB2  PHE  56           1HB      PHE  56   3.118  -0.914  -3.064
  428    HB3  PHE  56           2HB      PHE  56   4.056  -0.180  -1.757
  429    HD1  PHE  56           1HD      PHE  56   2.979   0.351  -5.351
  430    HD2  PHE  56           2HD      PHE  56   4.542   2.281  -1.770
  431    HE1  PHE  56           1HE      PHE  56   2.773   2.577  -6.440
  432    HE2  PHE  56           2HE      PHE  56   4.312   4.498  -2.879
  433    HZ   PHE  56           HZ       PHE  56   3.441   4.644  -5.208
  434    H    VAL  57           H        VAL  57   6.423  -0.488  -1.138
  435    HA   VAL  57           HA       VAL  57   7.940   1.905  -1.658
  436    HB   VAL  57           HB       VAL  57   8.194  -0.262   0.532
  437   HG11  VAL  57          1HG1      VAL  57  10.403   0.860   0.525
  438   HG12  VAL  57          2HG1      VAL  57   9.500   1.614   1.837
  439   HG13  VAL  57          3HG1      VAL  57   9.673   2.457   0.296
  440   HG21  VAL  57          3HG2      VAL  57   6.017   1.055   0.559
  441   HG22  VAL  57          1HG2      VAL  57   6.926   2.570   0.625
  442   HG23  VAL  57          2HG2      VAL  57   7.003   1.434   1.964
  443    H    ALA  58           H        ALA  58   8.857  -1.586  -1.581
  444    HA   ALA  58           HA       ALA  58  11.641  -1.214  -2.101
  445    HB1  ALA  58           1HB      ALA  58   9.854  -3.659  -2.670
  446    HB2  ALA  58           2HB      ALA  58  10.670  -3.335  -1.145
  447    HB3  ALA  58           3HB      ALA  58  11.624  -3.693  -2.593
  448    H    ALA  59           H        ALA  59   8.809  -1.720  -4.272
  449    HA   ALA  59           HA       ALA  59  10.326  -1.910  -6.743
  450    HB1  ALA  59           1HB      ALA  59   8.056  -2.950  -6.485
  451    HB2  ALA  59           2HB      ALA  59   8.026  -1.771  -7.799
  452    HB3  ALA  59           3HB      ALA  59   7.335  -1.360  -6.219
  453    H    ALA  60           H        ALA  60   8.496   0.700  -5.055
  454    HA   ALA  60           HA       ALA  60   8.674   2.716  -7.090
  455    HB1  ALA  60           1HB      ALA  60   8.055   4.305  -5.191
  456    HB2  ALA  60           2HB      ALA  60   8.313   2.991  -4.037
  457    HB3  ALA  60           3HB      ALA  60   7.015   2.877  -5.225
  458    H    ARG  61           H        ARG  61  10.751   1.898  -4.293
  459    HA   ARG  61           HA       ARG  61  12.483   4.160  -4.533
  460    HB2  ARG  61           1HB      ARG  61  12.196   2.856  -2.375
  461    HB3  ARG  61           2HB      ARG  61  12.961   1.440  -3.121
  462    HG2  ARG  61           1HG      ARG  61  15.131   2.733  -3.388
  463    HG3  ARG  61           2HG      ARG  61  14.362   4.168  -2.699
  464    HD2  ARG  61           1HD      ARG  61  14.060   2.914  -0.499
  465    HD3  ARG  61           2HD      ARG  61  14.866   1.509  -1.228
  466    HE   ARG  61           HE       ARG  61  16.920   2.593  -0.991
  467   HH11  ARG  61          1HH2      ARG  61  14.359   4.976  -0.686
  468   HH12  ARG  61          2HH2      ARG  61  15.426   6.251  -0.197
  469   HH21  ARG  61          1HH1      ARG  61  18.292   4.307  -0.386
  470   HH22  ARG  61          2HH1      ARG  61  17.639   5.871  -0.028
  Start of MODEL    9
    1    H    ILE   5           H        ILE   5 -13.285 -10.587 -11.494
    2    HA   ILE   5           HA       ILE   5 -11.730 -10.038 -13.107
    3    HB   ILE   5           HB       ILE   5 -13.233  -7.292 -13.099
    4   HG12  ILE   5          1HG1      ILE   5 -13.735  -9.650 -15.070
    5   HG13  ILE   5          2HG1      ILE   5 -14.652  -9.505 -13.581
    6   HG21  ILE   5          1HG2      ILE   5 -11.079  -8.434 -14.987
    7   HG22  ILE   5          2HG2      ILE   5 -11.341  -6.759 -14.502
    8   HG23  ILE   5          3HG2      ILE   5 -12.362  -7.482 -15.724
    9   HD11  ILE   5          3HD1      ILE   5 -15.843  -8.519 -15.541
   10   HD12  ILE   5          1HD1      ILE   5 -14.561  -7.321 -15.722
   11   HD13  ILE   5          2HD1      ILE   5 -15.568  -7.340 -14.265
   12    H    MET   6           H        MET   6 -11.069  -9.724 -10.281
   13    HA   MET   6           HA       MET   6  -9.609  -8.646  -8.734
   14    HB2  MET   6           1HB      MET   6  -8.047  -8.540 -11.404
   15    HB3  MET   6           2HB      MET   6  -7.286  -8.285  -9.821
   16    HG2  MET   6           1HG      MET   6  -7.975 -10.628  -9.114
   17    HG3  MET   6           2HG      MET   6  -8.723 -10.876 -10.705
   18    HE1  MET   6           3HE      MET   6  -5.613 -13.178 -10.944
   19    HE2  MET   6           1HE      MET   6  -7.332 -13.002 -11.315
   20    HE3  MET   6           2HE      MET   6  -6.775 -12.926  -9.645
   21    H    GLN   7           H        GLN   7 -11.599  -6.863 -10.136
   22    HA   GLN   7           HA       GLN   7 -10.534  -4.378 -10.944
   23    HB2  GLN   7           1HB      GLN   7 -12.946  -5.126 -11.312
   24    HB3  GLN   7           2HB      GLN   7 -13.270  -4.909  -9.580
   25    HG2  GLN   7           1HG      GLN   7 -12.691  -2.409  -9.822
   26    HG3  GLN   7           2HG      GLN   7 -12.412  -2.648 -11.545
   27   HE21  GLN   7          1HE2      GLN   7 -14.349  -0.792 -10.526
   28   HE22  GLN   7          2HE2      GLN   7 -15.897  -1.326 -10.968
   29    H    ALA   8           H        ALA   8 -11.504  -5.542  -7.707
   30    HA   ALA   8           HA       ALA   8 -11.180  -3.108  -6.218
   31    HB1  ALA   8           1HB      ALA   8 -10.816  -6.029  -5.296
   32    HB2  ALA   8           2HB      ALA   8 -12.353  -5.171  -5.336
   33    HB3  ALA   8           3HB      ALA   8 -11.083  -4.643  -4.219
   34    H    LYS   9           H        LYS   9  -8.892  -5.804  -7.008
   35    HA   LYS   9           HA       LYS   9  -6.694  -4.856  -5.479
   36    HB2  LYS   9           1HB      LYS   9  -7.099  -7.264  -6.504
   37    HB3  LYS   9           2HB      LYS   9  -6.462  -6.608  -8.026
   38    HG2  LYS   9           1HG      LYS   9  -4.284  -6.025  -6.888
   39    HG3  LYS   9           2HG      LYS   9  -4.922  -6.595  -5.331
   40    HD2  LYS   9           1HD      LYS   9  -5.125  -8.962  -6.293
   41    HD3  LYS   9           2HD      LYS   9  -4.438  -8.383  -7.832
   42    HE2  LYS   9           1HE      LYS   9  -2.656  -9.459  -6.384
   43    HE3  LYS   9           2HE      LYS   9  -2.305  -7.745  -6.622
   44    HZ1  LYS   9           3HZ      LYS   9  -2.138  -8.560  -4.280
   45    HZ2  LYS   9           1HZ      LYS   9  -3.818  -8.783  -4.287
   46    HZ3  LYS   9           2HZ      LYS   9  -3.167  -7.226  -4.492
   47    H    GLU  10           H        GLU  10  -7.563  -4.413  -8.922
   48    HA   GLU  10           HA       GLU  10  -5.240  -2.889  -9.736
   49    HB2  GLU  10           1HB      GLU  10  -8.099  -3.133 -10.882
   50    HB3  GLU  10           2HB      GLU  10  -6.830  -2.202 -11.699
   51    HG2  GLU  10           1HG      GLU  10  -6.615  -5.240 -11.068
   52    HG3  GLU  10           2HG      GLU  10  -7.078  -4.590 -12.640
   53    H    ASP  11           H        ASP  11  -8.447  -2.011  -8.505
   54    HA   ASP  11           HA       ASP  11  -8.236   0.878  -8.722
   55    HB2  ASP  11           1HB      ASP  11  -9.879  -0.898  -6.800
   56    HB3  ASP  11           2HB      ASP  11 -10.056   0.855  -6.864
   57    H    PHE  12           H        PHE  12  -7.270  -1.467  -6.180
   58    HA   PHE  12           HA       PHE  12  -6.468   0.460  -4.177
   59    HB2  PHE  12           1HB      PHE  12  -6.881  -2.060  -3.766
   60    HB3  PHE  12           2HB      PHE  12  -5.356  -2.394  -4.584
   61    HD1  PHE  12           2HD      PHE  12  -6.833  -0.372  -1.733
   62    HD2  PHE  12           1HD      PHE  12  -3.208  -2.257  -3.265
   63    HE1  PHE  12           2HE      PHE  12  -5.642   0.181   0.370
   64    HE2  PHE  12           1HE      PHE  12  -2.056  -1.701  -1.128
   65    HZ   PHE  12           HZ       PHE  12  -3.255  -0.470   0.677
   66    H    LYS  13           H        LYS  13  -4.501  -1.266  -6.710
   67    HA   LYS  13           HA       LYS  13  -1.959  -0.110  -6.110
   68    HB2  LYS  13           1HB      LYS  13  -3.147  -1.287  -8.695
   69    HB3  LYS  13           2HB      LYS  13  -1.448  -0.791  -8.566
   70    HG2  LYS  13           1HG      LYS  13  -1.094  -2.412  -6.654
   71    HG3  LYS  13           2HG      LYS  13  -2.804  -2.899  -6.748
   72    HD2  LYS  13           1HD      LYS  13  -2.461  -3.848  -9.062
   73    HD3  LYS  13           2HD      LYS  13  -0.779  -3.262  -9.087
   74    HE2  LYS  13           1HE      LYS  13  -1.837  -5.294  -7.040
   75    HE3  LYS  13           2HE      LYS  13  -0.934  -5.737  -8.487
   76    HZ1  LYS  13           3HZ      LYS  13   0.001  -4.076  -6.202
   77    HZ2  LYS  13           1HZ      LYS  13   0.838  -4.176  -7.674
   78    HZ3  LYS  13           2HZ      LYS  13   0.618  -5.569  -6.727
   79    H    LYS  14           H        LYS  14  -4.502   0.848  -8.362
   80    HA   LYS  14           HA       LYS  14  -3.210   3.012  -9.629
   81    HB2  LYS  14           1HB      LYS  14  -6.177   2.460  -9.119
   82    HB3  LYS  14           2HB      LYS  14  -5.627   3.853 -10.061
   83    HG2  LYS  14           1HG      LYS  14  -4.490   2.317 -11.737
   84    HG3  LYS  14           2HG      LYS  14  -4.949   0.915 -10.780
   85    HD2  LYS  14           1HD      LYS  14  -6.589   1.041 -12.620
   86    HD3  LYS  14           2HD      LYS  14  -7.458   1.550 -11.165
   87    HE2  LYS  14           1HE      LYS  14  -7.179   3.966 -11.837
   88    HE3  LYS  14           2HE      LYS  14  -6.217   3.488 -13.241
   89    HZ1  LYS  14           3HZ      LYS  14  -8.108   2.305 -14.098
   90    HZ2  LYS  14           1HZ      LYS  14  -8.538   3.914 -13.774
   91    HZ3  LYS  14           2HZ      LYS  14  -9.025   2.676 -12.718
   92    H    MET  15           H        MET  15  -5.097   2.827  -6.630
   93    HA   MET  15           HA       MET  15  -5.135   5.641  -6.073
   94    HB2  MET  15           1HB      MET  15  -6.591   3.784  -4.933
   95    HB3  MET  15           2HB      MET  15  -5.172   3.353  -4.000
   96    HG2  MET  15           1HG      MET  15  -6.505   4.890  -2.595
   97    HG3  MET  15           2HG      MET  15  -5.095   5.821  -3.132
   98    HE1  MET  15           3HE      MET  15  -7.714   7.149  -2.021
   99    HE2  MET  15           1HE      MET  15  -7.971   8.479  -3.142
  100    HE3  MET  15           2HE      MET  15  -6.349   8.082  -2.583
  101    H    MET  16           H        MET  16  -2.880   3.011  -5.087
  102    HA   MET  16           HA       MET  16  -1.168   4.539  -3.392
  103    HB2  MET  16           1HB      MET  16  -0.497   2.032  -5.035
  104    HB3  MET  16           2HB      MET  16   0.478   2.661  -3.690
  105    HG2  MET  16           1HG      MET  16  -1.766   2.382  -2.260
  106    HG3  MET  16           2HG      MET  16  -2.279   1.369  -3.566
  107    HE1  MET  16           3HE      MET  16  -0.580   1.354  -0.231
  108    HE2  MET  16           1HE      MET  16   0.718   2.071  -1.192
  109    HE3  MET  16           2HE      MET  16   0.913   0.504  -0.474
  110    H    GLU  17           H        GLU  17  -0.847   3.845  -6.902
  111    HA   GLU  17           HA       GLU  17   1.736   5.115  -7.225
  112    HB2  GLU  17           1HB      GLU  17   1.532   4.639  -9.588
  113    HB3  GLU  17           2HB      GLU  17   0.667   3.315  -8.788
  114    HG2  GLU  17           1HG      GLU  17  -1.494   4.632  -9.198
  115    HG3  GLU  17           2HG      GLU  17  -0.593   5.772 -10.155
  116    H    GLU  18           H        GLU  18  -1.630   6.208  -7.369
  117    HA   GLU  18           HA       GLU  18  -1.019   8.951  -8.357
  118    HB2  GLU  18           1HB      GLU  18  -3.646   7.596  -7.472
  119    HB3  GLU  18           2HB      GLU  18  -3.565   9.288  -8.012
  120    HG2  GLU  18           1HG      GLU  18  -2.737   8.523 -10.285
  121    HG3  GLU  18           2HG      GLU  18  -2.785   6.857  -9.752
  122    H    ALA  19           H        ALA  19  -1.337   7.318  -5.250
  123    HA   ALA  19           HA       ALA  19  -1.951   9.787  -3.743
  124    HB1  ALA  19           1HB      ALA  19  -1.599   6.893  -2.798
  125    HB2  ALA  19           2HB      ALA  19  -3.120   7.730  -3.046
  126    HB3  ALA  19           3HB      ALA  19  -2.034   8.220  -1.735
  127    H    LYS  20           H        LYS  20   0.809   8.719  -5.209
  128    HA   LYS  20           HA       LYS  20   2.912   8.041  -3.794
  129    HB2  LYS  20           1HB      LYS  20   3.042  10.746  -5.299
  130    HB3  LYS  20           2HB      LYS  20   4.453   9.748  -4.876
  131    HG2  LYS  20           1HG      LYS  20   3.393   7.834  -6.313
  132    HG3  LYS  20           2HG      LYS  20   2.193   9.020  -6.836
  133    HD2  LYS  20           1HD      LYS  20   5.255   9.309  -7.299
  134    HD3  LYS  20           2HD      LYS  20   4.111   8.748  -8.521
  135    HE2  LYS  20           1HE      LYS  20   2.891  11.017  -8.354
  136    HE3  LYS  20           2HE      LYS  20   4.177  11.575  -7.279
  137    HZ1  LYS  20           3HZ      LYS  20   4.190  11.274 -10.116
  138    HZ2  LYS  20           1HZ      LYS  20   5.515  10.503  -9.388
  139    HZ3  LYS  20           2HZ      LYS  20   5.236  12.152  -9.106
  140    H    PHE  21           H        PHE  21   3.611   8.313  -1.839
  141    HA   PHE  21           HA       PHE  21   3.358  10.906  -0.406
  142    HB2  PHE  21           1HB      PHE  21   2.568   9.592   1.600
  143    HB3  PHE  21           2HB      PHE  21   1.466   9.388   0.236
  144    HD1  PHE  21           1HD      PHE  21   1.516   7.187  -1.180
  145    HD2  PHE  21           2HD      PHE  21   3.850   7.609   2.447
  146    HE1  PHE  21           1HE      PHE  21   1.845   4.722  -1.102
  147    HE2  PHE  21           2HE      PHE  21   4.183   5.139   2.519
  148    HZ   PHE  21           HZ       PHE  21   3.186   3.697   0.732
  149    H    ASN  22           H        ASN  22   4.728  10.709   1.680
  150    HA   ASN  22           HA       ASN  22   7.393  10.534   1.114
  151    HB2  ASN  22           1HB      ASN  22   5.936  10.112   3.759
  152    HB3  ASN  22           2HB      ASN  22   7.686  10.343   3.670
  153   HD21  ASN  22          1HD2      ASN  22   8.232  12.388   2.157
  154   HD22  ASN  22          2HD2      ASN  22   7.317  13.782   2.476
  155    HA   PRO  23           HA       PRO  23   7.826   5.894   0.597
  156    HB2  PRO  23           1HB      PRO  23  10.540   5.723   0.048
  157    HB3  PRO  23           2HB      PRO  23   9.358   6.336  -1.148
  158    HG2  PRO  23           1HG      PRO  23  11.177   7.912   0.697
  159    HG3  PRO  23           2HG      PRO  23  10.853   8.163  -1.034
  160    HD2  PRO  23           1HD      PRO  23   9.602   9.664   0.891
  161    HD3  PRO  23           2HD      PRO  23   8.769   9.237  -0.629
  162    H    ARG  24           H        ARG  24   9.385   7.837   3.025
  163    HA   ARG  24           HA       ARG  24  10.465   5.524   4.549
  164    HB2  ARG  24           1HB      ARG  24  10.494   8.567   5.118
  165    HB3  ARG  24           2HB      ARG  24  11.337   7.358   6.128
  166    HG2  ARG  24           1HG      ARG  24  12.777   6.686   4.135
  167    HG3  ARG  24           2HG      ARG  24  11.926   7.864   3.117
  168    HD2  ARG  24           1HD      ARG  24  13.543   8.634   5.626
  169    HD3  ARG  24           2HD      ARG  24  14.155   8.743   3.960
  170    HE   ARG  24           HE       ARG  24  11.691  10.150   4.039
  171   HH11  ARG  24          1HH2      ARG  24  14.885  10.408   5.433
  172   HH12  ARG  24          2HH2      ARG  24  14.839  12.134   5.553
  173   HH21  ARG  24          1HH1      ARG  24  11.653  12.418   4.209
  174   HH22  ARG  24          2HH1      ARG  24  13.013  13.267   4.862
  175    H    ALA  25           H        ALA  25   7.461   6.982   4.254
  176    HA   ALA  25           HA       ALA  25   6.603   6.886   7.046
  177    HB1  ALA  25           1HB      ALA  25   5.356   8.259   5.335
  178    HB2  ALA  25           2HB      ALA  25   4.274   7.064   6.050
  179    HB3  ALA  25           3HB      ALA  25   4.959   6.805   4.446
  180    H    THR  26           H        THR  26   5.275   5.271   7.949
  181    HA   THR  26           HA       THR  26   5.864   2.511   7.020
  182    HB   THR  26           HB       THR  26   5.241   1.863   9.347
  183    HG1  THR  26           1HG      THR  26   4.855   4.597   9.950
  184   HG21  THR  26          3HG2      THR  26   7.616   2.791   8.976
  185   HG22  THR  26          1HG2      THR  26   7.010   3.058  10.622
  186   HG23  THR  26          2HG2      THR  26   7.020   4.386   9.469
  187    H    PHE  27           H        PHE  27   4.039   0.950   7.441
  188    HA   PHE  27           HA       PHE  27   1.723   1.538   5.882
  189    HB2  PHE  27           1HB      PHE  27   2.535  -0.794   6.135
  190    HB3  PHE  27           2HB      PHE  27   2.326  -0.719   7.883
  191    HD1  PHE  27           1HD      PHE  27   0.356  -0.295   4.661
  192    HD2  PHE  27           2HD      PHE  27   0.154  -1.434   8.852
  193    HE1  PHE  27           1HE      PHE  27  -2.018  -0.880   4.392
  194    HE2  PHE  27           2HE      PHE  27  -2.227  -2.044   8.557
  195    HZ   PHE  27           HZ       PHE  27  -3.300  -1.777   6.339
  196    H    SER  28           H        SER  28   2.186   1.442   9.427
  197    HA   SER  28           HA       SER  28  -0.512   1.813  10.266
  198    HB2  SER  28           1HB      SER  28   1.386   1.180  11.791
  199    HB3  SER  28           2HB      SER  28   2.081   2.793  11.606
  200    HG   SER  28           HG       SER  28   0.759   3.378  13.123
  201    H    GLU  29           H        GLU  29   1.998   4.239   9.443
  202    HA   GLU  29           HA       GLU  29   0.390   6.584  10.066
  203    HB2  GLU  29           1HB      GLU  29   2.939   6.196   8.358
  204    HB3  GLU  29           2HB      GLU  29   2.262   7.799   8.727
  205    HG2  GLU  29           1HG      GLU  29   3.242   5.770  10.868
  206    HG3  GLU  29           2HG      GLU  29   4.168   7.171  10.318
  207    H    PHE  30           H        PHE  30   1.178   4.853   7.002
  208    HA   PHE  30           HA       PHE  30  -0.255   6.607   5.214
  209    HB2  PHE  30           1HB      PHE  30   1.550   5.031   4.465
  210    HB3  PHE  30           2HB      PHE  30   0.554   3.644   4.925
  211    HD1  PHE  30           2HD      PHE  30   0.623   6.681   2.653
  212    HD2  PHE  30           1HD      PHE  30  -1.237   2.803   3.366
  213    HE1  PHE  30           2HE      PHE  30  -0.636   6.868   0.518
  214    HE2  PHE  30           1HE      PHE  30  -2.484   3.022   1.226
  215    HZ   PHE  30           HZ       PHE  30  -2.186   5.051  -0.196
  216    H    ALA  31           H        ALA  31  -1.135   3.514   6.817
  217    HA   ALA  31           HA       ALA  31  -3.763   3.227   5.690
  218    HB1  ALA  31           1HB      ALA  31  -2.458   1.341   6.716
  219    HB2  ALA  31           2HB      ALA  31  -4.037   1.477   7.469
  220    HB3  ALA  31           3HB      ALA  31  -2.595   2.074   8.301
  221    H    ALA  32           H        ALA  32  -2.554   4.728   8.697
  222    HA   ALA  32           HA       ALA  32  -5.055   5.309   9.989
  223    HB1  ALA  32           1HB      ALA  32  -2.369   6.831  10.029
  224    HB2  ALA  32           2HB      ALA  32  -2.891   5.612  11.187
  225    HB3  ALA  32           3HB      ALA  32  -3.711   7.176  11.136
  226    H    LYS  33           H        LYS  33  -3.281   7.016   7.386
  227    HA   LYS  33           HA       LYS  33  -5.060   9.334   7.327
  228    HB2  LYS  33           1HB      LYS  33  -2.648   9.414   6.585
  229    HB3  LYS  33           2HB      LYS  33  -3.011   8.338   5.237
  230    HG2  LYS  33           1HG      LYS  33  -4.553  10.039   4.202
  231    HG3  LYS  33           2HG      LYS  33  -4.386  11.116   5.598
  232    HD2  LYS  33           1HD      LYS  33  -1.948  10.302   3.864
  233    HD3  LYS  33           2HD      LYS  33  -2.952  11.694   3.455
  234    HE2  LYS  33           1HE      LYS  33  -2.402  12.798   5.631
  235    HE3  LYS  33           2HE      LYS  33  -1.464  11.394   6.147
  236    HZ1  LYS  33           3HZ      LYS  33  -0.886  13.111   3.803
  237    HZ2  LYS  33           1HZ      LYS  33  -0.017  11.717   4.221
  238    HZ3  LYS  33           2HZ      LYS  33  -0.018  13.057   5.264
  239    H    HIS  34           H        HIS  34  -4.754   6.312   5.345
  240    HA   HIS  34           HA       HIS  34  -7.124   7.052   3.714
  241    HB2  HIS  34           1HB      HIS  34  -5.077   4.769   3.497
  242    HB3  HIS  34           2HB      HIS  34  -6.448   4.947   2.388
  243    HD2  HIS  34           2HD      HIS  34  -6.134   7.054   0.467
  244    HE1  HIS  34           1HE      HIS  34  -2.360   8.394   1.799
  245    HE2  HIS  34           2HE      HIS  34  -4.117   8.637  -0.018
  246    H    ALA  35           H        ALA  35  -6.656   5.628   6.680
  247    HA   ALA  35           HA       ALA  35  -8.002   3.207   6.786
  248    HB1  ALA  35           1HB      ALA  35  -7.003   4.003   8.865
  249    HB2  ALA  35           2HB      ALA  35  -8.726   3.960   9.195
  250    HB3  ALA  35           3HB      ALA  35  -7.937   5.495   8.823
  251    H    LYS  36           H        LYS  36  -9.426   6.482   6.628
  252    HA   LYS  36           HA       LYS  36 -12.157   5.540   6.901
  253    HB2  LYS  36           1HB      LYS  36 -10.946   8.286   6.100
  254    HB3  LYS  36           2HB      LYS  36 -12.681   8.031   6.432
  255    HG2  LYS  36           1HG      LYS  36 -12.125   7.331   8.808
  256    HG3  LYS  36           2HG      LYS  36 -10.389   7.579   8.481
  257    HD2  LYS  36           1HD      LYS  36 -10.824  10.064   8.015
  258    HD3  LYS  36           2HD      LYS  36 -12.554   9.817   8.373
  259    HE2  LYS  36           1HE      LYS  36 -10.243   9.375  10.380
  260    HE3  LYS  36           2HE      LYS  36 -11.381  10.733  10.401
  261    HZ1  LYS  36           3HZ      LYS  36 -12.532   9.393  11.753
  262    HZ2  LYS  36           1HZ      LYS  36 -11.764   7.981  11.218
  263    HZ3  LYS  36           2HZ      LYS  36 -13.049   8.636  10.321
  264    H    ASP  37           H        ASP  37  -9.906   5.636   4.307
  265    HA   ASP  37           HA       ASP  37 -11.646   6.305   2.124
  266    HB2  ASP  37           1HB      ASP  37  -9.030   6.167   2.089
  267    HB3  ASP  37           2HB      ASP  37  -9.216   4.426   1.909
  268    H    SER  38           H        SER  38 -12.973   4.980   0.889
  269    HA   SER  38           HA       SER  38 -14.179   2.693   2.070
  270    HB2  SER  38           1HB      SER  38 -14.409   3.958  -0.683
  271    HB3  SER  38           2HB      SER  38 -15.384   2.563  -0.219
  272    HG   SER  38           HG       SER  38 -16.605   4.225   0.404
  273    H    ARG  39           H        ARG  39 -11.673   3.061  -0.333
  274    HA   ARG  39           HA       ARG  39 -11.554   0.348  -1.353
  275    HB2  ARG  39           1HB      ARG  39  -9.503   2.646  -1.357
  276    HB3  ARG  39           2HB      ARG  39  -9.270   1.113  -2.237
  277    HG2  ARG  39           1HG      ARG  39 -11.379   1.578  -3.606
  278    HG3  ARG  39           2HG      ARG  39 -11.610   3.108  -2.731
  279    HD2  ARG  39           1HD      ARG  39  -9.405   3.952  -3.622
  280    HD3  ARG  39           2HD      ARG  39  -9.172   2.417  -4.498
  281    HE   ARG  39           HE       ARG  39 -11.690   3.444  -5.254
  282   HH11  ARG  39          1HH2      ARG  39  -8.341   4.341  -5.481
  283   HH12  ARG  39          2HH2      ARG  39  -8.515   5.187  -6.977
  284   HH21  ARG  39          1HH1      ARG  39 -11.919   4.564  -7.225
  285   HH22  ARG  39          2HH1      ARG  39 -10.546   5.315  -7.964
  286    H    PHE  40           H        PHE  40 -10.278   1.938   1.482
  287    HA   PHE  40           HA       PHE  40  -8.092   0.117   1.972
  288    HB2  PHE  40           1HB      PHE  40  -8.184   2.407   3.000
  289    HB3  PHE  40           2HB      PHE  40  -9.612   1.962   3.924
  290    HD1  PHE  40           1HD      PHE  40  -5.980   1.115   3.387
  291    HD2  PHE  40           2HD      PHE  40  -9.384   0.691   6.079
  292    HE1  PHE  40           1HE      PHE  40  -4.532   0.071   5.089
  293    HE2  PHE  40           2HE      PHE  40  -7.899  -0.350   7.772
  294    HZ   PHE  40           HZ       PHE  40  -5.483  -0.670   7.281
  295    H    LYS  41           H        LYS  41 -11.372   0.405   3.427
  296    HA   LYS  41           HA       LYS  41 -11.252  -2.014   5.015
  297    HB2  LYS  41           1HB      LYS  41 -13.587  -1.526   5.646
  298    HB3  LYS  41           2HB      LYS  41 -12.752   0.040   5.533
  299    HG2  LYS  41           1HG      LYS  41 -13.698   0.377   3.205
  300    HG3  LYS  41           2HG      LYS  41 -14.541  -1.170   3.305
  301    HD2  LYS  41           1HD      LYS  41 -15.855  -0.236   5.330
  302    HD3  LYS  41           2HD      LYS  41 -15.100   1.346   5.019
  303    HE2  LYS  41           1HE      LYS  41 -17.378   1.229   3.919
  304    HE3  LYS  41           2HE      LYS  41 -16.137   1.320   2.673
  305    HZ1  LYS  41           3HZ      LYS  41 -16.672  -1.375   3.465
  306    HZ2  LYS  41           1HZ      LYS  41 -16.673  -0.678   1.916
  307    HZ3  LYS  41           2HZ      LYS  41 -18.062  -0.588   2.884
  308    H    ALA  42           H        ALA  42 -11.813  -1.460   1.634
  309    HA   ALA  42           HA       ALA  42 -13.685  -3.570   0.980
  310    HB1  ALA  42           1HB      ALA  42 -11.445  -2.334  -0.749
  311    HB2  ALA  42           2HB      ALA  42 -13.042  -1.630  -0.565
  312    HB3  ALA  42           3HB      ALA  42 -12.872  -3.198  -1.359
  313    H    ILE  43           H        ILE  43 -10.189  -3.513   1.492
  314    HA   ILE  43           HA       ILE  43  -9.829  -6.334   0.672
  315    HB   ILE  43           HB       ILE  43  -7.954  -4.337   2.163
  316   HG12  ILE  43          1HG1      ILE  43  -7.825  -5.223  -0.813
  317   HG13  ILE  43          2HG1      ILE  43  -8.575  -3.716  -0.299
  318   HG21  ILE  43          1HG2      ILE  43  -7.363  -7.131   0.903
  319   HG22  ILE  43          2HG2      ILE  43  -7.281  -6.737   2.615
  320   HG23  ILE  43          3HG2      ILE  43  -6.112  -6.048   1.516
  321   HD11  ILE  43          3HD1      ILE  43  -5.643  -4.399   0.259
  322   HD12  ILE  43          1HD1      ILE  43  -6.464  -2.851   0.525
  323   HD13  ILE  43          2HD1      ILE  43  -6.227  -3.464  -1.097
  324    H    GLU  44           H        GLU  44 -10.338  -7.952   1.989
  325    HA   GLU  44           HA       GLU  44 -11.245  -7.605   4.754
  326    HB2  GLU  44           1HB      GLU  44 -11.416 -10.319   4.405
  327    HB3  GLU  44           2HB      GLU  44 -12.631  -9.241   3.713
  328    HG2  GLU  44           1HG      GLU  44 -10.146 -10.027   2.058
  329    HG3  GLU  44           2HG      GLU  44 -11.538 -11.092   2.121
  330    H    LYS  45           H        LYS  45  -8.579  -9.285   3.014
  331    HA   LYS  45           HA       LYS  45  -7.300 -10.356   5.384
  332    HB2  LYS  45           1HB      LYS  45  -6.348 -10.053   2.461
  333    HB3  LYS  45           2HB      LYS  45  -5.429 -10.933   3.713
  334    HG2  LYS  45           1HG      LYS  45  -7.387 -12.528   4.028
  335    HG3  LYS  45           2HG      LYS  45  -8.299 -11.653   2.776
  336    HD2  LYS  45           1HD      LYS  45  -6.513 -12.263   1.047
  337    HD3  LYS  45           2HD      LYS  45  -5.607 -13.135   2.298
  338    HE2  LYS  45           1HE      LYS  45  -7.540 -14.732   2.585
  339    HE3  LYS  45           2HE      LYS  45  -8.450 -13.854   1.336
  340    HZ1  LYS  45           3HZ      LYS  45  -7.317 -14.878  -0.253
  341    HZ2  LYS  45           1HZ      LYS  45  -6.677 -15.906   0.933
  342    HZ3  LYS  45           2HZ      LYS  45  -5.815 -14.521   0.455
  343    H    MET  46           H        MET  46  -6.412  -9.004   6.828
  344    HA   MET  46           HA       MET  46  -5.352  -6.419   6.314
  345    HB2  MET  46           1HB      MET  46  -6.269  -7.155   8.545
  346    HB3  MET  46           2HB      MET  46  -4.920  -8.284   8.711
  347    HG2  MET  46           1HG      MET  46  -3.280  -6.323   8.715
  348    HG3  MET  46           2HG      MET  46  -4.627  -5.205   8.515
  349    HE1  MET  46           3HE      MET  46  -3.482  -8.273  10.796
  350    HE2  MET  46           1HE      MET  46  -3.378  -7.451  12.353
  351    HE3  MET  46           2HE      MET  46  -2.332  -6.963  11.026
  352    H    LYS  47           H        LYS  47  -3.915  -9.652   6.518
  353    HA   LYS  47           HA       LYS  47  -1.127  -9.017   6.581
  354    HB2  LYS  47           1HB      LYS  47  -2.608 -11.469   5.420
  355    HB3  LYS  47           2HB      LYS  47  -0.840 -11.395   5.651
  356    HG2  LYS  47           1HG      LYS  47  -1.194 -11.028   8.161
  357    HG3  LYS  47           2HG      LYS  47  -2.959 -11.142   7.916
  358    HD2  LYS  47           1HD      LYS  47  -2.689 -13.537   7.068
  359    HD3  LYS  47           2HD      LYS  47  -0.931 -13.425   7.286
  360    HE2  LYS  47           1HE      LYS  47  -1.264 -13.101   9.771
  361    HE3  LYS  47           2HE      LYS  47  -3.020 -13.228   9.546
  362    HZ1  LYS  47           3HZ      LYS  47  -1.633 -15.384   8.286
  363    HZ2  LYS  47           1HZ      LYS  47  -2.878 -15.426   9.433
  364    HZ3  LYS  47           2HZ      LYS  47  -1.263 -15.294   9.943
  365    H    ASP  48           H        ASP  48  -3.421  -9.353   3.852
  366    HA   ASP  48           HA       ASP  48  -1.478  -9.287   1.734
  367    HB2  ASP  48           1HB      ASP  48  -3.869 -10.086   1.417
  368    HB3  ASP  48           2HB      ASP  48  -4.457  -8.453   1.732
  369    H    ARG  49           H        ARG  49  -3.167  -6.761   3.594
  370    HA   ARG  49           HA       ARG  49  -2.573  -4.511   1.907
  371    HB2  ARG  49           1HB      ARG  49  -2.872  -4.632   4.974
  372    HB3  ARG  49           2HB      ARG  49  -2.853  -3.154   4.036
  373    HG2  ARG  49           1HG      ARG  49  -4.948  -3.847   2.806
  374    HG3  ARG  49           2HG      ARG  49  -4.974  -5.366   3.726
  375    HD2  ARG  49           1HD      ARG  49  -5.208  -4.037   5.883
  376    HD3  ARG  49           2HD      ARG  49  -5.239  -2.557   4.928
  377    HE   ARG  49           HE       ARG  49  -7.215  -4.133   3.840
  378   HH11  ARG  49          1HH2      ARG  49  -6.525  -2.873   7.007
  379   HH12  ARG  49          2HH2      ARG  49  -8.190  -2.657   7.426
  380   HH21  ARG  49          1HH1      ARG  49  -9.374  -3.832   4.407
  381   HH22  ARG  49          2HH1      ARG  49  -9.788  -3.202   5.966
  382    H    GLU  50           H        GLU  50  -0.766  -6.014   4.647
  383    HA   GLU  50           HA       GLU  50   1.435  -4.178   4.676
  384    HB2  GLU  50           1HB      GLU  50   0.898  -5.783   6.578
  385    HB3  GLU  50           2HB      GLU  50   1.426  -7.144   5.566
  386    HG2  GLU  50           1HG      GLU  50   3.779  -6.132   5.441
  387    HG3  GLU  50           2HG      GLU  50   3.250  -4.767   6.429
  388    H    ALA  51           H        ALA  51   0.914  -7.330   2.976
  389    HA   ALA  51           HA       ALA  51   3.473  -7.690   1.823
  390    HB1  ALA  51           1HB      ALA  51   0.738  -8.435   0.602
  391    HB2  ALA  51           2HB      ALA  51   1.621  -9.409   1.769
  392    HB3  ALA  51           3HB      ALA  51   2.294  -9.152   0.148
  393    H    LEU  52           H        LEU  52   0.600  -5.999   0.416
  394    HA   LEU  52           HA       LEU  52   1.849  -5.127  -1.987
  395    HB2  LEU  52           1HB      LEU  52  -0.705  -4.408  -0.525
  396    HB3  LEU  52           2HB      LEU  52  -0.191  -3.326  -1.820
  397    HG   LEU  52           HG       LEU  52  -1.833  -5.134  -2.627
  398   HD11  LEU  52          1HD1      LEU  52   0.131  -4.125  -4.144
  399   HD12  LEU  52          2HD1      LEU  52  -0.834  -5.464  -4.696
  400   HD13  LEU  52          3HD1      LEU  52   0.765  -5.782  -4.084
  401   HD21  LEU  52          3HD2      LEU  52  -1.253  -7.483  -2.711
  402   HD22  LEU  52          1HD2      LEU  52  -0.965  -6.979  -1.084
  403   HD23  LEU  52          2HD2      LEU  52   0.397  -7.205  -2.160
  404    H    PHE  53           H        PHE  53   1.410  -3.556   1.181
  405    HA   PHE  53           HA       PHE  53   2.398  -0.984   0.520
  406    HB2  PHE  53           1HB      PHE  53   1.160  -1.592   2.650
  407    HB3  PHE  53           2HB      PHE  53   2.584  -2.471   3.193
  408    HD1  PHE  53           1HD      PHE  53   1.284   0.958   2.327
  409    HD2  PHE  53           2HD      PHE  53   4.643  -1.253   4.016
  410    HE1  PHE  53           1HE      PHE  53   2.344   3.060   3.050
  411    HE2  PHE  53           2HE      PHE  53   5.661   0.888   4.744
  412    HZ   PHE  53           HZ       PHE  53   4.505   3.041   4.253
  413    H    ASN  54           H        ASN  54   4.088  -3.813   1.842
  414    HA   ASN  54           HA       ASN  54   6.731  -2.692   1.945
  415    HB2  ASN  54           1HB      ASN  54   5.667  -5.566   1.820
  416    HB3  ASN  54           2HB      ASN  54   7.409  -5.261   1.825
  417   HD21  ASN  54          1HD2      ASN  54   4.522  -4.097   3.667
  418   HD22  ASN  54          2HD2      ASN  54   5.272  -4.197   5.186
  419    H    GLU  55           H        GLU  55   4.989  -4.520  -0.621
  420    HA   GLU  55           HA       GLU  55   7.185  -4.689  -2.486
  421    HB2  GLU  55           1HB      GLU  55   5.130  -6.203  -2.567
  422    HB3  GLU  55           2HB      GLU  55   4.146  -4.818  -3.050
  423    HG2  GLU  55           1HG      GLU  55   5.504  -4.567  -5.191
  424    HG3  GLU  55           2HG      GLU  55   6.543  -5.906  -4.697
  425    H    PHE  56           H        PHE  56   4.429  -2.379  -2.071
  426    HA   PHE  56           HA       PHE  56   4.813  -0.833  -4.403
  427    HB2  PHE  56           1HB      PHE  56   2.721  -0.706  -3.015
  428    HB3  PHE  56           2HB      PHE  56   3.631  -0.017  -1.664
  429    HD1  PHE  56           2HD      PHE  56   2.703   0.598  -5.295
  430    HD2  PHE  56           1HD      PHE  56   4.077   2.464  -1.601
  431    HE1  PHE  56           2HE      PHE  56   2.535   2.840  -6.340
  432    HE2  PHE  56           1HE      PHE  56   3.911   4.698  -2.682
  433    HZ   PHE  56           HZ       PHE  56   3.147   4.888  -5.045
  434    H    VAL  57           H        VAL  57   6.043  -0.303  -1.039
  435    HA   VAL  57           HA       VAL  57   7.514   2.114  -1.530
  436    HB   VAL  57           HB       VAL  57   7.810  -0.111   0.612
  437   HG11  VAL  57          1HG1      VAL  57   9.271   2.625   0.449
  438   HG12  VAL  57          2HG1      VAL  57  10.016   1.033   0.618
  439   HG13  VAL  57          3HG1      VAL  57   9.119   1.716   1.963
  440   HG21  VAL  57          3HG2      VAL  57   6.571   2.729   0.832
  441   HG22  VAL  57          1HG2      VAL  57   6.589   1.496   2.105
  442   HG23  VAL  57          2HG2      VAL  57   5.630   1.258   0.650
  443    H    ALA  58           H        ALA  58   8.491  -1.353  -1.554
  444    HA   ALA  58           HA       ALA  58  11.270  -0.936  -2.117
  445    HB1  ALA  58           1HB      ALA  58   9.473  -3.387  -2.694
  446    HB2  ALA  58           2HB      ALA  58  10.355  -3.094  -1.195
  447    HB3  ALA  58           3HB      ALA  58  11.250  -3.414  -2.688
  448    H    ALA  59           H        ALA  59   8.393  -1.395  -4.243
  449    HA   ALA  59           HA       ALA  59   9.853  -1.513  -6.761
  450    HB1  ALA  59           1HB      ALA  59   6.873  -1.006  -6.142
  451    HB2  ALA  59           2HB      ALA  59   7.602  -2.585  -6.439
  452    HB3  ALA  59           3HB      ALA  59   7.528  -1.396  -7.746
  453    H    ALA  60           H        ALA  60   7.995   1.044  -4.993
  454    HA   ALA  60           HA       ALA  60   8.141   3.119  -6.996
  455    HB1  ALA  60           1HB      ALA  60   7.465   4.642  -5.068
  456    HB2  ALA  60           2HB      ALA  60   7.806   3.329  -3.923
  457    HB3  ALA  60           3HB      ALA  60   6.491   3.158  -5.084
  458    H    ARG  61           H        ARG  61  10.196   2.328  -4.118
  459    HA   ARG  61           HA       ARG  61  11.940   4.583  -4.431
  460    HB2  ARG  61           1HB      ARG  61  11.630   3.395  -2.208
  461    HB3  ARG  61           2HB      ARG  61  12.376   1.929  -2.878
  462    HG2  ARG  61           1HG      ARG  61  14.574   3.186  -3.213
  463    HG3  ARG  61           2HG      ARG  61  13.818   4.665  -2.605
  464    HD2  ARG  61           1HD      ARG  61  13.501   3.535  -0.342
  465    HD3  ARG  61           2HD      ARG  61  14.291   2.083  -0.994
  466    HE   ARG  61           HE       ARG  61  16.352   3.148  -0.825
  467   HH11  ARG  61          1HH2      ARG  61  13.828   5.577  -0.671
  468   HH12  ARG  61          2HH2      ARG  61  14.907   6.865  -0.254
  469   HH21  ARG  61          1HH1      ARG  61  17.751   4.879  -0.305
  470   HH22  ARG  61          2HH1      ARG  61  17.114   6.470  -0.049
  Start of MODEL   10
    1    H    ILE   5           H        ILE   5 -13.613  -7.731 -11.693
    2    HA   ILE   5           HA       ILE   5 -12.125 -10.220 -12.347
    3    HB   ILE   5           HB       ILE   5 -12.273  -7.738 -14.214
    4   HG12  ILE   5          1HG1      ILE   5 -13.661 -10.491 -14.611
    5   HG13  ILE   5          2HG1      ILE   5 -14.502  -9.004 -14.206
    6   HG21  ILE   5          1HG2      ILE   5 -10.082  -9.097 -14.294
    7   HG22  ILE   5          2HG2      ILE   5 -10.940  -9.133 -15.819
    8   HG23  ILE   5          3HG2      ILE   5 -11.019 -10.528 -14.734
    9   HD11  ILE   5          3HD1      ILE   5 -14.787  -9.314 -16.556
   10   HD12  ILE   5          1HD1      ILE   5 -13.067  -9.593 -16.799
   11   HD13  ILE   5          2HD1      ILE   5 -13.649  -7.981 -16.367
   12    H    MET   6           H        MET   6 -10.930  -9.799 -10.398
   13    HA   MET   6           HA       MET   6  -9.411  -8.701  -8.928
   14    HB2  MET   6           1HB      MET   6  -8.162  -8.543 -11.745
   15    HB3  MET   6           2HB      MET   6  -7.230  -8.396 -10.253
   16    HG2  MET   6           1HG      MET   6  -7.981 -10.757  -9.591
   17    HG3  MET   6           2HG      MET   6  -8.840 -10.881 -11.127
   18    HE1  MET   6           3HE      MET   6  -4.252 -10.952 -10.471
   19    HE2  MET   6           1HE      MET   6  -5.470 -11.509  -9.321
   20    HE3  MET   6           2HE      MET   6  -5.310  -9.798  -9.693
   21    H    GLN   7           H        GLN   7 -11.459  -6.852 -10.150
   22    HA   GLN   7           HA       GLN   7 -10.315  -4.413 -10.992
   23    HB2  GLN   7           1HB      GLN   7 -12.762  -5.111 -11.283
   24    HB3  GLN   7           2HB      GLN   7 -13.018  -4.864  -9.552
   25    HG2  GLN   7           1HG      GLN   7 -12.365  -2.410  -9.824
   26    HG3  GLN   7           2HG      GLN   7 -12.132  -2.664 -11.547
   27   HE21  GLN   7          1HE2      GLN   7 -13.944  -0.744 -10.503
   28   HE22  GLN   7          2HE2      GLN   7 -15.528  -1.211 -10.905
   29    H    ALA   8           H        ALA   8 -11.244  -5.634  -7.781
   30    HA   ALA   8           HA       ALA   8 -10.867  -3.270  -6.244
   31    HB1  ALA   8           1HB      ALA   8 -10.683  -4.871  -4.283
   32    HB2  ALA   8           2HB      ALA   8 -10.518  -6.229  -5.417
   33    HB3  ALA   8           3HB      ALA   8 -12.023  -5.313  -5.352
   34    H    LYS   9           H        LYS   9  -8.627  -5.929  -7.103
   35    HA   LYS   9           HA       LYS   9  -6.441  -4.929  -5.612
   36    HB2  LYS   9           1HB      LYS   9  -6.822  -7.349  -6.645
   37    HB3  LYS   9           2HB      LYS   9  -6.185  -6.690  -8.152
   38    HG2  LYS   9           1HG      LYS   9  -4.022  -6.069  -7.009
   39    HG3  LYS   9           2HG      LYS   9  -4.663  -6.628  -5.453
   40    HD2  LYS   9           1HD      LYS   9  -4.848  -9.006  -6.413
   41    HD3  LYS   9           2HD      LYS   9  -4.096  -8.419  -7.906
   42    HE2  LYS   9           1HE      LYS   9  -2.738  -8.258  -5.133
   43    HE3  LYS   9           2HE      LYS   9  -2.394  -9.500  -6.347
   44    HZ1  LYS   9           3HZ      LYS   9  -0.931  -8.065  -7.150
   45    HZ2  LYS   9           1HZ      LYS   9  -1.538  -6.778  -6.227
   46    HZ3  LYS   9           2HZ      LYS   9  -2.249  -7.164  -7.722
   47    H    GLU  10           H        GLU  10  -7.369  -4.484  -9.005
   48    HA   GLU  10           HA       GLU  10  -5.080  -2.977  -9.865
   49    HB2  GLU  10           1HB      GLU  10  -7.969  -3.234 -10.921
   50    HB3  GLU  10           2HB      GLU  10  -6.758  -2.267 -11.771
   51    HG2  GLU  10           1HG      GLU  10  -6.434  -5.290 -11.165
   52    HG3  GLU  10           2HG      GLU  10  -6.976  -4.651 -12.710
   53    H    ASP  11           H        ASP  11  -8.184  -2.107  -8.483
   54    HA   ASP  11           HA       ASP  11  -7.975   0.752  -8.717
   55    HB2  ASP  11           1HB      ASP  11  -9.592  -0.993  -6.755
   56    HB3  ASP  11           2HB      ASP  11  -9.729   0.756  -6.846
   57    H    PHE  12           H        PHE  12  -6.924  -1.577  -6.268
   58    HA   PHE  12           HA       PHE  12  -6.108   0.300  -4.244
   59    HB2  PHE  12           1HB      PHE  12  -6.378  -2.265  -3.948
   60    HB3  PHE  12           2HB      PHE  12  -4.888  -2.467  -4.839
   61    HD1  PHE  12           2HD      PHE  12  -6.371  -0.874  -1.768
   62    HD2  PHE  12           1HD      PHE  12  -2.648  -2.030  -3.726
   63    HE1  PHE  12           2HE      PHE  12  -5.097  -0.313   0.288
   64    HE2  PHE  12           1HE      PHE  12  -1.407  -1.444  -1.634
   65    HZ   PHE  12           HZ       PHE  12  -2.623  -0.586   0.358
   66    H    LYS  13           H        LYS  13  -4.254  -1.254  -6.926
   67    HA   LYS  13           HA       LYS  13  -1.760   0.016  -6.428
   68    HB2  LYS  13           1HB      LYS  13  -3.016  -1.146  -8.994
   69    HB3  LYS  13           2HB      LYS  13  -1.331  -0.591  -8.917
   70    HG2  LYS  13           1HG      LYS  13  -0.861  -2.240  -7.064
   71    HG3  LYS  13           2HG      LYS  13  -2.547  -2.790  -7.125
   72    HD2  LYS  13           1HD      LYS  13  -2.208  -3.605  -9.501
   73    HD3  LYS  13           2HD      LYS  13  -0.530  -3.023  -9.473
   74    HE2  LYS  13           1HE      LYS  13  -1.620  -5.145  -7.523
   75    HE3  LYS  13           2HE      LYS  13  -0.698  -5.526  -8.984
   76    HZ1  LYS  13           3HZ      LYS  13   0.804  -5.425  -7.160
   77    HZ2  LYS  13           1HZ      LYS  13   0.194  -3.927  -6.649
   78    HZ3  LYS  13           2HZ      LYS  13   1.065  -4.034  -8.101
   79    H    LYS  14           H        LYS  14  -4.499   0.837  -8.434
   80    HA   LYS  14           HA       LYS  14  -3.398   3.036  -9.775
   81    HB2  LYS  14           1HB      LYS  14  -5.592   1.899 -10.414
   82    HB3  LYS  14           2HB      LYS  14  -6.355   2.634  -9.004
   83    HG2  LYS  14           1HG      LYS  14  -5.860   4.952  -9.895
   84    HG3  LYS  14           2HG      LYS  14  -5.008   4.251 -11.278
   85    HD2  LYS  14           1HD      LYS  14  -7.188   3.197 -12.064
   86    HD3  LYS  14           2HD      LYS  14  -8.030   3.924 -10.681
   87    HE2  LYS  14           1HE      LYS  14  -8.333   5.355 -12.750
   88    HE3  LYS  14           2HE      LYS  14  -7.391   6.249 -11.545
   89    HZ1  LYS  14           3HZ      LYS  14  -5.531   6.123 -12.777
   90    HZ2  LYS  14           1HZ      LYS  14  -6.602   5.882 -14.072
   91    HZ3  LYS  14           2HZ      LYS  14  -5.855   4.551 -13.329
   92    H    MET  15           H        MET  15  -5.039   2.706  -6.654
   93    HA   MET  15           HA       MET  15  -5.149   5.519  -6.071
   94    HB2  MET  15           1HB      MET  15  -6.605   3.624  -4.972
   95    HB3  MET  15           2HB      MET  15  -5.187   3.221  -4.013
   96    HG2  MET  15           1HG      MET  15  -6.549   4.754  -2.637
   97    HG3  MET  15           2HG      MET  15  -5.168   5.702  -3.167
   98    HE1  MET  15           3HE      MET  15  -8.133   8.294  -3.240
   99    HE2  MET  15           1HE      MET  15  -6.541   7.909  -2.581
  100    HE3  MET  15           2HE      MET  15  -7.948   6.950  -2.113
  101    H    MET  16           H        MET  16  -2.881   2.929  -5.172
  102    HA   MET  16           HA       MET  16  -1.215   4.429  -3.393
  103    HB2  MET  16           1HB      MET  16  -0.753   1.925  -5.130
  104    HB3  MET  16           2HB      MET  16   0.487   2.506  -4.023
  105    HG2  MET  16           1HG      MET  16  -2.358   1.762  -3.112
  106    HG3  MET  16           2HG      MET  16  -1.003   0.664  -3.048
  107    HE1  MET  16           3HE      MET  16   1.332   1.421  -1.857
  108    HE2  MET  16           1HE      MET  16   0.340   0.408  -0.787
  109    HE3  MET  16           2HE      MET  16   1.155   1.835  -0.168
  110    H    GLU  17           H        GLU  17  -0.859   3.921  -6.906
  111    HA   GLU  17           HA       GLU  17   1.723   5.135  -7.111
  112    HB2  GLU  17           1HB      GLU  17   1.341   5.034  -9.577
  113    HB3  GLU  17           2HB      GLU  17   0.746   3.537  -8.822
  114    HG2  GLU  17           1HG      GLU  17  -1.577   4.530  -8.868
  115    HG3  GLU  17           2HG      GLU  17  -1.004   5.921  -9.740
  116    H    GLU  18           H        GLU  18  -1.555   6.423  -7.562
  117    HA   GLU  18           HA       GLU  18  -0.696   9.126  -8.286
  118    HB2  GLU  18           1HB      GLU  18  -3.113   9.625  -8.438
  119    HB3  GLU  18           2HB      GLU  18  -2.844   8.029  -9.163
  120    HG2  GLU  18           1HG      GLU  18  -3.580   6.995  -6.982
  121    HG3  GLU  18           2HG      GLU  18  -3.925   8.532  -6.300
  122    H    ALA  19           H        ALA  19  -1.182   7.413  -5.328
  123    HA   ALA  19           HA       ALA  19  -1.843   9.776  -3.705
  124    HB1  ALA  19           1HB      ALA  19  -1.431   6.839  -2.931
  125    HB2  ALA  19           2HB      ALA  19  -2.969   7.695  -3.065
  126    HB3  ALA  19           3HB      ALA  19  -1.849   8.105  -1.771
  127    H    LYS  20           H        LYS  20   0.866   8.691  -5.174
  128    HA   LYS  20           HA       LYS  20   2.939   8.041  -3.825
  129    HB2  LYS  20           1HB      LYS  20   2.984   9.323  -6.110
  130    HB3  LYS  20           2HB      LYS  20   3.123  10.815  -5.188
  131    HG2  LYS  20           1HG      LYS  20   5.443  10.354  -5.598
  132    HG3  LYS  20           2HG      LYS  20   5.252   9.624  -4.018
  133    HD2  LYS  20           1HD      LYS  20   4.872   7.331  -5.184
  134    HD3  LYS  20           2HD      LYS  20   5.217   8.112  -6.724
  135    HE2  LYS  20           1HE      LYS  20   7.290   6.994  -5.896
  136    HE3  LYS  20           2HE      LYS  20   7.539   8.750  -5.801
  137    HZ1  LYS  20           3HZ      LYS  20   6.377   7.307  -3.516
  138    HZ2  LYS  20           1HZ      LYS  20   7.257   8.753  -3.535
  139    HZ3  LYS  20           2HZ      LYS  20   8.056   7.270  -3.761
  140    H    PHE  21           H        PHE  21   3.651   8.310  -1.786
  141    HA   PHE  21           HA       PHE  21   3.458  10.948  -0.441
  142    HB2  PHE  21           1HB      PHE  21   2.609   9.800   1.613
  143    HB3  PHE  21           2HB      PHE  21   1.501   9.594   0.257
  144    HD1  PHE  21           1HD      PHE  21   1.412   7.341  -1.030
  145    HD2  PHE  21           2HD      PHE  21   3.800   7.774   2.552
  146    HE1  PHE  21           1HE      PHE  21   1.612   4.869  -0.875
  147    HE2  PHE  21           2HE      PHE  21   4.003   5.289   2.701
  148    HZ   PHE  21           HZ       PHE  21   2.904   3.836   0.981
  149    H    ASN  22           H        ASN  22   4.709  10.775   1.710
  150    HA   ASN  22           HA       ASN  22   7.359  10.555   1.274
  151    HB2  ASN  22           1HB      ASN  22   5.872  10.154   3.884
  152    HB3  ASN  22           2HB      ASN  22   7.624  10.367   3.819
  153   HD21  ASN  22          1HD2      ASN  22   8.230  12.370   2.329
  154   HD22  ASN  22          2HD2      ASN  22   7.345  13.787   2.628
  155    HA   PRO  23           HA       PRO  23   7.757   5.972   0.741
  156    HB2  PRO  23           1HB      PRO  23  10.472   5.808   0.237
  157    HB3  PRO  23           2HB      PRO  23   9.313   6.437  -0.969
  158    HG2  PRO  23           1HG      PRO  23  11.121   7.990   0.911
  159    HG3  PRO  23           2HG      PRO  23  10.803   8.267  -0.823
  160    HD2  PRO  23           1HD      PRO  23   9.548   9.731   1.152
  161    HD3  PRO  23           2HD      PRO  23   8.727   9.346  -0.414
  162    H    ARG  24           H        ARG  24   9.312   7.876   3.185
  163    HA   ARG  24           HA       ARG  24  10.367   5.558   4.683
  164    HB2  ARG  24           1HB      ARG  24  10.364   8.598   5.255
  165    HB3  ARG  24           2HB      ARG  24  11.158   7.407   6.314
  166    HG2  ARG  24           1HG      ARG  24  12.693   6.725   4.417
  167    HG3  ARG  24           2HG      ARG  24  11.893   7.876   3.343
  168    HD2  ARG  24           1HD      ARG  24  12.611   9.779   4.806
  169    HD3  ARG  24           2HD      ARG  24  13.407   8.626   5.911
  170    HE   ARG  24           HE       ARG  24  14.435   8.185   3.309
  171   HH11  ARG  24          1HH2      ARG  24  14.346  10.651   5.744
  172   HH12  ARG  24          2HH2      ARG  24  15.879  11.332   5.312
  173   HH21  ARG  24          1HH1      ARG  24  16.433   9.059   2.738
  174   HH22  ARG  24          2HH1      ARG  24  17.066  10.422   3.598
  175    H    ALA  25           H        ALA  25   7.397   7.033   4.397
  176    HA   ALA  25           HA       ALA  25   6.523   6.907   7.159
  177    HB1  ALA  25           1HB      ALA  25   4.220   7.146   6.169
  178    HB2  ALA  25           2HB      ALA  25   4.905   6.917   4.556
  179    HB3  ALA  25           3HB      ALA  25   5.335   8.335   5.490
  180    H    THR  26           H        THR  26   5.204   5.263   8.033
  181    HA   THR  26           HA       THR  26   5.761   2.541   7.025
  182    HB   THR  26           HB       THR  26   5.084   1.822   9.321
  183    HG1  THR  26           1HG      THR  26   3.473   3.284   9.742
  184   HG21  THR  26          3HG2      THR  26   6.857   2.948  10.666
  185   HG22  THR  26          1HG2      THR  26   6.907   4.300   9.535
  186   HG23  THR  26          2HG2      THR  26   7.472   2.706   9.022
  187    H    PHE  27           H        PHE  27   3.936   1.004   7.368
  188    HA   PHE  27           HA       PHE  27   1.704   1.652   5.742
  189    HB2  PHE  27           1HB      PHE  27   2.556  -0.686   6.015
  190    HB3  PHE  27           2HB      PHE  27   2.148  -0.669   7.720
  191    HD1  PHE  27           2HD      PHE  27   0.596  -0.178   4.289
  192    HD2  PHE  27           1HD      PHE  27  -0.163  -1.351   8.411
  193    HE1  PHE  27           2HE      PHE  27  -1.733  -0.770   3.693
  194    HE2  PHE  27           1HE      PHE  27  -2.515  -1.932   7.791
  195    HZ   PHE  27           HZ       PHE  27  -3.288  -1.659   5.435
  196    H    SER  28           H        SER  28   2.062   1.430   9.294
  197    HA   SER  28           HA       SER  28  -0.664   1.789  10.068
  198    HB2  SER  28           1HB      SER  28   1.185   1.133  11.660
  199    HB3  SER  28           2HB      SER  28   1.886   2.740  11.503
  200    HG   SER  28           HG       SER  28   0.295   2.215  13.307
  201    H    GLU  29           H        GLU  29   1.857   4.222   9.355
  202    HA   GLU  29           HA       GLU  29   0.240   6.529  10.014
  203    HB2  GLU  29           1HB      GLU  29   2.774   6.189   8.267
  204    HB3  GLU  29           2HB      GLU  29   2.086   7.777   8.685
  205    HG2  GLU  29           1HG      GLU  29   2.436   7.281  11.140
  206    HG3  GLU  29           2HG      GLU  29   3.099   5.713  10.744
  207    H    PHE  30           H        PHE  30   1.031   4.844   6.948
  208    HA   PHE  30           HA       PHE  30  -0.394   6.607   5.184
  209    HB2  PHE  30           1HB      PHE  30   1.389   5.009   4.409
  210    HB3  PHE  30           2HB      PHE  30   0.385   3.648   4.874
  211    HD1  PHE  30           2HD      PHE  30   0.469   6.696   2.625
  212    HD2  PHE  30           1HD      PHE  30  -1.451   2.843   3.347
  213    HE1  PHE  30           2HE      PHE  30  -0.809   6.908   0.495
  214    HE2  PHE  30           1HE      PHE  30  -2.721   3.093   1.211
  215    HZ   PHE  30           HZ       PHE  30  -2.401   5.121  -0.211
  216    H    ALA  31           H        ALA  31  -1.280   3.500   6.753
  217    HA   ALA  31           HA       ALA  31  -3.906   3.221   5.639
  218    HB1  ALA  31           1HB      ALA  31  -2.655   2.072   8.224
  219    HB2  ALA  31           2HB      ALA  31  -2.701   1.274   6.659
  220    HB3  ALA  31           3HB      ALA  31  -4.193   1.541   7.557
  221    H    ALA  32           H        ALA  32  -2.680   4.726   8.630
  222    HA   ALA  32           HA       ALA  32  -5.159   5.333   9.940
  223    HB1  ALA  32           1HB      ALA  32  -2.970   5.601  11.119
  224    HB2  ALA  32           2HB      ALA  32  -3.808   7.151  11.109
  225    HB3  ALA  32           3HB      ALA  32  -2.476   6.852   9.977
  226    H    LYS  33           H        LYS  33  -3.353   7.034   7.410
  227    HA   LYS  33           HA       LYS  33  -5.094   9.360   7.415
  228    HB2  LYS  33           1HB      LYS  33  -2.659   9.377   6.572
  229    HB3  LYS  33           2HB      LYS  33  -3.156   8.365   5.214
  230    HG2  LYS  33           1HG      LYS  33  -4.755  10.173   4.412
  231    HG3  LYS  33           2HG      LYS  33  -4.335  11.177   5.808
  232    HD2  LYS  33           1HD      LYS  33  -1.944  11.307   4.964
  233    HD3  LYS  33           2HD      LYS  33  -2.394  10.318   3.564
  234    HE2  LYS  33           1HE      LYS  33  -4.021  12.102   2.812
  235    HE3  LYS  33           2HE      LYS  33  -3.598  13.092   4.224
  236    HZ1  LYS  33           3HZ      LYS  33  -1.614  13.607   3.380
  237    HZ2  LYS  33           1HZ      LYS  33  -2.395  13.311   1.908
  238    HZ3  LYS  33           2HZ      LYS  33  -1.408  12.115   2.600
  239    H    HIS  34           H        HIS  34  -4.893   6.396   5.376
  240    HA   HIS  34           HA       HIS  34  -7.285   7.211   3.818
  241    HB2  HIS  34           1HB      HIS  34  -5.275   4.890   3.515
  242    HB3  HIS  34           2HB      HIS  34  -6.669   5.104   2.443
  243    HD2  HIS  34           2HD      HIS  34  -6.416   7.268   0.598
  244    HE1  HIS  34           1HE      HIS  34  -2.532   8.433   1.744
  245    HE2  HIS  34           2HE      HIS  34  -4.364   8.767   0.025
  246    H    ALA  35           H        ALA  35  -6.785   5.784   6.746
  247    HA   ALA  35           HA       ALA  35  -8.131   3.352   6.851
  248    HB1  ALA  35           1HB      ALA  35  -7.133   4.094   8.940
  249    HB2  ALA  35           2HB      ALA  35  -8.849   4.157   9.278
  250    HB3  ALA  35           3HB      ALA  35  -7.981   5.641   8.890
  251    H    LYS  36           H        LYS  36  -9.546   6.612   6.737
  252    HA   LYS  36           HA       LYS  36 -12.256   5.747   7.121
  253    HB2  LYS  36           1HB      LYS  36 -12.773   8.192   6.663
  254    HB3  LYS  36           2HB      LYS  36 -11.362   8.076   7.713
  255    HG2  LYS  36           1HG      LYS  36  -9.841   8.356   5.626
  256    HG3  LYS  36           2HG      LYS  36 -11.276   8.551   4.635
  257    HD2  LYS  36           1HD      LYS  36 -10.565  10.811   5.021
  258    HD3  LYS  36           2HD      LYS  36 -11.906  10.600   6.139
  259    HE2  LYS  36           1HE      LYS  36 -10.272  10.217   8.029
  260    HE3  LYS  36           2HE      LYS  36  -8.923  10.383   6.904
  261    HZ1  LYS  36           3HZ      LYS  36  -9.879  12.392   8.273
  262    HZ2  LYS  36           1HZ      LYS  36 -10.922  12.498   6.941
  263    HZ3  LYS  36           2HZ      LYS  36  -9.245  12.588   6.706
  264    H    ASP  37           H        ASP  37 -10.124   5.661   4.450
  265    HA   ASP  37           HA       ASP  37 -11.921   6.210   2.300
  266    HB2  ASP  37           1HB      ASP  37  -9.309   6.006   2.156
  267    HB3  ASP  37           2HB      ASP  37  -9.536   4.265   2.113
  268    H    SER  38           H        SER  38 -13.304   4.822   1.188
  269    HA   SER  38           HA       SER  38 -14.477   2.635   2.618
  270    HB2  SER  38           1HB      SER  38 -15.770   4.109   1.081
  271    HB3  SER  38           2HB      SER  38 -14.844   3.513  -0.292
  272    HG   SER  38           HG       SER  38 -16.013   1.762  -0.283
  273    H    ARG  39           H        ARG  39 -12.015   2.848   0.174
  274    HA   ARG  39           HA       ARG  39 -12.022   0.091  -0.768
  275    HB2  ARG  39           1HB      ARG  39  -9.843   2.282  -0.879
  276    HB3  ARG  39           2HB      ARG  39  -9.742   0.720  -1.726
  277    HG2  ARG  39           1HG      ARG  39 -11.879   1.307  -2.984
  278    HG3  ARG  39           2HG      ARG  39 -11.910   2.877  -2.184
  279    HD2  ARG  39           1HD      ARG  39  -9.694   3.456  -3.255
  280    HD3  ARG  39           2HD      ARG  39  -9.675   1.886  -4.068
  281    HE   ARG  39           HE       ARG  39 -11.203   4.221  -4.834
  282   HH11  ARG  39          1HH2      ARG  39 -11.339   0.708  -4.829
  283   HH12  ARG  39          2HH2      ARG  39 -12.383   0.627  -6.207
  284   HH21  ARG  39          1HH1      ARG  39 -12.582   4.065  -6.594
  285   HH22  ARG  39          2HH1      ARG  39 -13.080   2.523  -7.199
  286    H    PHE  40           H        PHE  40 -10.765   1.722   2.001
  287    HA   PHE  40           HA       PHE  40  -8.609  -0.082   2.545
  288    HB2  PHE  40           1HB      PHE  40  -8.836   2.267   3.542
  289    HB3  PHE  40           2HB      PHE  40 -10.173   1.708   4.524
  290    HD1  PHE  40           2HD      PHE  40  -6.521   1.181   3.800
  291    HD2  PHE  40           1HD      PHE  40  -9.750   0.379   6.626
  292    HE1  PHE  40           2HE      PHE  40  -4.906   0.257   5.416
  293    HE2  PHE  40           1HE      PHE  40  -8.090  -0.565   8.233
  294    HZ   PHE  40           HZ       PHE  40  -5.666  -0.629   7.628
  295    H    LYS  41           H        LYS  41 -11.864   0.226   3.978
  296    HA   LYS  41           HA       LYS  41 -11.750  -2.200   5.556
  297    HB2  LYS  41           1HB      LYS  41 -14.080  -1.673   6.184
  298    HB3  LYS  41           2HB      LYS  41 -13.199  -0.133   6.112
  299    HG2  LYS  41           1HG      LYS  41 -14.133   0.296   3.798
  300    HG3  LYS  41           2HG      LYS  41 -15.006  -1.233   3.841
  301    HD2  LYS  41           1HD      LYS  41 -16.354  -0.376   5.829
  302    HD3  LYS  41           2HD      LYS  41 -15.519   1.181   5.695
  303    HE2  LYS  41           1HE      LYS  41 -17.762   1.278   4.518
  304    HE3  LYS  41           2HE      LYS  41 -16.472   1.442   3.332
  305    HZ1  LYS  41           3HZ      LYS  41 -17.300  -1.267   3.941
  306    HZ2  LYS  41           1HZ      LYS  41 -16.865  -0.574   2.457
  307    HZ3  LYS  41           2HZ      LYS  41 -18.423  -0.322   3.091
  308    H    ALA  42           H        ALA  42 -12.389  -1.576   2.198
  309    HA   ALA  42           HA       ALA  42 -14.330  -3.622   1.584
  310    HB1  ALA  42           1HB      ALA  42 -13.534  -3.267  -0.790
  311    HB2  ALA  42           2HB      ALA  42 -12.127  -2.376  -0.192
  312    HB3  ALA  42           3HB      ALA  42 -13.734  -1.697   0.003
  313    H    ILE  43           H        ILE  43 -10.809  -3.607   1.861
  314    HA   ILE  43           HA       ILE  43 -10.573  -6.460   1.070
  315    HB   ILE  43           HB       ILE  43  -8.465  -4.471   2.126
  316   HG12  ILE  43          1HG1      ILE  43  -8.854  -5.374  -0.817
  317   HG13  ILE  43          2HG1      ILE  43  -9.527  -3.875  -0.204
  318   HG21  ILE  43          1HG2      ILE  43  -6.795  -6.228   1.205
  319   HG22  ILE  43          2HG2      ILE  43  -8.146  -7.304   0.896
  320   HG23  ILE  43          3HG2      ILE  43  -7.750  -6.830   2.546
  321   HD11  ILE  43          3HD1      ILE  43  -7.329  -2.956   0.251
  322   HD12  ILE  43          1HD1      ILE  43  -7.324  -3.575  -1.397
  323   HD13  ILE  43          2HD1      ILE  43  -6.540  -4.492  -0.119
  324    H    GLU  44           H        GLU  44 -10.910  -7.971   2.516
  325    HA   GLU  44           HA       GLU  44 -11.344  -7.521   5.333
  326    HB2  GLU  44           1HB      GLU  44 -11.168 -10.058   3.571
  327    HB3  GLU  44           2HB      GLU  44 -11.648 -10.098   5.277
  328    HG2  GLU  44           1HG      GLU  44 -13.139  -8.541   3.037
  329    HG3  GLU  44           2HG      GLU  44 -13.671 -10.067   3.738
  330    H    LYS  45           H        LYS  45  -8.812  -9.187   3.394
  331    HA   LYS  45           HA       LYS  45  -7.213  -9.934   5.690
  332    HB2  LYS  45           1HB      LYS  45  -6.633 -10.006   2.654
  333    HB3  LYS  45           2HB      LYS  45  -5.564 -10.713   3.887
  334    HG2  LYS  45           1HG      LYS  45  -7.458 -12.242   4.636
  335    HG3  LYS  45           2HG      LYS  45  -8.503 -11.546   3.383
  336    HD2  LYS  45           1HD      LYS  45  -6.936 -12.400   1.583
  337    HD3  LYS  45           2HD      LYS  45  -5.851 -13.062   2.823
  338    HE2  LYS  45           1HE      LYS  45  -7.332 -14.876   1.893
  339    HE3  LYS  45           2HE      LYS  45  -7.724 -14.609   3.601
  340    HZ1  LYS  45           3HZ      LYS  45  -9.686 -13.649   3.097
  341    HZ2  LYS  45           1HZ      LYS  45  -9.556 -14.629   1.720
  342    HZ3  LYS  45           2HZ      LYS  45  -9.138 -12.986   1.635
  343    H    MET  46           H        MET  46  -6.278  -8.414   6.784
  344    HA   MET  46           HA       MET  46  -5.331  -5.951   5.729
  345    HB2  MET  46           1HB      MET  46  -6.059  -6.191   8.107
  346    HB3  MET  46           2HB      MET  46  -4.717  -7.287   8.408
  347    HG2  MET  46           1HG      MET  46  -3.061  -5.435   7.887
  348    HG3  MET  46           2HG      MET  46  -4.385  -4.352   7.497
  349    HE1  MET  46           3HE      MET  46  -1.976  -5.491  10.239
  350    HE2  MET  46           1HE      MET  46  -3.156  -6.809  10.347
  351    HE3  MET  46           2HE      MET  46  -2.977  -5.686  11.675
  352    H    LYS  47           H        LYS  47  -3.883  -9.074   6.363
  353    HA   LYS  47           HA       LYS  47  -1.126  -8.495   6.225
  354    HB2  LYS  47           1HB      LYS  47  -2.689 -11.011   5.361
  355    HB3  LYS  47           2HB      LYS  47  -0.928 -10.945   5.538
  356    HG2  LYS  47           1HG      LYS  47  -1.227 -10.333   8.011
  357    HG3  LYS  47           2HG      LYS  47  -2.975 -10.429   7.802
  358    HD2  LYS  47           1HD      LYS  47  -2.332 -12.566   8.768
  359    HD3  LYS  47           2HD      LYS  47  -2.683 -12.916   7.083
  360    HE2  LYS  47           1HE      LYS  47  -0.228 -12.951   6.550
  361    HE3  LYS  47           2HE      LYS  47   0.165 -12.469   8.202
  362    HZ1  LYS  47           3HZ      LYS  47  -0.498 -15.028   7.153
  363    HZ2  LYS  47           1HZ      LYS  47  -1.486 -14.622   8.468
  364    HZ3  LYS  47           2HZ      LYS  47   0.201 -14.613   8.646
  365    H    ASP  48           H        ASP  48  -3.521  -9.070   3.650
  366    HA   ASP  48           HA       ASP  48  -1.643  -9.324   1.522
  367    HB2  ASP  48           1HB      ASP  48  -4.119 -10.025   1.372
  368    HB3  ASP  48           2HB      ASP  48  -4.585  -8.326   1.400
  369    H    ARG  49           H        ARG  49  -3.256  -6.538   3.013
  370    HA   ARG  49           HA       ARG  49  -2.407  -4.560   1.091
  371    HB2  ARG  49           1HB      ARG  49  -3.233  -4.300   4.041
  372    HB3  ARG  49           2HB      ARG  49  -2.855  -2.909   3.026
  373    HG2  ARG  49           1HG      ARG  49  -4.676  -3.587   1.403
  374    HG3  ARG  49           2HG      ARG  49  -5.042  -4.987   2.426
  375    HD2  ARG  49           1HD      ARG  49  -5.259  -2.075   3.399
  376    HD3  ARG  49           2HD      ARG  49  -6.613  -3.008   2.755
  377    HE   ARG  49           HE       ARG  49  -5.294  -4.463   4.838
  378   HH11  ARG  49          1HH2      ARG  49  -7.431  -1.834   4.268
  379   HH12  ARG  49          2HH2      ARG  49  -8.195  -1.928   5.816
  380   HH21  ARG  49          1HH1      ARG  49  -6.294  -4.608   6.886
  381   HH22  ARG  49          2HH1      ARG  49  -7.551  -3.497   7.304
  382    H    GLU  50           H        GLU  50  -0.991  -5.849   4.061
  383    HA   GLU  50           HA       GLU  50   1.183  -4.023   4.271
  384    HB2  GLU  50           1HB      GLU  50   0.421  -5.616   6.118
  385    HB3  GLU  50           2HB      GLU  50   1.119  -6.958   5.210
  386    HG2  GLU  50           1HG      GLU  50   3.418  -5.871   5.364
  387    HG3  GLU  50           2HG      GLU  50   2.727  -4.515   6.250
  388    H    ALA  51           H        ALA  51   0.844  -7.201   2.578
  389    HA   ALA  51           HA       ALA  51   3.514  -7.587   1.738
  390    HB1  ALA  51           1HB      ALA  51   0.907  -8.380   0.279
  391    HB2  ALA  51           2HB      ALA  51   1.684  -9.329   1.537
  392    HB3  ALA  51           3HB      ALA  51   2.498  -9.093  -0.021
  393    H    LEU  52           H        LEU  52   0.780  -5.900   0.116
  394    HA   LEU  52           HA       LEU  52   2.196  -5.114  -2.221
  395    HB2  LEU  52           1HB      LEU  52  -0.424  -4.288  -0.946
  396    HB3  LEU  52           2HB      LEU  52   0.215  -3.276  -2.229
  397    HG   LEU  52           HG       LEU  52  -1.392  -5.052  -3.117
  398   HD11  LEU  52          1HD1      LEU  52   1.312  -5.793  -4.359
  399   HD12  LEU  52          2HD1      LEU  52   0.726  -4.132  -4.513
  400   HD13  LEU  52          3HD1      LEU  52  -0.233  -5.459  -5.126
  401   HD21  LEU  52          3HD2      LEU  52  -0.621  -6.866  -1.407
  402   HD22  LEU  52          1HD2      LEU  52   0.721  -7.201  -2.476
  403   HD23  LEU  52          2HD2      LEU  52  -0.940  -7.425  -3.009
  404    H    PHE  53           H        PHE  53   1.605  -3.460   0.814
  405    HA   PHE  53           HA       PHE  53   2.695  -0.938   0.163
  406    HB2  PHE  53           1HB      PHE  53   1.448  -1.223   2.219
  407    HB3  PHE  53           2HB      PHE  53   2.474  -2.521   2.756
  408    HD1  PHE  53           2HD      PHE  53   2.626   1.145   1.835
  409    HD2  PHE  53           1HD      PHE  53   4.462  -2.054   4.153
  410    HE1  PHE  53           2HE      PHE  53   4.231   2.748   2.851
  411    HE2  PHE  53           1HE      PHE  53   6.056  -0.415   5.134
  412    HZ   PHE  53           HZ       PHE  53   5.938   1.972   4.474
  413    H    ASN  54           H        ASN  54   4.262  -3.830   1.587
  414    HA   ASN  54           HA       ASN  54   6.904  -2.765   1.803
  415    HB2  ASN  54           1HB      ASN  54   5.924  -5.677   1.481
  416    HB3  ASN  54           2HB      ASN  54   7.607  -5.266   1.854
  417   HD21  ASN  54          1HD2      ASN  54   5.494  -6.694   3.535
  418   HD22  ASN  54          2HD2      ASN  54   5.454  -5.827   4.994
  419    H    GLU  55           H        GLU  55   5.265  -4.568  -0.799
  420    HA   GLU  55           HA       GLU  55   7.546  -4.767  -2.542
  421    HB2  GLU  55           1HB      GLU  55   5.474  -6.259  -2.718
  422    HB3  GLU  55           2HB      GLU  55   4.544  -4.877  -3.297
  423    HG2  GLU  55           1HG      GLU  55   6.066  -4.690  -5.331
  424    HG3  GLU  55           2HG      GLU  55   7.058  -6.019  -4.734
  425    H    PHE  56           H        PHE  56   4.830  -2.450  -2.251
  426    HA   PHE  56           HA       PHE  56   5.273  -0.964  -4.590
  427    HB2  PHE  56           1HB      PHE  56   3.188  -0.771  -3.201
  428    HB3  PHE  56           2HB      PHE  56   4.099  -0.072  -1.878
  429    HD1  PHE  56           1HD      PHE  56   3.125   0.468  -5.493
  430    HD2  PHE  56           2HD      PHE  56   4.649   2.393  -1.883
  431    HE1  PHE  56           1HE      PHE  56   2.972   2.694  -6.593
  432    HE2  PHE  56           2HE      PHE  56   4.472   4.617  -3.011
  433    HZ   PHE  56           HZ       PHE  56   3.644   4.764  -5.364
  434    H    VAL  57           H        VAL  57   6.444  -0.399  -1.230
  435    HA   VAL  57           HA       VAL  57   7.973   1.970  -1.757
  436    HB   VAL  57           HB       VAL  57   8.206  -0.179   0.464
  437   HG11  VAL  57          1HG1      VAL  57   9.742   2.507   0.178
  438   HG12  VAL  57          2HG1      VAL  57  10.427   0.901   0.472
  439   HG13  VAL  57          3HG1      VAL  57   9.536   1.712   1.749
  440   HG21  VAL  57          3HG2      VAL  57   6.963   2.668   0.550
  441   HG22  VAL  57          1HG2      VAL  57   6.977   1.499   1.869
  442   HG23  VAL  57          2HG2      VAL  57   6.031   1.181   0.426
  443    H    ALA  58           H        ALA  58   8.886  -1.513  -1.620
  444    HA   ALA  58           HA       ALA  58  11.667  -1.159  -2.110
  445    HB1  ALA  58           1HB      ALA  58   9.860  -3.594  -2.694
  446    HB2  ALA  58           2HB      ALA  58  10.704  -3.287  -1.178
  447    HB3  ALA  58           3HB      ALA  58  11.634  -3.640  -2.645
  448    H    ALA  59           H        ALA  59   8.874  -1.659  -4.307
  449    HA   ALA  59           HA       ALA  59  10.400  -1.875  -6.754
  450    HB1  ALA  59           1HB      ALA  59   8.113  -1.681  -7.838
  451    HB2  ALA  59           2HB      ALA  59   7.418  -1.259  -6.262
  452    HB3  ALA  59           3HB      ALA  59   8.101  -2.863  -6.518
  453    H    ALA  60           H        ALA  60   8.592   0.768  -5.118
  454    HA   ALA  60           HA       ALA  60   8.851   2.756  -7.160
  455    HB1  ALA  60           1HB      ALA  60   7.147   2.948  -5.322
  456    HB2  ALA  60           2HB      ALA  60   8.189   4.377  -5.308
  457    HB3  ALA  60           3HB      ALA  60   8.430   3.089  -4.113
  458    H    ARG  61           H        ARG  61  10.782   1.980  -4.248
  459    HA   ARG  61           HA       ARG  61  12.555   4.206  -4.553
  460    HB2  ARG  61           1HB      ARG  61  12.219   3.023  -2.335
  461    HB3  ARG  61           2HB      ARG  61  12.981   1.563  -2.978
  462    HG2  ARG  61           1HG      ARG  61  15.178   2.814  -3.280
  463    HG3  ARG  61           2HG      ARG  61  14.420   4.312  -2.703
  464    HD2  ARG  61           1HD      ARG  61  15.728   3.268  -0.870
  465    HD3  ARG  61           2HD      ARG  61  13.996   3.169  -0.465
  466    HE   ARG  61           HE       ARG  61  14.805   0.809  -1.891
  467   HH11  ARG  61          1HH2      ARG  61  15.093   2.382   1.168
  468   HH12  ARG  61          2HH2      ARG  61  15.331   0.922   2.063
  469   HH21  ARG  61          1HH1      ARG  61  15.114  -1.132  -0.730
  470   HH22  ARG  61          2HH1      ARG  61  15.344  -1.079   0.986
  Start of MODEL   11
    1    H    ILE   5           H        ILE   5 -13.568  -7.803 -11.378
    2    HA   ILE   5           HA       ILE   5 -11.833  -9.725 -12.849
    3    HB   ILE   5           HB       ILE   5 -11.465  -7.784 -14.598
    4   HG12  ILE   5          1HG1      ILE   5 -14.252  -6.745 -13.674
    5   HG13  ILE   5          2HG1      ILE   5 -12.798  -6.044 -12.987
    6   HG21  ILE   5          1HG2      ILE   5 -14.269  -9.116 -14.544
    7   HG22  ILE   5          2HG2      ILE   5 -12.808  -9.865 -15.201
    8   HG23  ILE   5          3HG2      ILE   5 -13.494  -8.436 -15.982
    9   HD11  ILE   5          3HD1      ILE   5 -13.748  -4.766 -14.950
   10   HD12  ILE   5          1HD1      ILE   5 -13.339  -6.136 -15.990
   11   HD13  ILE   5          2HD1      ILE   5 -12.063  -5.250 -15.154
   12    H    MET   6           H        MET   6 -10.984  -9.418 -10.493
   13    HA   MET   6           HA       MET   6  -9.494  -8.460  -8.925
   14    HB2  MET   6           1HB      MET   6  -8.033  -7.924 -11.599
   15    HB3  MET   6           2HB      MET   6  -7.230  -7.986 -10.017
   16    HG2  MET   6           1HG      MET   6  -8.718 -10.367 -11.317
   17    HG3  MET   6           2HG      MET   6  -6.963 -10.171 -11.310
   18    HE1  MET   6           3HE      MET   6  -6.846 -12.634 -10.322
   19    HE2  MET   6           1HE      MET   6  -8.615 -12.739 -10.239
   20    HE3  MET   6           2HE      MET   6  -7.637 -13.150  -8.834
   21    H    GLN   7           H        GLN   7 -11.601  -6.590  -9.831
   22    HA   GLN   7           HA       GLN   7 -10.668  -3.992 -10.471
   23    HB2  GLN   7           1HB      GLN   7 -13.086  -4.770 -10.659
   24    HB3  GLN   7           2HB      GLN   7 -13.219  -4.737  -8.896
   25    HG2  GLN   7           1HG      GLN   7 -12.766  -2.227  -8.916
   26    HG3  GLN   7           2HG      GLN   7 -12.603  -2.256 -10.669
   27   HE21  GLN   7          1HE2      GLN   7 -14.524  -1.607 -11.716
   28   HE22  GLN   7          2HE2      GLN   7 -16.088  -1.757 -11.071
   29    H    ALA   8           H        ALA   8 -11.227  -5.528  -7.274
   30    HA   ALA   8           HA       ALA   8 -10.802  -3.289  -5.558
   31    HB1  ALA   8           1HB      ALA   8 -10.240  -6.284  -5.112
   32    HB2  ALA   8           2HB      ALA   8 -11.743  -5.445  -4.749
   33    HB3  ALA   8           3HB      ALA   8 -10.290  -5.078  -3.815
   34    H    LYS   9           H        LYS   9  -8.423  -5.795  -6.699
   35    HA   LYS   9           HA       LYS   9  -6.126  -4.637  -5.456
   36    HB2  LYS   9           1HB      LYS   9  -6.406  -6.569  -7.855
   37    HB3  LYS   9           2HB      LYS   9  -4.854  -6.192  -7.093
   38    HG2  LYS   9           1HG      LYS   9  -5.695  -7.129  -4.892
   39    HG3  LYS   9           2HG      LYS   9  -7.254  -7.509  -5.658
   40    HD2  LYS   9           1HD      LYS   9  -6.093  -9.116  -7.249
   41    HD3  LYS   9           2HD      LYS   9  -4.523  -8.724  -6.520
   42    HE2  LYS   9           1HE      LYS   9  -5.414 -10.884  -5.576
   43    HE3  LYS   9           2HE      LYS   9  -5.351  -9.651  -4.303
   44    HZ1  LYS   9           3HZ      LYS   9  -7.613  -9.411  -4.296
   45    HZ2  LYS   9           1HZ      LYS   9  -7.496 -11.057  -4.686
   46    HZ3  LYS   9           2HZ      LYS   9  -7.802  -9.916  -5.909
   47    H    GLU  10           H        GLU  10  -7.513  -4.275  -8.760
   48    HA   GLU  10           HA       GLU  10  -5.393  -2.726  -9.894
   49    HB2  GLU  10           1HB      GLU  10  -7.223  -3.899 -11.229
   50    HB3  GLU  10           2HB      GLU  10  -8.401  -2.734 -10.615
   51    HG2  GLU  10           1HG      GLU  10  -7.130  -0.844 -11.761
   52    HG3  GLU  10           2HG      GLU  10  -5.938  -2.000 -12.352
   53    H    ASP  11           H        ASP  11  -8.412  -1.885  -8.215
   54    HA   ASP  11           HA       ASP  11  -8.208   1.002  -8.341
   55    HB2  ASP  11           1HB      ASP  11  -9.686  -0.810  -6.327
   56    HB3  ASP  11           2HB      ASP  11  -9.820   0.948  -6.317
   57    H    PHE  12           H        PHE  12  -7.000  -1.448  -6.017
   58    HA   PHE  12           HA       PHE  12  -6.023   0.380  -4.035
   59    HB2  PHE  12           1HB      PHE  12  -6.379  -2.215  -3.833
   60    HB3  PHE  12           2HB      PHE  12  -4.786  -2.376  -4.573
   61    HD1  PHE  12           2HD      PHE  12  -6.644  -1.056  -1.572
   62    HD2  PHE  12           1HD      PHE  12  -2.715  -1.672  -3.270
   63    HE1  PHE  12           2HE      PHE  12  -5.609  -0.552   0.632
   64    HE2  PHE  12           1HE      PHE  12  -1.701  -1.137  -1.040
   65    HZ   PHE  12           HZ       PHE  12  -3.146  -0.583   0.888
   66    H    LYS  13           H        LYS  13  -4.268  -1.285  -6.727
   67    HA   LYS  13           HA       LYS  13  -1.720  -0.087  -6.313
   68    HB2  LYS  13           1HB      LYS  13  -3.049  -1.300  -8.805
   69    HB3  LYS  13           2HB      LYS  13  -1.343  -0.817  -8.761
   70    HG2  LYS  13           1HG      LYS  13  -0.913  -2.436  -6.867
   71    HG3  LYS  13           2HG      LYS  13  -2.619  -2.905  -6.872
   72    HD2  LYS  13           1HD      LYS  13  -2.380  -3.804  -9.233
   73    HD3  LYS  13           2HD      LYS  13  -0.675  -3.303  -9.260
   74    HE2  LYS  13           1HE      LYS  13  -0.858  -5.757  -8.726
   75    HE3  LYS  13           2HE      LYS  13  -0.206  -4.888  -7.326
   76    HZ1  LYS  13           3HZ      LYS  13  -2.041  -5.292  -6.127
   77    HZ2  LYS  13           1HZ      LYS  13  -2.317  -6.539  -7.236
   78    HZ3  LYS  13           2HZ      LYS  13  -3.099  -5.045  -7.427
   79    H    LYS  14           H        LYS  14  -4.476   0.776  -8.383
   80    HA   LYS  14           HA       LYS  14  -3.329   2.975  -9.727
   81    HB2  LYS  14           1HB      LYS  14  -5.502   1.885 -10.432
   82    HB3  LYS  14           2HB      LYS  14  -6.298   2.577  -9.019
   83    HG2  LYS  14           1HG      LYS  14  -5.808   4.921  -9.867
   84    HG3  LYS  14           2HG      LYS  14  -4.949   4.241 -11.260
   85    HD2  LYS  14           1HD      LYS  14  -7.116   3.166 -12.064
   86    HD3  LYS  14           2HD      LYS  14  -7.969   3.876 -10.676
   87    HE2  LYS  14           1HE      LYS  14  -6.522   5.529 -12.852
   88    HE3  LYS  14           2HE      LYS  14  -8.276   5.302 -12.757
   89    HZ1  LYS  14           3HZ      LYS  14  -8.099   6.234 -10.433
   90    HZ2  LYS  14           1HZ      LYS  14  -7.808   7.336 -11.689
   91    HZ3  LYS  14           2HZ      LYS  14  -6.506   6.689 -10.811
   92    H    MET  15           H        MET  15  -5.150   2.767  -6.639
   93    HA   MET  15           HA       MET  15  -5.158   5.577  -6.085
   94    HB2  MET  15           1HB      MET  15  -6.708   3.831  -4.989
   95    HB3  MET  15           2HB      MET  15  -5.326   3.294  -4.046
   96    HG2  MET  15           1HG      MET  15  -6.624   4.894  -2.631
   97    HG3  MET  15           2HG      MET  15  -5.132   5.714  -3.083
   98    HE1  MET  15           3HE      MET  15  -7.843   8.576  -3.118
   99    HE2  MET  15           1HE      MET  15  -6.282   8.041  -2.481
  100    HE3  MET  15           2HE      MET  15  -7.761   7.188  -2.037
  101    H    MET  16           H        MET  16  -2.920   2.929  -5.125
  102    HA   MET  16           HA       MET  16  -1.186   4.435  -3.387
  103    HB2  MET  16           1HB      MET  16  -0.819   1.838  -4.975
  104    HB3  MET  16           2HB      MET  16   0.435   2.439  -3.911
  105    HG2  MET  16           1HG      MET  16  -2.424   1.848  -2.917
  106    HG3  MET  16           2HG      MET  16  -1.124   0.674  -2.805
  107    HE1  MET  16           3HE      MET  16   1.238   2.081  -0.138
  108    HE2  MET  16           1HE      MET  16   1.291   1.524  -1.799
  109    HE3  MET  16           2HE      MET  16   0.446   0.576  -0.583
  110    H    GLU  17           H        GLU  17  -0.886   3.762  -6.952
  111    HA   GLU  17           HA       GLU  17   1.742   4.936  -7.257
  112    HB2  GLU  17           1HB      GLU  17   1.479   4.561  -9.653
  113    HB3  GLU  17           2HB      GLU  17   0.595   3.238  -8.870
  114    HG2  GLU  17           1HG      GLU  17  -1.550   4.592  -9.208
  115    HG3  GLU  17           2HG      GLU  17  -0.662   5.769 -10.122
  116    H    GLU  18           H        GLU  18  -1.553   6.230  -7.648
  117    HA   GLU  18           HA       GLU  18  -0.669   8.931  -8.537
  118    HB2  GLU  18           1HB      GLU  18  -3.041   9.407  -8.859
  119    HB3  GLU  18           2HB      GLU  18  -2.800   7.736  -9.374
  120    HG2  GLU  18           1HG      GLU  18  -4.773   7.496  -8.033
  121    HG3  GLU  18           2HG      GLU  18  -3.515   7.142  -6.879
  122    H    ALA  19           H        ALA  19  -1.200   7.354  -5.469
  123    HA   ALA  19           HA       ALA  19  -1.822   9.841  -3.995
  124    HB1  ALA  19           1HB      ALA  19  -1.458   6.952  -3.017
  125    HB2  ALA  19           2HB      ALA  19  -2.988   7.801  -3.241
  126    HB3  ALA  19           3HB      ALA  19  -1.894   8.305  -1.961
  127    H    LYS  20           H        LYS  20   0.961   8.978  -5.449
  128    HA   LYS  20           HA       LYS  20   3.095   8.340  -4.114
  129    HB2  LYS  20           1HB      LYS  20   2.866  11.075  -5.512
  130    HB3  LYS  20           2HB      LYS  20   4.430  10.444  -4.985
  131    HG2  LYS  20           1HG      LYS  20   2.614   8.916  -6.931
  132    HG3  LYS  20           2HG      LYS  20   3.827  10.034  -7.494
  133    HD2  LYS  20           1HD      LYS  20   5.650   8.625  -6.392
  134    HD3  LYS  20           2HD      LYS  20   4.444   7.476  -5.832
  135    HE2  LYS  20           1HE      LYS  20   3.876   6.869  -8.181
  136    HE3  LYS  20           2HE      LYS  20   5.013   8.076  -8.789
  137    HZ1  LYS  20           3HZ      LYS  20   5.650   5.530  -8.373
  138    HZ2  LYS  20           1HZ      LYS  20   6.081   6.178  -6.865
  139    HZ3  LYS  20           2HZ      LYS  20   6.775   6.799  -8.285
  140    H    PHE  21           H        PHE  21   3.698   8.418  -2.067
  141    HA   PHE  21           HA       PHE  21   3.366  10.861  -0.413
  142    HB2  PHE  21           1HB      PHE  21   2.556   9.388   1.453
  143    HB3  PHE  21           2HB      PHE  21   1.504   9.251   0.045
  144    HD1  PHE  21           2HD      PHE  21   1.684   7.161  -1.534
  145    HD2  PHE  21           1HD      PHE  21   3.831   7.380   2.236
  146    HE1  PHE  21           2HE      PHE  21   2.062   4.686  -1.579
  147    HE2  PHE  21           1HE      PHE  21   4.218   4.932   2.164
  148    HZ   PHE  21           HZ       PHE  21   3.333   3.583   0.267
  149    H    ASN  22           H        ASN  22   4.762  10.571   1.635
  150    HA   ASN  22           HA       ASN  22   7.452  10.363   1.032
  151    HB2  ASN  22           1HB      ASN  22   5.961  10.019   3.677
  152    HB3  ASN  22           2HB      ASN  22   7.716  10.178   3.604
  153   HD21  ASN  22          1HD2      ASN  22   8.390  12.198   2.118
  154   HD22  ASN  22          2HD2      ASN  22   7.521  13.629   2.408
  155    HA   PRO  23           HA       PRO  23   7.762   5.699   0.555
  156    HB2  PRO  23           1HB      PRO  23  10.474   5.444   0.028
  157    HB3  PRO  23           2HB      PRO  23   9.318   6.080  -1.183
  158    HG2  PRO  23           1HG      PRO  23  11.160   7.632   0.665
  159    HG3  PRO  23           2HG      PRO  23  10.869   7.866  -1.080
  160    HD2  PRO  23           1HD      PRO  23   9.628   9.435   0.802
  161    HD3  PRO  23           2HD      PRO  23   8.795   8.992  -0.713
  162    H    ARG  24           H        ARG  24   9.351   7.631   2.966
  163    HA   ARG  24           HA       ARG  24  10.374   5.319   4.521
  164    HB2  ARG  24           1HB      ARG  24  10.448   8.364   5.026
  165    HB3  ARG  24           2HB      ARG  24  11.214   7.174   6.108
  166    HG2  ARG  24           1HG      ARG  24  12.731   6.419   4.221
  167    HG3  ARG  24           2HG      ARG  24  11.952   7.561   3.118
  168    HD2  ARG  24           1HD      ARG  24  12.734   9.484   4.534
  169    HD3  ARG  24           2HD      ARG  24  13.524   8.339   5.646
  170    HE   ARG  24           HE       ARG  24  14.486   7.811   3.032
  171   HH11  ARG  24          1HH2      ARG  24  14.579  10.375   5.400
  172   HH12  ARG  24          2HH2      ARG  24  16.127  10.971   4.897
  173   HH21  ARG  24          1HH1      ARG  24  16.519   8.609   2.386
  174   HH22  ARG  24          2HH1      ARG  24  17.219   9.970   3.195
  175    H    ALA  25           H        ALA  25   7.406   6.888   4.218
  176    HA   ALA  25           HA       ALA  25   6.536   6.833   7.006
  177    HB1  ALA  25           1HB      ALA  25   5.349   8.261   5.311
  178    HB2  ALA  25           2HB      ALA  25   4.216   7.107   6.006
  179    HB3  ALA  25           3HB      ALA  25   4.897   6.833   4.400
  180    H    THR  26           H        THR  26   5.009   5.283   7.865
  181    HA   THR  26           HA       THR  26   5.542   2.500   6.979
  182    HB   THR  26           HB       THR  26   4.257   3.544   9.589
  183    HG1  THR  26           1HG      THR  26   6.164   4.264   9.941
  184   HG21  THR  26          3HG2      THR  26   5.162   1.321  10.508
  185   HG22  THR  26          1HG2      THR  26   5.570   0.837   8.861
  186   HG23  THR  26          2HG2      THR  26   3.883   1.096   9.318
  187    H    PHE  27           H        PHE  27   3.697   1.006   7.163
  188    HA   PHE  27           HA       PHE  27   1.462   1.735   5.542
  189    HB2  PHE  27           1HB      PHE  27   2.288  -0.606   5.660
  190    HB3  PHE  27           2HB      PHE  27   1.941  -0.683   7.393
  191    HD1  PHE  27           1HD      PHE  27   0.283  -0.097   4.025
  192    HD2  PHE  27           2HD      PHE  27  -0.337  -1.304   8.168
  193    HE1  PHE  27           1HE      PHE  27  -2.088  -0.636   3.534
  194    HE2  PHE  27           2HE      PHE  27  -2.691  -1.858   7.640
  195    HZ   PHE  27           HZ       PHE  27  -3.545  -1.517   5.345
  196    H    SER  28           H        SER  28   1.809   1.371   9.088
  197    HA   SER  28           HA       SER  28  -0.907   1.708   9.887
  198    HB2  SER  28           1HB      SER  28   0.940   0.937  11.409
  199    HB3  SER  28           2HB      SER  28   1.655   2.546  11.362
  200    HG   SER  28           HG       SER  28   0.337   2.931  12.956
  201    H    GLU  29           H        GLU  29   1.631   4.164   9.272
  202    HA   GLU  29           HA       GLU  29   0.044   6.467  10.048
  203    HB2  GLU  29           1HB      GLU  29   2.528   6.208   8.224
  204    HB3  GLU  29           2HB      GLU  29   1.868   7.768   8.759
  205    HG2  GLU  29           1HG      GLU  29   2.945   5.568  10.668
  206    HG3  GLU  29           2HG      GLU  29   3.848   7.010  10.196
  207    H    PHE  30           H        PHE  30   0.717   4.859   6.889
  208    HA   PHE  30           HA       PHE  30  -0.763   6.678   5.211
  209    HB2  PHE  30           1HB      PHE  30   1.024   5.041   4.386
  210    HB3  PHE  30           2HB      PHE  30  -0.087   3.705   4.703
  211    HD1  PHE  30           1HD      PHE  30   0.416   6.831   2.621
  212    HD2  PHE  30           2HD      PHE  30  -2.057   3.275   3.163
  213    HE1  PHE  30           1HE      PHE  30  -0.778   7.316   0.491
  214    HE2  PHE  30           2HE      PHE  30  -3.219   3.780   1.020
  215    HZ   PHE  30           HZ       PHE  30  -2.587   5.795  -0.306
  216    H    ALA  31           H        ALA  31  -1.617   3.563   6.763
  217    HA   ALA  31           HA       ALA  31  -4.286   3.304   5.749
  218    HB1  ALA  31           1HB      ALA  31  -2.974   2.098   8.258
  219    HB2  ALA  31           2HB      ALA  31  -2.984   1.374   6.655
  220    HB3  ALA  31           3HB      ALA  31  -4.494   1.549   7.551
  221    H    ALA  32           H        ALA  32  -2.933   4.778   8.702
  222    HA   ALA  32           HA       ALA  32  -5.355   5.349  10.139
  223    HB1  ALA  32           1HB      ALA  32  -2.682   6.871  10.081
  224    HB2  ALA  32           2HB      ALA  32  -3.103   5.580  11.198
  225    HB3  ALA  32           3HB      ALA  32  -3.950   7.128  11.292
  226    H    LYS  33           H        LYS  33  -3.642   7.154   7.547
  227    HA   LYS  33           HA       LYS  33  -5.416   9.465   7.639
  228    HB2  LYS  33           1HB      LYS  33  -3.026   9.570   6.734
  229    HB3  LYS  33           2HB      LYS  33  -3.506   8.544   5.382
  230    HG2  LYS  33           1HG      LYS  33  -5.158  10.315   4.604
  231    HG3  LYS  33           2HG      LYS  33  -4.722  11.334   5.986
  232    HD2  LYS  33           1HD      LYS  33  -2.336  11.505   5.091
  233    HD3  LYS  33           2HD      LYS  33  -2.808  10.517   3.694
  234    HE2  LYS  33           1HE      LYS  33  -4.008  13.280   4.392
  235    HE3  LYS  33           2HE      LYS  33  -2.873  12.959   3.070
  236    HZ1  LYS  33           3HZ      LYS  33  -4.607  11.285   2.286
  237    HZ2  LYS  33           1HZ      LYS  33  -4.977  12.927   2.088
  238    HZ3  LYS  33           2HZ      LYS  33  -5.682  12.046   3.359
  239    H    HIS  34           H        HIS  34  -5.269   6.495   5.560
  240    HA   HIS  34           HA       HIS  34  -7.714   7.302   4.083
  241    HB2  HIS  34           1HB      HIS  34  -5.773   4.937   3.737
  242    HB3  HIS  34           2HB      HIS  34  -7.190   5.193   2.694
  243    HD2  HIS  34           2HD      HIS  34  -6.828   7.256   0.745
  244    HE1  HIS  34           1HE      HIS  34  -2.967   8.459   1.958
  245    HE2  HIS  34           2HE      HIS  34  -4.769   8.764   0.195
  246    H    ALA  35           H        ALA  35  -7.194   5.907   7.039
  247    HA   ALA  35           HA       ALA  35  -8.589   3.498   7.228
  248    HB1  ALA  35           1HB      ALA  35  -8.442   5.843   9.207
  249    HB2  ALA  35           2HB      ALA  35  -7.485   4.371   9.226
  250    HB3  ALA  35           3HB      ALA  35  -9.186   4.297   9.640
  251    H    LYS  36           H        LYS  36  -9.978   6.808   7.183
  252    HA   LYS  36           HA       LYS  36 -12.715   5.878   7.484
  253    HB2  LYS  36           1HB      LYS  36 -13.256   8.354   7.258
  254    HB3  LYS  36           2HB      LYS  36 -11.933   8.105   8.410
  255    HG2  LYS  36           1HG      LYS  36 -10.229   8.684   6.587
  256    HG3  LYS  36           2HG      LYS  36 -11.555   8.969   5.446
  257    HD2  LYS  36           1HD      LYS  36 -12.409  10.862   6.907
  258    HD3  LYS  36           2HD      LYS  36 -11.092  10.577   8.051
  259    HE2  LYS  36           1HE      LYS  36  -9.407  11.169   6.271
  260    HE3  LYS  36           2HE      LYS  36 -10.716  11.436   5.111
  261    HZ1  LYS  36           3HZ      LYS  36 -10.841  12.870   7.663
  262    HZ2  LYS  36           1HZ      LYS  36 -11.340  13.357   6.117
  263    HZ3  LYS  36           2HZ      LYS  36  -9.691  13.389   6.524
  264    H    ASP  37           H        ASP  37 -10.655   5.619   4.906
  265    HA   ASP  37           HA       ASP  37 -12.452   6.423   2.710
  266    HB2  ASP  37           1HB      ASP  37  -9.844   6.473   2.587
  267    HB3  ASP  37           2HB      ASP  37  -9.893   4.724   2.428
  268    H    SER  38           H        SER  38 -14.052   5.131   1.899
  269    HA   SER  38           HA       SER  38 -14.848   2.628   2.964
  270    HB2  SER  38           1HB      SER  38 -16.406   2.575   0.967
  271    HB3  SER  38           2HB      SER  38 -16.357   4.186   1.701
  272    HG   SER  38           HG       SER  38 -14.478   3.597  -0.278
  273    H    ARG  39           H        ARG  39 -12.595   3.430   0.384
  274    HA   ARG  39           HA       ARG  39 -12.372   0.916  -0.977
  275    HB2  ARG  39           1HB      ARG  39 -11.541   3.229  -1.810
  276    HB3  ARG  39           2HB      ARG  39 -10.215   3.096  -0.667
  277    HG2  ARG  39           1HG      ARG  39 -10.142   0.586  -2.161
  278    HG3  ARG  39           2HG      ARG  39 -10.466   1.834  -3.365
  279    HD2  ARG  39           1HD      ARG  39  -8.001   1.453  -3.104
  280    HD3  ARG  39           2HD      ARG  39  -8.422   3.091  -2.611
  281    HE   ARG  39           HE       ARG  39  -8.495   1.378  -0.312
  282   HH11  ARG  39          1HH2      ARG  39  -6.113   2.664  -2.512
  283   HH12  ARG  39          2HH2      ARG  39  -4.879   2.817  -1.312
  284   HH21  ARG  39          1HH1      ARG  39  -6.844   1.610   1.245
  285   HH22  ARG  39          2HH1      ARG  39  -5.291   2.225   0.793
  286    H    PHE  40           H        PHE  40 -11.069   2.176   2.019
  287    HA   PHE  40           HA       PHE  40  -8.893   0.282   2.323
  288    HB2  PHE  40           1HB      PHE  40  -9.092   2.536   3.597
  289    HB3  PHE  40           2HB      PHE  40 -10.325   1.793   4.616
  290    HD1  PHE  40           2HD      PHE  40  -6.696   1.604   3.573
  291    HD2  PHE  40           1HD      PHE  40  -9.671   0.099   6.389
  292    HE1  PHE  40           2HE      PHE  40  -4.912   0.518   4.902
  293    HE2  PHE  40           1HE      PHE  40  -7.855  -0.995   7.691
  294    HZ   PHE  40           HZ       PHE  40  -5.485  -0.792   6.951
  295    H    LYS  41           H        LYS  41 -12.226   0.476   3.525
  296    HA   LYS  41           HA       LYS  41 -12.256  -1.981   5.021
  297    HB2  LYS  41           1HB      LYS  41 -14.639  -0.354   3.913
  298    HB3  LYS  41           2HB      LYS  41 -14.746  -1.545   5.222
  299    HG2  LYS  41           1HG      LYS  41 -13.119   1.097   5.383
  300    HG3  LYS  41           2HG      LYS  41 -14.745   0.877   6.050
  301    HD2  LYS  41           1HD      LYS  41 -13.864  -0.916   7.628
  302    HD3  LYS  41           2HD      LYS  41 -12.235  -0.697   6.983
  303    HE2  LYS  41           1HE      LYS  41 -12.500   0.592   9.130
  304    HE3  LYS  41           2HE      LYS  41 -12.228   1.691   7.778
  305    HZ1  LYS  41           3HZ      LYS  41 -15.008   1.100   8.185
  306    HZ2  LYS  41           1HZ      LYS  41 -14.231   2.602   8.034
  307    HZ3  LYS  41           2HZ      LYS  41 -14.287   1.822   9.542
  308    H    ALA  42           H        ALA  42 -12.352  -1.436   1.639
  309    HA   ALA  42           HA       ALA  42 -14.140  -3.525   0.732
  310    HB1  ALA  42           1HB      ALA  42 -11.706  -2.286  -0.700
  311    HB2  ALA  42           2HB      ALA  42 -13.293  -1.525  -0.655
  312    HB3  ALA  42           3HB      ALA  42 -13.083  -3.080  -1.473
  313    H    ILE  43           H        ILE  43 -10.667  -3.405   1.516
  314    HA   ILE  43           HA       ILE  43 -10.253  -6.248   0.814
  315    HB   ILE  43           HB       ILE  43  -8.209  -4.429   2.277
  316   HG12  ILE  43          1HG1      ILE  43  -7.354  -4.268  -0.385
  317   HG13  ILE  43          2HG1      ILE  43  -9.086  -4.321  -0.671
  318   HG21  ILE  43          1HG2      ILE  43  -7.735  -6.942   2.135
  319   HG22  ILE  43          2HG2      ILE  43  -6.523  -5.987   1.286
  320   HG23  ILE  43          3HG2      ILE  43  -7.775  -6.835   0.375
  321   HD11  ILE  43          3HD1      ILE  43  -9.185  -2.376   1.101
  322   HD12  ILE  43          1HD1      ILE  43  -8.597  -2.029  -0.513
  323   HD13  ILE  43          2HD1      ILE  43  -7.469  -2.260   0.808
  324    H    GLU  44           H        GLU  44 -10.480  -7.880   2.257
  325    HA   GLU  44           HA       GLU  44 -11.349  -7.316   5.013
  326    HB2  GLU  44           1HB      GLU  44 -12.467  -9.043   3.404
  327    HB3  GLU  44           2HB      GLU  44 -11.029 -10.046   3.599
  328    HG2  GLU  44           1HG      GLU  44 -12.704 -10.881   5.218
  329    HG3  GLU  44           2HG      GLU  44 -11.478 -10.053   6.170
  330    H    LYS  45           H        LYS  45  -8.748  -9.063   3.286
  331    HA   LYS  45           HA       LYS  45  -7.315  -9.902   5.670
  332    HB2  LYS  45           1HB      LYS  45  -6.494  -9.848   2.689
  333    HB3  LYS  45           2HB      LYS  45  -5.533 -10.615   3.969
  334    HG2  LYS  45           1HG      LYS  45  -7.475 -12.188   4.475
  335    HG3  LYS  45           2HG      LYS  45  -8.419 -11.429   3.178
  336    HD2  LYS  45           1HD      LYS  45  -6.678 -12.185   1.473
  337    HD3  LYS  45           2HD      LYS  45  -5.738 -12.941   2.764
  338    HE2  LYS  45           1HE      LYS  45  -7.649 -14.517   3.238
  339    HE3  LYS  45           2HE      LYS  45  -8.595 -13.758   1.950
  340    HZ1  LYS  45           3HZ      LYS  45  -7.643 -15.517   0.871
  341    HZ2  LYS  45           1HZ      LYS  45  -6.199 -15.445   1.754
  342    HZ3  LYS  45           2HZ      LYS  45  -6.507 -14.298   0.540
  343    H    MET  46           H        MET  46  -5.510  -9.014   6.578
  344    HA   MET  46           HA       MET  46  -4.751  -6.239   5.853
  345    HB2  MET  46           1HB      MET  46  -5.683  -6.651   8.159
  346    HB3  MET  46           2HB      MET  46  -4.385  -7.799   8.476
  347    HG2  MET  46           1HG      MET  46  -3.649  -4.914   7.676
  348    HG3  MET  46           2HG      MET  46  -4.141  -5.242   9.337
  349    HE1  MET  46           3HE      MET  46  -1.752  -4.141   9.865
  350    HE2  MET  46           1HE      MET  46  -1.203  -4.143   8.179
  351    HE3  MET  46           2HE      MET  46  -0.206  -4.868   9.434
  352    H    LYS  47           H        LYS  47  -3.541  -9.520   6.132
  353    HA   LYS  47           HA       LYS  47  -0.718  -9.040   6.235
  354    HB2  LYS  47           1HB      LYS  47  -2.312 -11.439   5.121
  355    HB3  LYS  47           2HB      LYS  47  -0.551 -11.457   5.350
  356    HG2  LYS  47           1HG      LYS  47  -0.876 -11.039   7.841
  357    HG3  LYS  47           2HG      LYS  47  -2.637 -11.045   7.603
  358    HD2  LYS  47           1HD      LYS  47  -2.538 -13.460   6.828
  359    HD3  LYS  47           2HD      LYS  47  -0.772 -13.462   7.015
  360    HE2  LYS  47           1HE      LYS  47  -1.868 -14.534   9.017
  361    HE3  LYS  47           2HE      LYS  47  -1.054 -13.037   9.504
  362    HZ1  LYS  47           3HZ      LYS  47  -3.106 -11.878   9.501
  363    HZ2  LYS  47           1HZ      LYS  47  -3.366 -13.317  10.360
  364    HZ3  LYS  47           2HZ      LYS  47  -3.929 -13.168   8.763
  365    H    ASP  48           H        ASP  48  -2.995  -9.365   3.491
  366    HA   ASP  48           HA       ASP  48  -1.064  -9.400   1.373
  367    HB2  ASP  48           1HB      ASP  48  -3.486 -10.170   1.144
  368    HB3  ASP  48           2HB      ASP  48  -4.024  -8.493   1.297
  369    H    ARG  49           H        ARG  49  -2.711  -6.808   3.118
  370    HA   ARG  49           HA       ARG  49  -2.097  -4.603   1.379
  371    HB2  ARG  49           1HB      ARG  49  -2.446  -4.604   4.442
  372    HB3  ARG  49           2HB      ARG  49  -2.568  -3.197   3.394
  373    HG2  ARG  49           1HG      ARG  49  -4.595  -4.202   2.239
  374    HG3  ARG  49           2HG      ARG  49  -4.477  -5.608   3.306
  375    HD2  ARG  49           1HD      ARG  49  -4.647  -3.807   5.297
  376    HD3  ARG  49           2HD      ARG  49  -5.316  -2.758   4.038
  377    HE   ARG  49           HE       ARG  49  -6.724  -5.165   3.851
  378   HH11  ARG  49          1HH2      ARG  49  -6.182  -2.748   6.310
  379   HH12  ARG  49          2HH2      ARG  49  -7.710  -3.005   7.087
  380   HH21  ARG  49          1HH1      ARG  49  -8.698  -5.497   4.914
  381   HH22  ARG  49          2HH1      ARG  49  -9.118  -4.550   6.301
  382    H    GLU  50           H        GLU  50  -0.427  -6.003   4.280
  383    HA   GLU  50           HA       GLU  50   1.780  -4.168   4.390
  384    HB2  GLU  50           1HB      GLU  50   1.087  -5.691   6.316
  385    HB3  GLU  50           2HB      GLU  50   1.708  -7.078   5.418
  386    HG2  GLU  50           1HG      GLU  50   4.047  -6.023   5.438
  387    HG3  GLU  50           2HG      GLU  50   3.419  -4.653   6.344
  388    H    ALA  51           H        ALA  51   1.378  -7.414   2.861
  389    HA   ALA  51           HA       ALA  51   3.985  -7.846   1.875
  390    HB1  ALA  51           1HB      ALA  51   2.148  -9.570   1.856
  391    HB2  ALA  51           2HB      ALA  51   2.842  -9.393   0.236
  392    HB3  ALA  51           3HB      ALA  51   1.288  -8.645   0.624
  393    H    LEU  52           H        LEU  52   1.159  -6.285   0.259
  394    HA   LEU  52           HA       LEU  52   2.460  -5.618  -2.170
  395    HB2  LEU  52           1HB      LEU  52  -0.101  -5.715  -1.658
  396    HB3  LEU  52           2HB      LEU  52   0.051  -4.081  -1.019
  397    HG   LEU  52           HG       LEU  52   1.158  -4.580  -3.876
  398   HD11  LEU  52          1HD1      LEU  52  -1.027  -5.697  -4.043
  399   HD12  LEU  52          2HD1      LEU  52  -1.091  -4.173  -4.918
  400   HD13  LEU  52          3HD1      LEU  52  -1.846  -4.307  -3.323
  401   HD21  LEU  52          3HD2      LEU  52   0.535  -2.243  -4.284
  402   HD22  LEU  52          1HD2      LEU  52   1.312  -2.281  -2.718
  403   HD23  LEU  52          2HD2      LEU  52  -0.401  -2.184  -2.808
  404    H    PHE  53           H        PHE  53   1.919  -3.785   0.863
  405    HA   PHE  53           HA       PHE  53   2.924  -1.230   0.108
  406    HB2  PHE  53           1HB      PHE  53   1.625  -1.742   2.249
  407    HB3  PHE  53           2HB      PHE  53   3.040  -2.566   2.883
  408    HD1  PHE  53           1HD      PHE  53   5.125  -1.248   3.564
  409    HD2  PHE  53           2HD      PHE  53   1.618   0.787   1.974
  410    HE1  PHE  53           1HE      PHE  53   6.053   0.950   4.271
  411    HE2  PHE  53           2HE      PHE  53   2.565   2.966   2.695
  412    HZ   PHE  53           HZ       PHE  53   4.767   3.033   3.831
  413    H    ASN  54           H        ASN  54   4.570  -4.008   1.609
  414    HA   ASN  54           HA       ASN  54   7.204  -2.898   1.810
  415    HB2  ASN  54           1HB      ASN  54   6.244  -5.811   1.536
  416    HB3  ASN  54           2HB      ASN  54   7.927  -5.388   1.870
  417   HD21  ASN  54          1HD2      ASN  54   6.436  -6.964   3.700
  418   HD22  ASN  54          2HD2      ASN  54   6.179  -6.081   5.127
  419    H    GLU  55           H        GLU  55   5.560  -4.752  -0.811
  420    HA   GLU  55           HA       GLU  55   7.807  -4.918  -2.612
  421    HB2  GLU  55           1HB      GLU  55   5.772  -6.449  -2.747
  422    HB3  GLU  55           2HB      GLU  55   4.792  -5.079  -3.276
  423    HG2  GLU  55           1HG      GLU  55   6.257  -4.832  -5.363
  424    HG3  GLU  55           2HG      GLU  55   7.247  -6.191  -4.827
  425    H    PHE  56           H        PHE  56   5.076  -2.577  -2.224
  426    HA   PHE  56           HA       PHE  56   5.497  -1.040  -4.558
  427    HB2  PHE  56           1HB      PHE  56   3.402  -0.882  -3.190
  428    HB3  PHE  56           2HB      PHE  56   4.296  -0.188  -1.845
  429    HD1  PHE  56           2HD      PHE  56   3.301   0.421  -5.461
  430    HD2  PHE  56           1HD      PHE  56   4.841   2.272  -1.822
  431    HE1  PHE  56           2HE      PHE  56   3.117   2.679  -6.507
  432    HE2  PHE  56           1HE      PHE  56   4.656   4.510  -2.899
  433    HZ   PHE  56           HZ       PHE  56   3.795   4.712  -5.230
  434    H    VAL  57           H        VAL  57   6.729  -0.532  -1.192
  435    HA   VAL  57           HA       VAL  57   8.240   1.857  -1.689
  436    HB   VAL  57           HB       VAL  57   8.499  -0.341   0.469
  437   HG11  VAL  57          1HG1      VAL  57  10.713   0.786   0.464
  438   HG12  VAL  57          2HG1      VAL  57   9.814   1.487   1.809
  439   HG13  VAL  57          3HG1      VAL  57   9.965   2.383   0.294
  440   HG21  VAL  57          3HG2      VAL  57   7.253   2.499   0.633
  441   HG22  VAL  57          1HG2      VAL  57   7.298   1.319   1.948
  442   HG23  VAL  57          2HG2      VAL  57   6.321   1.008   0.511
  443    H    ALA  58           H        ALA  58   9.151  -1.625  -1.699
  444    HA   ALA  58           HA       ALA  58  11.925  -1.251  -2.263
  445    HB1  ALA  58           1HB      ALA  58  10.107  -3.677  -2.825
  446    HB2  ALA  58           2HB      ALA  58  10.969  -3.381  -1.318
  447    HB3  ALA  58           3HB      ALA  58  11.877  -3.725  -2.800
  448    H    ALA  59           H        ALA  59   9.049  -1.697  -4.386
  449    HA   ALA  59           HA       ALA  59  10.511  -1.833  -6.891
  450    HB1  ALA  59           1HB      ALA  59   7.537  -1.307  -6.290
  451    HB2  ALA  59           2HB      ALA  59   8.255  -2.889  -6.590
  452    HB3  ALA  59           3HB      ALA  59   8.193  -1.692  -7.893
  453    H    ALA  60           H        ALA  60   8.734   0.753  -5.105
  454    HA   ALA  60           HA       ALA  60   8.881   2.796  -7.117
  455    HB1  ALA  60           1HB      ALA  60   7.239   2.913  -5.231
  456    HB2  ALA  60           2HB      ALA  60   8.263   4.355  -5.187
  457    HB3  ALA  60           3HB      ALA  60   8.553   3.024  -4.055
  458    H    ARG  61           H        ARG  61  11.015   1.975  -4.328
  459    HA   ARG  61           HA       ARG  61  12.776   4.219  -4.686
  460    HB2  ARG  61           1HB      ARG  61  12.515   3.024  -2.464
  461    HB3  ARG  61           2HB      ARG  61  13.250   1.572  -3.156
  462    HG2  ARG  61           1HG      ARG  61  15.445   2.837  -3.511
  463    HG3  ARG  61           2HG      ARG  61  14.701   4.303  -2.851
  464    HD2  ARG  61           1HD      ARG  61  15.049   1.683  -1.261
  465    HD3  ARG  61           2HD      ARG  61  16.147   3.079  -1.143
  466    HE   ARG  61           HE       ARG  61  13.497   4.007  -0.689
  467   HH11  ARG  61          1HH2      ARG  61  15.862   1.940   0.881
  468   HH12  ARG  61          2HH2      ARG  61  15.268   2.260   2.477
  469   HH21  ARG  61          1HH1      ARG  61  12.752   4.397   1.406
  470   HH22  ARG  61          2HH1      ARG  61  13.512   3.649   2.769
  Start of MODEL   12
    1    H    ILE   5           H        ILE   5 -13.438  -7.782 -11.458
    2    HA   ILE   5           HA       ILE   5 -11.862 -10.015 -12.652
    3    HB   ILE   5           HB       ILE   5 -11.577  -8.427 -14.721
    4   HG12  ILE   5          1HG1      ILE   5 -14.301  -7.115 -13.859
    5   HG13  ILE   5          2HG1      ILE   5 -12.795  -6.351 -13.372
    6   HG21  ILE   5          1HG2      ILE   5 -13.734  -9.255 -15.822
    7   HG22  ILE   5          2HG2      ILE   5 -14.392  -9.691 -14.246
    8   HG23  ILE   5          3HG2      ILE   5 -12.986 -10.561 -14.877
    9   HD11  ILE   5          3HD1      ILE   5 -13.788  -5.447 -15.481
   10   HD12  ILE   5          1HD1      ILE   5 -13.458  -6.997 -16.259
   11   HD13  ILE   5          2HD1      ILE   5 -12.128  -6.012 -15.638
   12    H    MET   6           H        MET   6 -10.732  -9.478 -10.669
   13    HA   MET   6           HA       MET   6  -9.039  -8.409  -9.388
   14    HB2  MET   6           1HB      MET   6  -8.123  -7.917 -12.330
   15    HB3  MET   6           2HB      MET   6  -7.040  -7.707 -10.927
   16    HG2  MET   6           1HG      MET   6  -7.379 -10.147 -10.323
   17    HG3  MET   6           2HG      MET   6  -8.446 -10.339 -11.736
   18    HE1  MET   6           3HE      MET   6  -5.331 -12.289 -12.859
   19    HE2  MET   6           1HE      MET   6  -7.094 -12.236 -12.846
   20    HE3  MET   6           2HE      MET   6  -6.188 -12.252 -11.327
   21    H    GLN   7           H        GLN   7 -11.402  -6.738 -10.347
   22    HA   GLN   7           HA       GLN   7 -10.547  -4.170 -11.029
   23    HB2  GLN   7           1HB      GLN   7 -12.907  -5.007 -11.265
   24    HB3  GLN   7           2HB      GLN   7 -13.092  -4.999  -9.495
   25    HG2  GLN   7           1HG      GLN   7 -12.698  -2.448  -9.473
   26    HG3  GLN   7           2HG      GLN   7 -12.497  -2.459 -11.235
   27   HE21  GLN   7          1HE2      GLN   7 -14.339  -1.876 -12.275
   28   HE22  GLN   7          2HE2      GLN   7 -15.914  -2.086 -11.690
   29    H    ALA   8           H        ALA   8 -11.305  -5.704  -7.889
   30    HA   ALA   8           HA       ALA   8 -10.989  -3.436  -6.198
   31    HB1  ALA   8           1HB      ALA   8 -12.054  -5.574  -5.437
   32    HB2  ALA   8           2HB      ALA   8 -10.724  -5.158  -4.350
   33    HB3  ALA   8           3HB      ALA   8 -10.512  -6.428  -5.581
   34    H    LYS   9           H        LYS   9  -8.707  -5.986  -7.200
   35    HA   LYS   9           HA       LYS   9  -6.533  -4.949  -5.697
   36    HB2  LYS   9           1HB      LYS   9  -6.682  -7.307  -6.619
   37    HB3  LYS   9           2HB      LYS   9  -6.472  -6.657  -8.269
   38    HG2  LYS   9           1HG      LYS   9  -4.181  -5.733  -7.647
   39    HG3  LYS   9           2HG      LYS   9  -4.390  -6.316  -5.969
   40    HD2  LYS   9           1HD      LYS   9  -4.474  -8.728  -6.838
   41    HD3  LYS   9           2HD      LYS   9  -4.216  -8.113  -8.495
   42    HE2  LYS   9           1HE      LYS   9  -2.226  -7.710  -6.152
   43    HE3  LYS   9           2HE      LYS   9  -2.013  -8.859  -7.489
   44    HZ1  LYS   9           3HZ      LYS   9  -1.989  -5.903  -7.570
   45    HZ2  LYS   9           1HZ      LYS   9  -2.379  -6.789  -8.963
   46    HZ3  LYS   9           2HZ      LYS   9  -0.869  -7.003  -8.217
   47    H    GLU  10           H        GLU  10  -7.550  -4.399  -9.042
   48    HA   GLU  10           HA       GLU  10  -5.286  -2.820  -9.872
   49    HB2  GLU  10           1HB      GLU  10  -8.164  -3.164 -10.901
   50    HB3  GLU  10           2HB      GLU  10  -7.040  -2.055 -11.723
   51    HG2  GLU  10           1HG      GLU  10  -6.403  -5.074 -11.271
   52    HG3  GLU  10           2HG      GLU  10  -7.096  -4.445 -12.780
   53    H    ASP  11           H        ASP  11  -8.417  -2.092  -8.501
   54    HA   ASP  11           HA       ASP  11  -8.232   0.797  -8.645
   55    HB2  ASP  11           1HB      ASP  11  -9.955  -1.148  -7.010
   56    HB3  ASP  11           2HB      ASP  11  -9.969   0.568  -6.579
   57    H    PHE  12           H        PHE  12  -7.244  -1.591  -6.229
   58    HA   PHE  12           HA       PHE  12  -6.492   0.267  -4.184
   59    HB2  PHE  12           1HB      PHE  12  -6.923  -2.223  -3.835
   60    HB3  PHE  12           2HB      PHE  12  -5.413  -2.583  -4.714
   61    HD1  PHE  12           1HD      PHE  12  -6.823  -0.815  -1.658
   62    HD2  PHE  12           2HD      PHE  12  -3.158  -2.195  -3.609
   63    HE1  PHE  12           1HE      PHE  12  -5.521  -0.300   0.396
   64    HE2  PHE  12           2HE      PHE  12  -1.891  -1.720  -1.518
   65    HZ   PHE  12           HZ       PHE  12  -3.067  -0.766   0.469
   66    H    LYS  13           H        LYS  13  -4.627  -1.455  -6.709
   67    HA   LYS  13           HA       LYS  13  -2.141  -0.377  -6.070
   68    HB2  LYS  13           1HB      LYS  13  -2.523  -2.389  -7.510
   69    HB3  LYS  13           2HB      LYS  13  -3.197  -1.346  -8.795
   70    HG2  LYS  13           1HG      LYS  13  -0.983  -0.092  -8.966
   71    HG3  LYS  13           2HG      LYS  13  -0.322  -1.083  -7.640
   72    HD2  LYS  13           1HD      LYS  13  -0.538  -3.155  -9.087
   73    HD3  LYS  13           2HD      LYS  13  -1.192  -2.155 -10.412
   74    HE2  LYS  13           1HE      LYS  13   0.987  -0.864 -10.520
   75    HE3  LYS  13           2HE      LYS  13   1.641  -1.843  -9.183
   76    HZ1  LYS  13           3HZ      LYS  13   1.197  -2.508 -11.929
   77    HZ2  LYS  13           1HZ      LYS  13   0.727  -3.693 -10.819
   78    HZ3  LYS  13           2HZ      LYS  13   2.322  -3.111 -10.816
   79    H    LYS  14           H        LYS  14  -4.626   0.604  -8.334
   80    HA   LYS  14           HA       LYS  14  -3.299   2.688  -9.606
   81    HB2  LYS  14           1HB      LYS  14  -5.483   1.711 -10.374
   82    HB3  LYS  14           2HB      LYS  14  -6.307   2.484  -8.998
   83    HG2  LYS  14           1HG      LYS  14  -5.651   4.788  -9.870
   84    HG3  LYS  14           2HG      LYS  14  -4.745   4.032 -11.215
   85    HD2  LYS  14           1HD      LYS  14  -6.920   3.066 -12.111
   86    HD3  LYS  14           2HD      LYS  14  -7.813   3.842 -10.773
   87    HE2  LYS  14           1HE      LYS  14  -7.099   6.119 -11.598
   88    HE3  LYS  14           2HE      LYS  14  -6.166   5.366 -12.918
   89    HZ1  LYS  14           3HZ      LYS  14  -8.806   6.018 -12.872
   90    HZ2  LYS  14           1HZ      LYS  14  -8.756   4.331 -12.788
   91    HZ3  LYS  14           2HZ      LYS  14  -7.967   5.143 -14.054
   92    H    MET  15           H        MET  15  -5.091   2.564  -6.589
   93    HA   MET  15           HA       MET  15  -5.126   5.392  -6.139
   94    HB2  MET  15           1HB      MET  15  -6.735   3.774  -5.032
   95    HB3  MET  15           2HB      MET  15  -5.386   3.080  -4.123
   96    HG2  MET  15           1HG      MET  15  -6.517   4.719  -2.615
   97    HG3  MET  15           2HG      MET  15  -4.959   5.437  -3.073
   98    HE1  MET  15           3HE      MET  15  -5.686   7.892  -2.563
   99    HE2  MET  15           1HE      MET  15  -7.166   7.197  -1.900
  100    HE3  MET  15           2HE      MET  15  -7.252   8.570  -2.993
  101    H    MET  16           H        MET  16  -3.020   2.709  -5.096
  102    HA   MET  16           HA       MET  16  -1.361   4.117  -3.272
  103    HB2  MET  16           1HB      MET  16  -0.929   1.626  -4.976
  104    HB3  MET  16           2HB      MET  16   0.304   2.174  -3.838
  105    HG2  MET  16           1HG      MET  16  -2.596   1.569  -2.962
  106    HG3  MET  16           2HG      MET  16  -1.305   0.369  -2.896
  107    HE1  MET  16           3HE      MET  16   1.053   0.958  -1.709
  108    HE2  MET  16           1HE      MET  16  -0.010   0.011  -0.671
  109    HE3  MET  16           2HE      MET  16   0.903   1.350   0.003
  110    H    GLU  17           H        GLU  17  -0.932   3.568  -6.712
  111    HA   GLU  17           HA       GLU  17   1.671   4.816  -6.819
  112    HB2  GLU  17           1HB      GLU  17   1.535   4.501  -9.212
  113    HB3  GLU  17           2HB      GLU  17   0.694   3.117  -8.495
  114    HG2  GLU  17           1HG      GLU  17  -1.517   4.378  -8.916
  115    HG3  GLU  17           2HG      GLU  17  -0.637   5.596  -9.765
  116    H    GLU  18           H        GLU  18  -1.665   5.919  -7.210
  117    HA   GLU  18           HA       GLU  18  -0.965   8.640  -8.097
  118    HB2  GLU  18           1HB      GLU  18  -3.635   7.318  -7.293
  119    HB3  GLU  18           2HB      GLU  18  -3.529   9.036  -7.763
  120    HG2  GLU  18           1HG      GLU  18  -2.644   8.346 -10.061
  121    HG3  GLU  18           2HG      GLU  18  -2.723   6.658  -9.592
  122    H    ALA  19           H        ALA  19  -1.314   6.988  -5.096
  123    HA   ALA  19           HA       ALA  19  -1.926   9.449  -3.596
  124    HB1  ALA  19           1HB      ALA  19  -1.996   7.884  -1.599
  125    HB2  ALA  19           2HB      ALA  19  -1.583   6.546  -2.689
  126    HB3  ALA  19           3HB      ALA  19  -3.091   7.405  -2.885
  127    H    LYS  20           H        LYS  20   0.743   8.196  -5.026
  128    HA   LYS  20           HA       LYS  20   2.763   7.496  -3.584
  129    HB2  LYS  20           1HB      LYS  20   2.828   8.555  -5.934
  130    HB3  LYS  20           2HB      LYS  20   3.044  10.110  -5.117
  131    HG2  LYS  20           1HG      LYS  20   5.214   9.297  -4.021
  132    HG3  LYS  20           2HG      LYS  20   4.974   7.671  -4.724
  133    HD2  LYS  20           1HD      LYS  20   6.650   8.855  -6.119
  134    HD3  LYS  20           2HD      LYS  20   5.149   8.726  -7.073
  135    HE2  LYS  20           1HE      LYS  20   4.612  11.148  -6.619
  136    HE3  LYS  20           2HE      LYS  20   5.957  11.287  -5.478
  137    HZ1  LYS  20           3HZ      LYS  20   7.426  11.263  -7.096
  138    HZ2  LYS  20           1HZ      LYS  20   6.138  11.969  -7.933
  139    HZ3  LYS  20           2HZ      LYS  20   6.474  10.320  -8.136
  140    H    PHE  21           H        PHE  21   3.532   7.908  -1.605
  141    HA   PHE  21           HA       PHE  21   3.485  10.660  -0.465
  142    HB2  PHE  21           1HB      PHE  21   2.614   9.670   1.713
  143    HB3  PHE  21           2HB      PHE  21   1.477   9.412   0.361
  144    HD1  PHE  21           1HD      PHE  21   1.258   7.078  -0.753
  145    HD2  PHE  21           2HD      PHE  21   3.839   7.650   2.682
  146    HE1  PHE  21           1HE      PHE  21   1.389   4.634  -0.461
  147    HE2  PHE  21           2HE      PHE  21   3.964   5.186   2.965
  148    HZ   PHE  21           HZ       PHE  21   2.724   3.699   1.400
  149    H    ASN  22           H        ASN  22   4.717  10.646   1.646
  150    HA   ASN  22           HA       ASN  22   7.354  10.346   1.223
  151    HB2  ASN  22           1HB      ASN  22   5.891  10.119   3.890
  152    HB3  ASN  22           2HB      ASN  22   7.643  10.296   3.762
  153   HD21  ASN  22          1HD2      ASN  22   4.646  11.826   2.530
  154   HD22  ASN  22          2HD2      ASN  22   5.246  13.410   2.592
  155    HA   PRO  23           HA       PRO  23   7.492   5.678   0.799
  156    HB2  PRO  23           1HB      PRO  23  10.474   6.285   0.578
  157    HB3  PRO  23           2HB      PRO  23   9.430   5.306  -0.499
  158    HG2  PRO  23           1HG      PRO  23  10.212   7.754  -1.292
  159    HG3  PRO  23           2HG      PRO  23   8.534   7.216  -1.605
  160    HD2  PRO  23           1HD      PRO  23   9.564   9.092   0.549
  161    HD3  PRO  23           2HD      PRO  23   8.114   9.205  -0.494
  162    H    ARG  24           H        ARG  24   9.568   7.623   2.868
  163    HA   ARG  24           HA       ARG  24  10.514   5.410   4.490
  164    HB2  ARG  24           1HB      ARG  24  11.507   7.233   5.943
  165    HB3  ARG  24           2HB      ARG  24  11.844   7.521   4.224
  166    HG2  ARG  24           1HG      ARG  24   9.966   9.223   4.085
  167    HG3  ARG  24           2HG      ARG  24   9.514   8.936   5.781
  168    HD2  ARG  24           1HD      ARG  24  11.737   9.812   6.529
  169    HD3  ARG  24           2HD      ARG  24  12.225  10.106   4.838
  170    HE   ARG  24           HE       ARG  24  10.320  11.654   6.435
  171   HH11  ARG  24          1HH2      ARG  24  11.229  10.757   3.176
  172   HH12  ARG  24          2HH2      ARG  24  10.615  12.212   2.460
  173   HH21  ARG  24          1HH1      ARG  24   9.503  13.509   5.486
  174   HH22  ARG  24          2HH1      ARG  24   9.634  13.765   3.782
  175    H    ALA  25           H        ALA  25   7.525   6.838   4.322
  176    HA   ALA  25           HA       ALA  25   6.822   6.835   7.175
  177    HB1  ALA  25           1HB      ALA  25   4.482   7.223   6.345
  178    HB2  ALA  25           2HB      ALA  25   4.973   6.799   4.711
  179    HB3  ALA  25           3HB      ALA  25   5.586   8.256   5.446
  180    H    THR  26           H        THR  26   5.216   5.318   7.990
  181    HA   THR  26           HA       THR  26   5.774   2.528   7.120
  182    HB   THR  26           HB       THR  26   5.032   1.910   9.437
  183    HG1  THR  26           1HG      THR  26   4.143   4.559   9.365
  184   HG21  THR  26          3HG2      THR  26   6.899   4.384   9.600
  185   HG22  THR  26          1HG2      THR  26   7.465   2.767   9.135
  186   HG23  THR  26          2HG2      THR  26   6.825   3.055  10.759
  187    H    PHE  27           H        PHE  27   3.955   1.071   7.408
  188    HA   PHE  27           HA       PHE  27   1.761   1.726   5.764
  189    HB2  PHE  27           1HB      PHE  27   2.611  -0.593   5.987
  190    HB3  PHE  27           2HB      PHE  27   2.168  -0.613   7.718
  191    HD1  PHE  27           2HD      PHE  27   0.644  -0.038   4.255
  192    HD2  PHE  27           1HD      PHE  27  -0.179  -1.260   8.368
  193    HE1  PHE  27           2HE      PHE  27  -1.675  -0.624   3.617
  194    HE2  PHE  27           1HE      PHE  27  -2.505  -1.818   7.710
  195    HZ   PHE  27           HZ       PHE  27  -3.241  -1.528   5.344
  196    H    SER  28           H        SER  28   2.073   1.450   9.313
  197    HA   SER  28           HA       SER  28  -0.651   1.788  10.077
  198    HB2  SER  28           1HB      SER  28   1.903   2.716  11.523
  199    HB3  SER  28           2HB      SER  28   0.313   2.564  12.295
  200    HG   SER  28           HG       SER  28   1.665   0.735  12.564
  201    H    GLU  29           H        GLU  29   1.836   4.220   9.318
  202    HA   GLU  29           HA       GLU  29   0.191   6.518  10.000
  203    HB2  GLU  29           1HB      GLU  29   2.705   6.202   8.248
  204    HB3  GLU  29           2HB      GLU  29   1.984   7.784   8.641
  205    HG2  GLU  29           1HG      GLU  29   2.372   7.346  11.111
  206    HG3  GLU  29           2HG      GLU  29   3.034   5.758  10.758
  207    H    PHE  30           H        PHE  30   0.968   4.809   6.966
  208    HA   PHE  30           HA       PHE  30  -0.442   6.587   5.221
  209    HB2  PHE  30           1HB      PHE  30   1.312   5.009   4.424
  210    HB3  PHE  30           2HB      PHE  30   0.309   3.619   4.918
  211    HD1  PHE  30           2HD      PHE  30   0.296   6.696   2.671
  212    HD2  PHE  30           1HD      PHE  30  -1.531   2.781   3.412
  213    HE1  PHE  30           2HE      PHE  30  -0.996   6.866   0.549
  214    HE2  PHE  30           1HE      PHE  30  -2.813   3.000   1.296
  215    HZ   PHE  30           HZ       PHE  30  -2.535   5.025  -0.139
  216    H    ALA  31           H        ALA  31  -1.343   3.507   6.820
  217    HA   ALA  31           HA       ALA  31  -3.966   3.232   5.724
  218    HB1  ALA  31           1HB      ALA  31  -4.288   1.579   7.647
  219    HB2  ALA  31           2HB      ALA  31  -2.747   2.100   8.322
  220    HB3  ALA  31           3HB      ALA  31  -2.795   1.301   6.757
  221    H    ALA  32           H        ALA  32  -2.711   4.782   8.660
  222    HA   ALA  32           HA       ALA  32  -5.186   5.397   9.976
  223    HB1  ALA  32           1HB      ALA  32  -3.848   7.218  11.139
  224    HB2  ALA  32           2HB      ALA  32  -2.539   6.963   9.973
  225    HB3  ALA  32           3HB      ALA  32  -2.980   5.683  11.099
  226    H    LYS  33           H        LYS  33  -3.417   7.052   7.405
  227    HA   LYS  33           HA       LYS  33  -5.162   9.354   7.418
  228    HB2  LYS  33           1HB      LYS  33  -2.761   9.359   6.594
  229    HB3  LYS  33           2HB      LYS  33  -3.263   8.339   5.217
  230    HG2  LYS  33           1HG      LYS  33  -4.868  10.149   4.412
  231    HG3  LYS  33           2HG      LYS  33  -4.449  11.160   5.828
  232    HD2  LYS  33           1HD      LYS  33  -2.056  11.322   4.992
  233    HD3  LYS  33           2HD      LYS  33  -2.491  10.335   3.573
  234    HE2  LYS  33           1HE      LYS  33  -4.141  12.104   2.830
  235    HE3  LYS  33           2HE      LYS  33  -3.735  13.088   4.259
  236    HZ1  LYS  33           3HZ      LYS  33  -2.256  13.922   2.903
  237    HZ2  LYS  33           1HZ      LYS  33  -2.259  12.593   1.861
  238    HZ3  LYS  33           2HZ      LYS  33  -1.354  12.542   3.298
  239    H    HIS  34           H        HIS  34  -4.980   6.360   5.473
  240    HA   HIS  34           HA       HIS  34  -7.351   7.169   3.875
  241    HB2  HIS  34           1HB      HIS  34  -5.330   4.852   3.615
  242    HB3  HIS  34           2HB      HIS  34  -6.740   5.022   2.539
  243    HD2  HIS  34           2HD      HIS  34  -6.458   7.025   0.586
  244    HE1  HIS  34           1HE      HIS  34  -2.681   8.432   1.786
  245    HE2  HIS  34           2HE      HIS  34  -4.453   8.561  -0.020
  246    H    ALA  35           H        ALA  35  -6.835   5.787   6.811
  247    HA   ALA  35           HA       ALA  35  -8.171   3.355   6.951
  248    HB1  ALA  35           1HB      ALA  35  -7.197   4.169   9.018
  249    HB2  ALA  35           2HB      ALA  35  -8.917   4.192   9.347
  250    HB3  ALA  35           3HB      ALA  35  -8.072   5.693   8.937
  251    H    LYS  36           H        LYS  36  -9.579   6.642   6.783
  252    HA   LYS  36           HA       LYS  36 -12.321   5.709   7.092
  253    HB2  LYS  36           1HB      LYS  36 -11.105   8.407   6.200
  254    HB3  LYS  36           2HB      LYS  36 -12.851   8.157   6.555
  255    HG2  LYS  36           1HG      LYS  36 -12.250   7.474   8.943
  256    HG3  LYS  36           2HG      LYS  36 -10.517   7.765   8.578
  257    HD2  LYS  36           1HD      LYS  36 -10.986  10.219   8.141
  258    HD3  LYS  36           2HD      LYS  36 -12.732   9.965   8.438
  259    HE2  LYS  36           1HE      LYS  36 -11.620  10.902  10.507
  260    HE3  LYS  36           2HE      LYS  36 -12.178   9.244  10.831
  261    HZ1  LYS  36           3HZ      LYS  36  -9.480   9.627   9.725
  262    HZ2  LYS  36           1HZ      LYS  36 -10.056   8.429  10.779
  263    HZ3  LYS  36           2HZ      LYS  36  -9.732   9.988  11.367
  264    H    ASP  37           H        ASP  37 -10.139   5.716   4.538
  265    HA   ASP  37           HA       ASP  37 -11.876   6.391   2.374
  266    HB2  ASP  37           1HB      ASP  37  -9.247   6.160   2.329
  267    HB3  ASP  37           2HB      ASP  37  -9.508   4.424   2.157
  268    H    SER  38           H        SER  38 -13.198   5.037   1.158
  269    HA   SER  38           HA       SER  38 -14.419   2.783   2.419
  270    HB2  SER  38           1HB      SER  38 -15.751   2.631   0.275
  271    HB3  SER  38           2HB      SER  38 -15.681   4.284   0.904
  272    HG   SER  38           HG       SER  38 -14.016   4.727  -0.560
  273    H    ARG  39           H        ARG  39 -11.902   3.124   0.046
  274    HA   ARG  39           HA       ARG  39 -11.827   0.393  -0.941
  275    HB2  ARG  39           1HB      ARG  39  -9.764   2.655  -0.953
  276    HB3  ARG  39           2HB      ARG  39  -9.460   1.064  -1.714
  277    HG2  ARG  39           1HG      ARG  39 -11.514   1.387  -3.237
  278    HG3  ARG  39           2HG      ARG  39 -11.821   2.973  -2.472
  279    HD2  ARG  39           1HD      ARG  39  -9.183   2.305  -3.940
  280    HD3  ARG  39           2HD      ARG  39 -10.546   3.139  -4.732
  281    HE   ARG  39           HE       ARG  39  -8.723   4.266  -2.705
  282   HH11  ARG  39          1HH2      ARG  39 -11.902   4.505  -4.110
  283   HH12  ARG  39          2HH2      ARG  39 -12.087   6.192  -3.773
  284   HH21  ARG  39          1HH1      ARG  39  -8.998   6.465  -2.233
  285   HH22  ARG  39          2HH1      ARG  39 -10.437   7.296  -2.704
  286    H    PHE  40           H        PHE  40 -10.732   1.929   1.908
  287    HA   PHE  40           HA       PHE  40  -8.590   0.090   2.478
  288    HB2  PHE  40           1HB      PHE  40  -8.811   2.411   3.480
  289    HB3  PHE  40           2HB      PHE  40 -10.188   1.850   4.445
  290    HD1  PHE  40           1HD      PHE  40  -6.498   1.358   3.798
  291    HD2  PHE  40           2HD      PHE  40  -9.827   0.402   6.492
  292    HE1  PHE  40           1HE      PHE  40  -4.925   0.382   5.431
  293    HE2  PHE  40           2HE      PHE  40  -8.210  -0.550   8.118
  294    HZ   PHE  40           HZ       PHE  40  -5.767  -0.564   7.593
  295    H    LYS  41           H        LYS  41 -11.900   0.431   3.769
  296    HA   LYS  41           HA       LYS  41 -11.809  -2.035   5.336
  297    HB2  LYS  41           1HB      LYS  41 -14.100  -1.504   5.949
  298    HB3  LYS  41           2HB      LYS  41 -13.249   0.053   5.839
  299    HG2  LYS  41           1HG      LYS  41 -14.174   0.397   3.486
  300    HG3  LYS  41           2HG      LYS  41 -15.054  -1.138   3.588
  301    HD2  LYS  41           1HD      LYS  41 -16.278  -0.129   5.685
  302    HD3  LYS  41           2HD      LYS  41 -15.568   1.435   5.207
  303    HE2  LYS  41           1HE      LYS  41 -17.432  -0.294   3.427
  304    HE3  LYS  41           2HE      LYS  41 -17.874   1.232   4.215
  305    HZ1  LYS  41           3HZ      LYS  41 -16.260   2.385   2.935
  306    HZ2  LYS  41           1HZ      LYS  41 -17.217   1.477   1.875
  307    HZ3  LYS  41           2HZ      LYS  41 -15.655   0.943   2.267
  308    H    ALA  42           H        ALA  42 -12.302  -1.350   1.982
  309    HA   ALA  42           HA       ALA  42 -14.268  -3.348   1.261
  310    HB1  ALA  42           1HB      ALA  42 -11.961  -2.113  -0.396
  311    HB2  ALA  42           2HB      ALA  42 -13.582  -1.428  -0.270
  312    HB3  ALA  42           3HB      ALA  42 -13.344  -2.973  -1.083
  313    H    ILE  43           H        ILE  43 -10.783  -3.413   1.788
  314    HA   ILE  43           HA       ILE  43 -10.630  -6.272   0.911
  315    HB   ILE  43           HB       ILE  43  -8.494  -4.377   2.078
  316   HG12  ILE  43          1HG1      ILE  43  -8.872  -5.120  -0.934
  317   HG13  ILE  43          2HG1      ILE  43  -9.480  -3.601  -0.267
  318   HG21  ILE  43          1HG2      ILE  43  -8.101  -7.072   0.503
  319   HG22  ILE  43          2HG2      ILE  43  -8.016  -7.000   2.246
  320   HG23  ILE  43          3HG2      ILE  43  -6.833  -6.143   1.273
  321   HD11  ILE  43          3HD1      ILE  43  -7.236  -2.858   0.260
  322   HD12  ILE  43          1HD1      ILE  43  -7.251  -3.416  -1.408
  323   HD13  ILE  43          2HD1      ILE  43  -6.531  -4.419  -0.165
  324    H    GLU  44           H        GLU  44 -11.016  -7.777   2.334
  325    HA   GLU  44           HA       GLU  44 -11.496  -7.347   5.141
  326    HB2  GLU  44           1HB      GLU  44 -11.232  -9.921   3.454
  327    HB3  GLU  44           2HB      GLU  44 -11.742  -9.892   5.175
  328    HG2  GLU  44           1HG      GLU  44 -13.846  -9.899   3.841
  329    HG3  GLU  44           2HG      GLU  44 -13.687  -8.257   4.477
  330    H    LYS  45           H        LYS  45  -8.903  -8.980   3.270
  331    HA   LYS  45           HA       LYS  45  -7.370  -9.670   5.666
  332    HB2  LYS  45           1HB      LYS  45  -6.702  -9.768   2.653
  333    HB3  LYS  45           2HB      LYS  45  -5.649 -10.432   3.948
  334    HG2  LYS  45           1HG      LYS  45  -7.523 -12.000   4.677
  335    HG3  LYS  45           2HG      LYS  45  -8.577 -11.343   3.381
  336    HD2  LYS  45           1HD      LYS  45  -6.893 -12.169   1.613
  337    HD3  LYS  45           2HD      LYS  45  -5.893 -12.859   2.921
  338    HE2  LYS  45           1HE      LYS  45  -8.808 -13.710   2.313
  339    HE3  LYS  45           2HE      LYS  45  -7.356 -14.654   1.904
  340    HZ1  LYS  45           3HZ      LYS  45  -8.460 -14.023   4.570
  341    HZ2  LYS  45           1HZ      LYS  45  -6.809 -14.366   4.395
  342    HZ3  LYS  45           2HZ      LYS  45  -7.970 -15.521   3.939
  343    H    MET  46           H        MET  46  -5.780  -8.615   6.481
  344    HA   MET  46           HA       MET  46  -5.048  -5.922   5.490
  345    HB2  MET  46           1HB      MET  46  -4.005  -5.720   7.863
  346    HB3  MET  46           2HB      MET  46  -5.773  -5.875   7.809
  347    HG2  MET  46           1HG      MET  46  -5.672  -8.292   8.400
  348    HG3  MET  46           2HG      MET  46  -3.900  -8.289   8.287
  349    HE1  MET  46           3HE      MET  46  -4.537  -8.781  12.065
  350    HE2  MET  46           1HE      MET  46  -3.742  -9.393  10.614
  351    HE3  MET  46           2HE      MET  46  -5.505  -9.406  10.746
  352    H    LYS  47           H        LYS  47  -3.826  -9.139   5.882
  353    HA   LYS  47           HA       LYS  47  -1.011  -8.603   5.978
  354    HB2  LYS  47           1HB      LYS  47  -2.589 -11.030   4.911
  355    HB3  LYS  47           2HB      LYS  47  -0.805 -11.012   5.120
  356    HG2  LYS  47           1HG      LYS  47  -1.102 -10.512   7.609
  357    HG3  LYS  47           2HG      LYS  47  -2.882 -10.555   7.393
  358    HD2  LYS  47           1HD      LYS  47  -2.771 -12.991   6.703
  359    HD3  LYS  47           2HD      LYS  47  -0.988 -12.976   6.838
  360    HE2  LYS  47           1HE      LYS  47  -2.029 -13.975   8.920
  361    HE3  LYS  47           2HE      LYS  47  -1.213 -12.448   9.328
  362    HZ1  LYS  47           3HZ      LYS  47  -3.948 -12.132   8.447
  363    HZ2  LYS  47           1HZ      LYS  47  -3.155 -11.460   9.785
  364    HZ3  LYS  47           2HZ      LYS  47  -3.793 -13.029   9.884
  365    H    ASP  48           H        ASP  48  -3.301  -9.028   3.324
  366    HA   ASP  48           HA       ASP  48  -1.356  -9.161   1.247
  367    HB2  ASP  48           1HB      ASP  48  -3.817  -9.868   0.990
  368    HB3  ASP  48           2HB      ASP  48  -4.309  -8.157   1.079
  369    H    ARG  49           H        ARG  49  -3.013  -6.500   2.855
  370    HA   ARG  49           HA       ARG  49  -2.172  -4.395   1.050
  371    HB2  ARG  49           1HB      ARG  49  -3.013  -4.309   4.010
  372    HB3  ARG  49           2HB      ARG  49  -2.734  -2.861   3.012
  373    HG2  ARG  49           1HG      ARG  49  -4.536  -3.728   1.343
  374    HG3  ARG  49           2HG      ARG  49  -4.863  -5.060   2.489
  375    HD2  ARG  49           1HD      ARG  49  -5.154  -2.072   3.159
  376    HD3  ARG  49           2HD      ARG  49  -6.488  -3.163   2.739
  377    HE   ARG  49           HE       ARG  49  -4.917  -4.228   4.916
  378   HH11  ARG  49          1HH2      ARG  49  -7.324  -1.922   4.087
  379   HH12  ARG  49          2HH2      ARG  49  -8.033  -1.861   5.660
  380   HH21  ARG  49          1HH1      ARG  49  -5.802  -4.149   6.998
  381   HH22  ARG  49          2HH1      ARG  49  -7.163  -3.140   7.325
  382    H    GLU  50           H        GLU  50  -0.863  -5.803   4.010
  383    HA   GLU  50           HA       GLU  50   1.261  -3.953   4.344
  384    HB2  GLU  50           1HB      GLU  50   0.457  -5.574   6.127
  385    HB3  GLU  50           2HB      GLU  50   1.195  -6.913   5.207
  386    HG2  GLU  50           1HG      GLU  50   3.514  -5.815   5.456
  387    HG3  GLU  50           2HG      GLU  50   2.799  -4.474   6.359
  388    H    ALA  51           H        ALA  51   1.000  -7.106   2.610
  389    HA   ALA  51           HA       ALA  51   3.712  -7.445   1.843
  390    HB1  ALA  51           1HB      ALA  51   2.758  -9.006   0.100
  391    HB2  ALA  51           2HB      ALA  51   1.141  -8.340   0.386
  392    HB3  ALA  51           3HB      ALA  51   1.960  -9.236   1.666
  393    H    LEU  52           H        LEU  52   0.964  -5.839   0.197
  394    HA   LEU  52           HA       LEU  52   2.305  -5.070  -2.182
  395    HB2  LEU  52           1HB      LEU  52  -0.144  -3.978  -0.725
  396    HB3  LEU  52           2HB      LEU  52   0.370  -3.345  -2.322
  397    HG   LEU  52           HG       LEU  52  -0.150  -6.405  -1.897
  398   HD11  LEU  52          1HD1      LEU  52  -2.204  -4.293  -2.705
  399   HD12  LEU  52          2HD1      LEU  52  -2.278  -5.389  -1.344
  400   HD13  LEU  52          3HD1      LEU  52  -2.441  -6.006  -2.987
  401   HD21  LEU  52          3HD2      LEU  52   1.180  -5.823  -4.010
  402   HD22  LEU  52          1HD2      LEU  52  -0.073  -4.689  -4.518
  403   HD23  LEU  52          2HD2      LEU  52  -0.405  -6.418  -4.465
  404    H    PHE  53           H        PHE  53   1.765  -3.425   0.850
  405    HA   PHE  53           HA       PHE  53   2.833  -0.900   0.184
  406    HB2  PHE  53           1HB      PHE  53   1.612  -1.102   2.244
  407    HB3  PHE  53           2HB      PHE  53   2.593  -2.460   2.789
  408    HD1  PHE  53           2HD      PHE  53   2.928   1.207   1.841
  409    HD2  PHE  53           1HD      PHE  53   4.600  -2.073   4.209
  410    HE1  PHE  53           2HE      PHE  53   4.599   2.741   2.878
  411    HE2  PHE  53           1HE      PHE  53   6.247  -0.518   5.192
  412    HZ   PHE  53           HZ       PHE  53   6.234   1.870   4.538
  413    H    ASN  54           H        ASN  54   4.397  -3.783   1.594
  414    HA   ASN  54           HA       ASN  54   7.047  -2.710   1.850
  415    HB2  ASN  54           1HB      ASN  54   6.096  -5.623   1.450
  416    HB3  ASN  54           2HB      ASN  54   7.769  -5.195   1.874
  417   HD21  ASN  54          1HD2      ASN  54   5.452  -6.575   3.430
  418   HD22  ASN  54          2HD2      ASN  54   5.446  -5.766   4.919
  419    H    GLU  55           H        GLU  55   5.459  -4.458  -0.809
  420    HA   GLU  55           HA       GLU  55   7.763  -4.560  -2.555
  421    HB2  GLU  55           1HB      GLU  55   4.755  -4.840  -3.087
  422    HB3  GLU  55           2HB      GLU  55   5.997  -5.093  -4.349
  423    HG2  GLU  55           1HG      GLU  55   7.017  -6.985  -2.994
  424    HG3  GLU  55           2HG      GLU  55   5.862  -6.715  -1.689
  425    H    PHE  56           H        PHE  56   5.011  -2.318  -2.176
  426    HA   PHE  56           HA       PHE  56   5.388  -0.834  -4.506
  427    HB2  PHE  56           1HB      PHE  56   3.327  -0.711  -3.106
  428    HB3  PHE  56           2HB      PHE  56   4.248   0.010  -1.766
  429    HD1  PHE  56           1HD      PHE  56   3.287   0.547  -5.400
  430    HD2  PHE  56           2HD      PHE  56   4.702   2.491  -1.735
  431    HE1  PHE  56           1HE      PHE  56   3.079   2.771  -6.477
  432    HE2  PHE  56           2HE      PHE  56   4.450   4.703  -2.834
  433    HZ   PHE  56           HZ       PHE  56   3.642   4.847  -5.189
  434    H    VAL  57           H        VAL  57   6.606  -0.313  -1.181
  435    HA   VAL  57           HA       VAL  57   8.065   2.100  -1.696
  436    HB   VAL  57           HB       VAL  57   8.376  -0.078   0.480
  437   HG11  VAL  57          1HG1      VAL  57   9.721   1.876   1.743
  438   HG12  VAL  57          2HG1      VAL  57   9.888   2.650   0.172
  439   HG13  VAL  57          3HG1      VAL  57  10.616   1.061   0.445
  440   HG21  VAL  57          3HG2      VAL  57   7.077   2.767   0.611
  441   HG22  VAL  57          1HG2      VAL  57   7.170   1.616   1.927
  442   HG23  VAL  57          2HG2      VAL  57   6.162   1.258   0.532
  443    H    ALA  58           H        ALA  58   9.021  -1.348  -1.642
  444    HA   ALA  58           HA       ALA  58  11.804  -0.933  -2.127
  445    HB1  ALA  58           1HB      ALA  58  11.825  -3.393  -2.726
  446    HB2  ALA  58           2HB      ALA  58  10.053  -3.383  -2.784
  447    HB3  ALA  58           3HB      ALA  58  10.879  -3.097  -1.256
  448    H    ALA  59           H        ALA  59   8.984  -1.403  -4.303
  449    HA   ALA  59           HA       ALA  59  10.517  -1.570  -6.752
  450    HB1  ALA  59           1HB      ALA  59   7.518  -1.006  -6.266
  451    HB2  ALA  59           2HB      ALA  59   8.240  -2.601  -6.519
  452    HB3  ALA  59           3HB      ALA  59   8.236  -1.428  -7.839
  453    H    ALA  60           H        ALA  60   8.655   1.006  -5.062
  454    HA   ALA  60           HA       ALA  60   8.865   3.004  -7.106
  455    HB1  ALA  60           1HB      ALA  60   8.149   4.599  -5.258
  456    HB2  ALA  60           2HB      ALA  60   8.451   3.323  -4.054
  457    HB3  ALA  60           3HB      ALA  60   7.173   3.125  -5.254
  458    H    ARG  61           H        ARG  61  10.818   2.239  -4.224
  459    HA   ARG  61           HA       ARG  61  12.513   4.503  -4.526
  460    HB2  ARG  61           1HB      ARG  61  12.187   3.313  -2.343
  461    HB3  ARG  61           2HB      ARG  61  13.009   1.867  -3.005
  462    HG2  ARG  61           1HG      ARG  61  15.192   3.207  -3.300
  463    HG3  ARG  61           2HG      ARG  61  14.382   4.683  -2.710
  464    HD2  ARG  61           1HD      ARG  61  15.739   3.679  -0.895
  465    HD3  ARG  61           2HD      ARG  61  13.999   3.510  -0.493
  466    HE   ARG  61           HE       ARG  61  14.893   1.175  -1.958
  467   HH11  ARG  61          1HH2      ARG  61  15.143   2.765   1.090
  468   HH12  ARG  61          2HH2      ARG  61  15.455   1.326   1.999
  469   HH21  ARG  61          1HH1      ARG  61  15.290  -0.739  -0.795
  470   HH22  ARG  61          2HH1      ARG  61  15.537  -0.674   0.914
  Start of MODEL   13
    1    H    ILE   5           H        ILE   5 -13.085 -10.368 -11.384
    2    HA   ILE   5           HA       ILE   5 -11.777  -9.617 -13.169
    3    HB   ILE   5           HB       ILE   5 -13.377  -6.960 -12.785
    4   HG12  ILE   5          1HG1      ILE   5 -14.095  -9.194 -14.822
    5   HG13  ILE   5          2HG1      ILE   5 -14.792  -9.129 -13.218
    6   HG21  ILE   5          1HG2      ILE   5 -11.682  -6.181 -14.335
    7   HG22  ILE   5          2HG2      ILE   5 -12.802  -6.851 -15.507
    8   HG23  ILE   5          3HG2      ILE   5 -11.395  -7.791 -15.021
    9   HD11  ILE   5          3HD1      ILE   5 -16.245  -8.073 -14.976
   10   HD12  ILE   5          1HD1      ILE   5 -15.026  -6.815 -15.190
   11   HD13  ILE   5          2HD1      ILE   5 -15.853  -6.997 -13.638
   12    H    MET   6           H        MET   6 -10.905  -9.369 -10.434
   13    HA   MET   6           HA       MET   6  -9.325  -8.294  -9.017
   14    HB2  MET   6           1HB      MET   6  -8.115  -7.891 -11.849
   15    HB3  MET   6           2HB      MET   6  -7.177  -7.681 -10.349
   16    HG2  MET   6           1HG      MET   6  -7.651 -10.103  -9.739
   17    HG3  MET   6           2HG      MET   6  -8.560 -10.295 -11.260
   18    HE1  MET   6           3HE      MET   6  -7.123 -12.259 -12.149
   19    HE2  MET   6           1HE      MET   6  -6.381 -12.236 -10.538
   20    HE3  MET   6           2HE      MET   6  -5.378 -12.330 -11.976
   21    H    GLN   7           H        GLN   7 -11.564  -6.569  -9.982
   22    HA   GLN   7           HA       GLN   7 -10.700  -3.979 -10.740
   23    HB2  GLN   7           1HB      GLN   7 -13.018  -3.297 -10.135
   24    HB3  GLN   7           2HB      GLN   7 -13.068  -4.885 -10.925
   25    HG2  GLN   7           1HG      GLN   7 -13.115  -5.939  -8.448
   26    HG3  GLN   7           2HG      GLN   7 -13.439  -4.306  -7.879
   27   HE21  GLN   7          1HE2      GLN   7 -15.127  -6.837  -8.020
   28   HE22  GLN   7          2HE2      GLN   7 -16.576  -6.312  -8.722
   29    H    ALA   8           H        ALA   8 -11.287  -5.542  -7.558
   30    HA   ALA   8           HA       ALA   8 -10.959  -3.275  -5.858
   31    HB1  ALA   8           1HB      ALA   8 -10.519  -6.291  -5.313
   32    HB2  ALA   8           2HB      ALA   8 -11.990  -5.377  -5.000
   33    HB3  ALA   8           3HB      ALA   8 -10.544  -5.059  -4.033
   34    H    LYS   9           H        LYS   9  -8.628  -5.782  -6.972
   35    HA   LYS   9           HA       LYS   9  -6.358  -4.646  -5.643
   36    HB2  LYS   9           1HB      LYS   9  -6.660  -6.641  -7.970
   37    HB3  LYS   9           2HB      LYS   9  -5.042  -6.061  -7.504
   38    HG2  LYS   9           1HG      LYS   9  -5.451  -8.218  -6.324
   39    HG3  LYS   9           2HG      LYS   9  -5.475  -6.925  -5.106
   40    HD2  LYS   9           1HD      LYS   9  -8.030  -6.971  -5.082
   41    HD3  LYS   9           2HD      LYS   9  -8.053  -8.201  -6.365
   42    HE2  LYS   9           1HE      LYS   9  -6.902  -9.810  -4.788
   43    HE3  LYS   9           2HE      LYS   9  -6.900  -8.564  -3.521
   44    HZ1  LYS   9           3HZ      LYS   9  -9.134 -10.005  -4.714
   45    HZ2  LYS   9           1HZ      LYS   9  -9.385  -8.447  -4.104
   46    HZ3  LYS   9           2HZ      LYS   9  -8.799  -9.675  -3.088
   47    H    GLU  10           H        GLU  10  -7.693  -4.245  -8.844
   48    HA   GLU  10           HA       GLU  10  -5.526  -2.733  -9.844
   49    HB2  GLU  10           1HB      GLU  10  -7.368  -3.819 -11.278
   50    HB3  GLU  10           2HB      GLU  10  -8.502  -2.574 -10.696
   51    HG2  GLU  10           1HG      GLU  10  -7.603  -1.834 -12.944
   52    HG3  GLU  10           2HG      GLU  10  -6.945  -0.745 -11.711
   53    H    ASP  11           H        ASP  11  -8.547  -1.904  -8.253
   54    HA   ASP  11           HA       ASP  11  -8.364   0.980  -8.374
   55    HB2  ASP  11           1HB      ASP  11  -9.996  -0.962  -6.644
   56    HB3  ASP  11           2HB      ASP  11  -9.995   0.755  -6.232
   57    H    PHE  12           H        PHE  12  -7.249  -1.417  -6.042
   58    HA   PHE  12           HA       PHE  12  -6.381   0.409  -4.012
   59    HB2  PHE  12           1HB      PHE  12  -6.713  -2.105  -3.700
   60    HB3  PHE  12           2HB      PHE  12  -5.273  -2.399  -4.707
   61    HD1  PHE  12           2HD      PHE  12  -6.463  -0.632  -1.550
   62    HD2  PHE  12           1HD      PHE  12  -2.947  -2.150  -3.695
   63    HE1  PHE  12           2HE      PHE  12  -5.032  -0.161   0.431
   64    HE2  PHE  12           1HE      PHE  12  -1.562  -1.628  -1.697
   65    HZ   PHE  12           HZ       PHE  12  -2.589  -0.668   0.356
   66    H    LYS  13           H        LYS  13  -4.576  -1.151  -6.729
   67    HA   LYS  13           HA       LYS  13  -2.060   0.075  -6.231
   68    HB2  LYS  13           1HB      LYS  13  -3.348  -1.083  -8.765
   69    HB3  LYS  13           2HB      LYS  13  -1.645  -0.548  -8.702
   70    HG2  LYS  13           1HG      LYS  13  -1.175  -2.189  -6.802
   71    HG3  LYS  13           2HG      LYS  13  -2.872  -2.724  -6.846
   72    HD2  LYS  13           1HD      LYS  13  -2.551  -3.580  -9.227
   73    HD3  LYS  13           2HD      LYS  13  -0.857  -3.022  -9.195
   74    HE2  LYS  13           1HE      LYS  13  -0.355  -4.637  -7.311
   75    HE3  LYS  13           2HE      LYS  13  -2.046  -5.191  -7.327
   76    HZ1  LYS  13           3HZ      LYS  13  -1.649  -5.598  -9.748
   77    HZ2  LYS  13           1HZ      LYS  13  -0.913  -6.653  -8.651
   78    HZ3  LYS  13           2HZ      LYS  13   0.007  -5.442  -9.400
   79    H    LYS  14           H        LYS  14  -4.772   0.910  -8.219
   80    HA   LYS  14           HA       LYS  14  -3.660   3.075  -9.560
   81    HB2  LYS  14           1HB      LYS  14  -5.854   2.017 -10.167
   82    HB3  LYS  14           2HB      LYS  14  -6.580   2.736  -8.721
   83    HG2  LYS  14           1HG      LYS  14  -6.103   5.074  -9.574
   84    HG3  LYS  14           2HG      LYS  14  -5.263   4.404 -10.999
   85    HD2  LYS  14           1HD      LYS  14  -7.467   3.357 -11.775
   86    HD3  LYS  14           2HD      LYS  14  -8.288   4.069 -10.360
   87    HE2  LYS  14           1HE      LYS  14  -6.816   5.763 -12.514
   88    HE3  LYS  14           2HE      LYS  14  -8.575   5.523 -12.457
   89    HZ1  LYS  14           3HZ      LYS  14  -7.712   6.243  -9.889
   90    HZ2  LYS  14           1HZ      LYS  14  -8.715   7.114 -10.942
   91    HZ3  LYS  14           2HZ      LYS  14  -7.038   7.350 -10.989
   92    H    MET  15           H        MET  15  -5.284   2.843  -6.439
   93    HA   MET  15           HA       MET  15  -5.324   5.666  -5.895
   94    HB2  MET  15           1HB      MET  15  -6.830   4.033  -4.739
   95    HB3  MET  15           2HB      MET  15  -5.437   3.286  -3.959
   96    HG2  MET  15           1HG      MET  15  -4.918   5.518  -2.756
   97    HG3  MET  15           2HG      MET  15  -6.307   6.237  -3.530
   98    HE1  MET  15           3HE      MET  15  -6.230   3.249  -0.029
   99    HE2  MET  15           1HE      MET  15  -5.007   4.467  -0.402
  100    HE3  MET  15           2HE      MET  15  -5.215   3.067  -1.450
  101    H    MET  16           H        MET  16  -3.103   3.005  -4.989
  102    HA   MET  16           HA       MET  16  -1.387   4.447  -3.251
  103    HB2  MET  16           1HB      MET  16  -0.977   1.962  -4.985
  104    HB3  MET  16           2HB      MET  16   0.286   2.522  -3.888
  105    HG2  MET  16           1HG      MET  16  -2.565   1.829  -2.917
  106    HG3  MET  16           2HG      MET  16  -1.231   0.676  -2.889
  107    HE1  MET  16           3HE      MET  16   1.130   1.359  -1.782
  108    HE2  MET  16           1HE      MET  16   0.176   0.394  -0.663
  109    HE3  MET  16           2HE      MET  16   1.055   1.803  -0.095
  110    H    GLU  17           H        GLU  17  -1.068   3.899  -6.709
  111    HA   GLU  17           HA       GLU  17   1.520   5.176  -6.934
  112    HB2  GLU  17           1HB      GLU  17   1.227   4.903  -9.359
  113    HB3  GLU  17           2HB      GLU  17   0.554   3.460  -8.570
  114    HG2  GLU  17           1HG      GLU  17  -1.773   4.581  -8.785
  115    HG3  GLU  17           2HG      GLU  17  -1.047   5.812  -9.771
  116    H    GLU  18           H        GLU  18  -1.870   6.242  -7.222
  117    HA   GLU  18           HA       GLU  18  -1.261   8.974  -8.133
  118    HB2  GLU  18           1HB      GLU  18  -3.882   7.626  -7.192
  119    HB3  GLU  18           2HB      GLU  18  -3.812   9.326  -7.727
  120    HG2  GLU  18           1HG      GLU  18  -3.021   8.565 -10.038
  121    HG3  GLU  18           2HG      GLU  18  -3.054   6.904  -9.512
  122    H    ALA  19           H        ALA  19  -1.513   7.328  -5.089
  123    HA   ALA  19           HA       ALA  19  -2.121   9.779  -3.570
  124    HB1  ALA  19           1HB      ALA  19  -2.053   8.211  -1.559
  125    HB2  ALA  19           2HB      ALA  19  -1.635   6.889  -2.664
  126    HB3  ALA  19           3HB      ALA  19  -3.185   7.688  -2.804
  127    H    LYS  20           H        LYS  20   0.511   8.852  -5.175
  128    HA   LYS  20           HA       LYS  20   2.691   8.232  -4.015
  129    HB2  LYS  20           1HB      LYS  20   2.495   9.705  -6.153
  130    HB3  LYS  20           2HB      LYS  20   2.633  11.116  -5.085
  131    HG2  LYS  20           1HG      LYS  20   5.004  10.805  -5.573
  132    HG3  LYS  20           2HG      LYS  20   4.892   9.754  -4.140
  133    HD2  LYS  20           1HD      LYS  20   5.960   8.218  -5.705
  134    HD3  LYS  20           2HD      LYS  20   4.249   7.802  -5.990
  135    HE2  LYS  20           1HE      LYS  20   4.250   9.520  -7.938
  136    HE3  LYS  20           2HE      LYS  20   5.995   9.695  -7.704
  137    HZ1  LYS  20           3HZ      LYS  20   4.884   7.940  -9.274
  138    HZ2  LYS  20           1HZ      LYS  20   4.967   7.026  -7.854
  139    HZ3  LYS  20           2HZ      LYS  20   6.377   7.708  -8.505
  140    H    PHE  21           H        PHE  21   3.498   8.376  -1.983
  141    HA   PHE  21           HA       PHE  21   3.316  10.926  -0.473
  142    HB2  PHE  21           1HB      PHE  21   2.570   9.636   1.568
  143    HB3  PHE  21           2HB      PHE  21   1.427   9.433   0.220
  144    HD1  PHE  21           1HD      PHE  21   1.440   7.233  -1.207
  145    HD2  PHE  21           2HD      PHE  21   3.874   7.613   2.354
  146    HE1  PHE  21           1HE      PHE  21   1.793   4.776  -1.192
  147    HE2  PHE  21           2HE      PHE  21   4.247   5.150   2.363
  148    HZ   PHE  21           HZ       PHE  21   3.201   3.737   0.584
  149    H    ASN  22           H        ASN  22   4.634  10.659   1.593
  150    HA   ASN  22           HA       ASN  22   7.257  10.522   0.966
  151    HB2  ASN  22           1HB      ASN  22   5.978  10.104   3.707
  152    HB3  ASN  22           2HB      ASN  22   7.725  10.324   3.489
  153   HD21  ASN  22          1HD2      ASN  22   4.624  11.863   2.523
  154   HD22  ASN  22          2HD2      ASN  22   5.196  13.455   2.639
  155    HA   PRO  23           HA       PRO  23   7.718   5.916   0.490
  156    HB2  PRO  23           1HB      PRO  23  10.437   5.796  -0.090
  157    HB3  PRO  23           2HB      PRO  23   9.223   6.400  -1.259
  158    HG2  PRO  23           1HG      PRO  23  11.052   8.027   0.556
  159    HG3  PRO  23           2HG      PRO  23  10.682   8.290  -1.163
  160    HD2  PRO  23           1HD      PRO  23   9.480   9.710   0.846
  161    HD3  PRO  23           2HD      PRO  23   8.644   9.331  -0.690
  162    H    ARG  24           H        ARG  24   9.263   7.869   2.887
  163    HA   ARG  24           HA       ARG  24  10.400   5.558   4.380
  164    HB2  ARG  24           1HB      ARG  24  10.422   8.593   4.940
  165    HB3  ARG  24           2HB      ARG  24  11.259   7.386   5.966
  166    HG2  ARG  24           1HG      ARG  24  12.714   6.701   3.937
  167    HG3  ARG  24           2HG      ARG  24  11.886   7.928   2.959
  168    HD2  ARG  24           1HD      ARG  24  13.474   8.625   5.514
  169    HD3  ARG  24           2HD      ARG  24  14.154   8.769   3.871
  170    HE   ARG  24           HE       ARG  24  12.132  10.530   5.107
  171   HH11  ARG  24          1HH2      ARG  24  13.351   9.352   2.057
  172   HH12  ARG  24          2HH2      ARG  24  12.881  10.759   1.165
  173   HH21  ARG  24          1HH1      ARG  24  11.477  12.343   3.914
  174   HH22  ARG  24          2HH1      ARG  24  11.815  12.451   2.220
  175    H    ALA  25           H        ALA  25   7.417   6.895   4.107
  176    HA   ALA  25           HA       ALA  25   6.618   6.840   6.924
  177    HB1  ALA  25           1HB      ALA  25   5.374   8.219   5.202
  178    HB2  ALA  25           2HB      ALA  25   4.283   7.057   5.952
  179    HB3  ALA  25           3HB      ALA  25   4.938   6.756   4.341
  180    H    THR  26           H        THR  26   5.201   5.266   7.761
  181    HA   THR  26           HA       THR  26   5.796   2.486   6.883
  182    HB   THR  26           HB       THR  26   5.185   1.857   9.240
  183    HG1  THR  26           1HG      THR  26   4.889   3.993  10.548
  184   HG21  THR  26          3HG2      THR  26   7.016   3.042  10.479
  185   HG22  THR  26          1HG2      THR  26   7.002   4.374   9.315
  186   HG23  THR  26          2HG2      THR  26   7.581   2.773   8.825
  187    H    PHE  27           H        PHE  27   4.016   0.994   7.281
  188    HA   PHE  27           HA       PHE  27   1.722   1.564   5.734
  189    HB2  PHE  27           1HB      PHE  27   2.568  -0.742   5.930
  190    HB3  PHE  27           2HB      PHE  27   2.377  -0.711   7.701
  191    HD1  PHE  27           1HD      PHE  27   0.324  -0.221   4.498
  192    HD2  PHE  27           2HD      PHE  27   0.187  -1.465   8.686
  193    HE1  PHE  27           1HE      PHE  27  -2.052  -0.820   4.241
  194    HE2  PHE  27           2HE      PHE  27  -2.193  -2.099   8.391
  195    HZ   PHE  27           HZ       PHE  27  -3.297  -1.789   6.185
  196    H    SER  28           H        SER  28   2.174   1.358   9.281
  197    HA   SER  28           HA       SER  28  -0.531   1.685  10.123
  198    HB2  SER  28           1HB      SER  28   2.069   2.630  11.479
  199    HB3  SER  28           2HB      SER  28   0.501   2.511  12.303
  200    HG   SER  28           HG       SER  28   1.546   0.630  12.659
  201    H    GLU  29           H        GLU  29   1.919   4.109   9.264
  202    HA   GLU  29           HA       GLU  29   0.302   6.437   9.936
  203    HB2  GLU  29           1HB      GLU  29   2.845   6.088   8.210
  204    HB3  GLU  29           2HB      GLU  29   2.147   7.688   8.576
  205    HG2  GLU  29           1HG      GLU  29   3.128   5.672  10.750
  206    HG3  GLU  29           2HG      GLU  29   4.057   7.081  10.202
  207    H    PHE  30           H        PHE  30   1.078   4.759   6.911
  208    HA   PHE  30           HA       PHE  30  -0.342   6.533   5.169
  209    HB2  PHE  30           1HB      PHE  30   1.440   4.941   4.415
  210    HB3  PHE  30           2HB      PHE  30   0.401   3.558   4.855
  211    HD1  PHE  30           2HD      PHE  30   0.558   6.647   2.627
  212    HD2  PHE  30           1HD      PHE  30  -1.481   2.818   3.308
  213    HE1  PHE  30           2HE      PHE  30  -0.692   6.902   0.483
  214    HE2  PHE  30           1HE      PHE  30  -2.718   3.122   1.170
  215    HZ   PHE  30           HZ       PHE  30  -2.313   5.145  -0.242
  216    H    ALA  31           H        ALA  31  -1.241   3.430   6.715
  217    HA   ALA  31           HA       ALA  31  -3.872   3.184   5.605
  218    HB1  ALA  31           1HB      ALA  31  -2.587   1.276   6.641
  219    HB2  ALA  31           2HB      ALA  31  -4.197   1.397   7.329
  220    HB3  ALA  31           3HB      ALA  31  -2.786   1.976   8.237
  221    H    ALA  32           H        ALA  32  -2.634   4.618   8.610
  222    HA   ALA  32           HA       ALA  32  -5.109   5.195   9.944
  223    HB1  ALA  32           1HB      ALA  32  -3.749   7.018  11.143
  224    HB2  ALA  32           2HB      ALA  32  -2.426   6.721   9.998
  225    HB3  ALA  32           3HB      ALA  32  -2.926   5.455  11.116
  226    H    LYS  33           H        LYS  33  -3.364   6.912   7.404
  227    HA   LYS  33           HA       LYS  33  -5.112   9.216   7.517
  228    HB2  LYS  33           1HB      LYS  33  -2.694   9.271   6.734
  229    HB3  LYS  33           2HB      LYS  33  -3.172   8.337   5.290
  230    HG2  LYS  33           1HG      LYS  33  -4.768  10.196   4.565
  231    HG3  LYS  33           2HG      LYS  33  -4.402  11.112   6.055
  232    HD2  LYS  33           1HD      LYS  33  -1.986  11.359   5.294
  233    HD3  LYS  33           2HD      LYS  33  -2.375  10.472   3.801
  234    HE2  LYS  33           1HE      LYS  33  -4.022  12.282   3.136
  235    HE3  LYS  33           2HE      LYS  33  -3.671  13.162   4.644
  236    HZ1  LYS  33           3HZ      LYS  33  -2.021  14.055   3.610
  237    HZ2  LYS  33           1HZ      LYS  33  -2.239  13.082   2.250
  238    HZ3  LYS  33           2HZ      LYS  33  -1.269  12.536   3.530
  239    H    HIS  34           H        HIS  34  -4.879   6.301   5.458
  240    HA   HIS  34           HA       HIS  34  -7.208   7.125   3.821
  241    HB2  HIS  34           1HB      HIS  34  -5.222   4.770   3.571
  242    HB3  HIS  34           2HB      HIS  34  -6.548   5.063   2.414
  243    HD2  HIS  34           2HD      HIS  34  -5.844   6.935   0.433
  244    HE1  HIS  34           1HE      HIS  34  -2.343   8.393   2.227
  245    HE2  HIS  34           2HE      HIS  34  -3.805   8.504   0.165
  246    H    ALA  35           H        ALA  35  -6.749   5.652   6.727
  247    HA   ALA  35           HA       ALA  35  -8.093   3.221   6.760
  248    HB1  ALA  35           1HB      ALA  35  -8.050   5.480   8.852
  249    HB2  ALA  35           2HB      ALA  35  -7.119   3.988   8.869
  250    HB3  ALA  35           3HB      ALA  35  -8.841   3.932   9.183
  251    H    LYS  36           H        LYS  36  -9.502   6.516   6.703
  252    HA   LYS  36           HA       LYS  36 -12.238   5.591   6.982
  253    HB2  LYS  36           1HB      LYS  36 -10.998   8.309   6.169
  254    HB3  LYS  36           2HB      LYS  36 -12.750   8.073   6.500
  255    HG2  LYS  36           1HG      LYS  36 -12.182   7.322   8.879
  256    HG3  LYS  36           2HG      LYS  36 -10.445   7.595   8.540
  257    HD2  LYS  36           1HD      LYS  36 -10.862  10.070   8.185
  258    HD3  LYS  36           2HD      LYS  36 -12.617   9.843   8.427
  259    HE2  LYS  36           1HE      LYS  36 -11.544  10.698  10.559
  260    HE3  LYS  36           2HE      LYS  36 -12.143   9.044  10.820
  261    HZ1  LYS  36           3HZ      LYS  36  -9.370   9.633   9.934
  262    HZ2  LYS  36           1HZ      LYS  36  -9.984   8.172  10.533
  263    HZ3  LYS  36           2HZ      LYS  36  -9.802   9.503  11.572
  264    H    ASP  37           H        ASP  37 -10.079   5.700   4.362
  265    HA   ASP  37           HA       ASP  37 -11.957   6.368   2.268
  266    HB2  ASP  37           1HB      ASP  37  -9.257   4.872   2.192
  267    HB3  ASP  37           2HB      ASP  37 -10.134   5.378   0.769
  268    H    SER  38           H        SER  38 -13.164   4.985   1.075
  269    HA   SER  38           HA       SER  38 -14.118   2.516   2.227
  270    HB2  SER  38           1HB      SER  38 -15.588   4.048   0.925
  271    HB3  SER  38           2HB      SER  38 -14.635   3.763  -0.540
  272    HG   SER  38           HG       SER  38 -15.771   2.018  -0.781
  273    H    ARG  39           H        ARG  39 -11.848   3.377  -0.321
  274    HA   ARG  39           HA       ARG  39 -11.540   0.819  -1.607
  275    HB2  ARG  39           1HB      ARG  39  -9.676   3.257  -1.423
  276    HB3  ARG  39           2HB      ARG  39  -9.307   1.820  -2.433
  277    HG2  ARG  39           1HG      ARG  39 -11.491   2.176  -3.756
  278    HG3  ARG  39           2HG      ARG  39 -11.871   3.601  -2.744
  279    HD2  ARG  39           1HD      ARG  39  -9.336   3.374  -4.489
  280    HD3  ARG  39           2HD      ARG  39 -10.829   4.200  -5.009
  281    HE   ARG  39           HE       ARG  39 -10.074   5.253  -2.454
  282   HH11  ARG  39          1HH2      ARG  39  -8.978   5.135  -5.720
  283   HH12  ARG  39          2HH2      ARG  39  -8.191   6.676  -5.682
  284   HH21  ARG  39          1HH1      ARG  39  -9.039   7.276  -2.360
  285   HH22  ARG  39          2HH1      ARG  39  -8.228   7.896  -3.757
  286    H    PHE  40           H        PHE  40 -10.285   2.195   1.277
  287    HA   PHE  40           HA       PHE  40  -8.068   0.366   1.583
  288    HB2  PHE  40           1HB      PHE  40  -8.089   2.580   2.743
  289    HB3  PHE  40           2HB      PHE  40  -9.542   2.120   3.649
  290    HD1  PHE  40           1HD      PHE  40  -5.924   1.138   3.048
  291    HD2  PHE  40           2HD      PHE  40  -9.377   0.703   5.729
  292    HE1  PHE  40           1HE      PHE  40  -4.524  -0.077   4.704
  293    HE2  PHE  40           2HE      PHE  40  -7.939  -0.483   7.363
  294    HZ   PHE  40           HZ       PHE  40  -5.535  -0.864   6.862
  295    H    LYS  41           H        LYS  41 -11.335   0.574   2.905
  296    HA   LYS  41           HA       LYS  41 -11.340  -1.839   4.459
  297    HB2  LYS  41           1HB      LYS  41 -13.774  -0.306   3.314
  298    HB3  LYS  41           2HB      LYS  41 -13.809  -1.431   4.710
  299    HG2  LYS  41           1HG      LYS  41 -11.974   1.101   4.795
  300    HG3  LYS  41           2HG      LYS  41 -13.691   1.223   5.212
  301    HD2  LYS  41           1HD      LYS  41 -12.036  -0.971   6.655
  302    HD3  LYS  41           2HD      LYS  41 -11.872   0.711   7.212
  303    HE2  LYS  41           1HE      LYS  41 -14.292   0.844   7.736
  304    HE3  LYS  41           2HE      LYS  41 -14.615  -0.710   6.961
  305    HZ1  LYS  41           3HZ      LYS  41 -14.219  -1.635   8.849
  306    HZ2  LYS  41           1HZ      LYS  41 -13.763  -0.165   9.548
  307    HZ3  LYS  41           2HZ      LYS  41 -12.604  -1.119   8.758
  308    H    ALA  42           H        ALA  42 -11.457  -1.386   1.151
  309    HA   ALA  42           HA       ALA  42 -13.254  -3.477   0.285
  310    HB1  ALA  42           1HB      ALA  42 -12.261  -1.571  -1.159
  311    HB2  ALA  42           2HB      ALA  42 -12.091  -3.162  -1.895
  312    HB3  ALA  42           3HB      ALA  42 -10.708  -2.403  -1.104
  313    H    ILE  43           H        ILE  43  -9.831  -3.422   1.242
  314    HA   ILE  43           HA       ILE  43  -9.504  -6.303   0.591
  315    HB   ILE  43           HB       ILE  43  -7.651  -4.288   2.057
  316   HG12  ILE  43          1HG1      ILE  43  -7.363  -5.362  -0.867
  317   HG13  ILE  43          2HG1      ILE  43  -8.121  -3.807  -0.512
  318   HG21  ILE  43          1HG2      ILE  43  -7.027  -6.646   2.786
  319   HG22  ILE  43          2HG2      ILE  43  -5.822  -6.173   1.602
  320   HG23  ILE  43          3HG2      ILE  43  -7.114  -7.262   1.131
  321   HD11  ILE  43          3HD1      ILE  43  -5.729  -3.609  -1.171
  322   HD12  ILE  43          1HD1      ILE  43  -5.237  -4.525   0.242
  323   HD13  ILE  43          2HD1      ILE  43  -6.025  -2.957   0.439
  324    H    GLU  44           H        GLU  44  -9.965  -7.846   1.963
  325    HA   GLU  44           HA       GLU  44 -10.962  -7.297   4.686
  326    HB2  GLU  44           1HB      GLU  44 -10.748  -9.839   2.943
  327    HB3  GLU  44           2HB      GLU  44 -11.473  -9.817   4.582
  328    HG2  GLU  44           1HG      GLU  44 -13.221  -8.110   3.784
  329    HG3  GLU  44           2HG      GLU  44 -12.501  -8.117   2.164
  330    H    LYS  45           H        LYS  45  -8.346  -9.199   3.105
  331    HA   LYS  45           HA       LYS  45  -7.239 -10.165   5.626
  332    HB2  LYS  45           1HB      LYS  45  -6.135 -10.143   2.742
  333    HB3  LYS  45           2HB      LYS  45  -5.351 -10.995   4.112
  334    HG2  LYS  45           1HG      LYS  45  -7.467 -12.396   4.431
  335    HG3  LYS  45           2HG      LYS  45  -8.222 -11.553   3.042
  336    HD2  LYS  45           1HD      LYS  45  -6.431 -12.472   1.482
  337    HD3  LYS  45           2HD      LYS  45  -5.617 -13.277   2.851
  338    HE2  LYS  45           1HE      LYS  45  -7.067 -14.932   1.584
  339    HE3  LYS  45           2HE      LYS  45  -7.721 -14.693   3.224
  340    HZ1  LYS  45           3HZ      LYS  45  -9.079 -14.330   0.880
  341    HZ2  LYS  45           1HZ      LYS  45  -8.686 -12.748   1.349
  342    HZ3  LYS  45           2HZ      LYS  45  -9.555 -13.758   2.406
  343    H    MET  46           H        MET  46  -6.192  -8.933   6.919
  344    HA   MET  46           HA       MET  46  -5.060  -6.387   6.325
  345    HB2  MET  46           1HB      MET  46  -4.794  -8.268   8.735
  346    HB3  MET  46           2HB      MET  46  -4.136  -6.614   8.702
  347    HG2  MET  46           1HG      MET  46  -6.513  -5.689   8.274
  348    HG3  MET  46           2HG      MET  46  -7.133  -7.345   8.340
  349    HE1  MET  46           3HE      MET  46  -6.361  -4.170  10.401
  350    HE2  MET  46           1HE      MET  46  -4.755  -4.898  10.339
  351    HE3  MET  46           2HE      MET  46  -5.611  -4.778  11.864
  352    H    LYS  47           H        LYS  47  -3.776  -9.617   6.525
  353    HA   LYS  47           HA       LYS  47  -0.987  -9.026   6.574
  354    HB2  LYS  47           1HB      LYS  47  -2.541 -11.427   5.400
  355    HB3  LYS  47           2HB      LYS  47  -0.758 -11.400   5.602
  356    HG2  LYS  47           1HG      LYS  47  -1.045 -11.038   8.115
  357    HG3  LYS  47           2HG      LYS  47  -2.824 -11.081   7.914
  358    HD2  LYS  47           1HD      LYS  47  -2.661 -13.499   7.049
  359    HD3  LYS  47           2HD      LYS  47  -0.891 -13.450   7.277
  360    HE2  LYS  47           1HE      LYS  47  -2.930 -13.061   9.585
  361    HE3  LYS  47           2HE      LYS  47  -2.061 -14.578   9.253
  362    HZ1  LYS  47           3HZ      LYS  47  -0.598 -13.626  10.681
  363    HZ2  LYS  47           1HZ      LYS  47  -1.036 -12.037  10.284
  364    HZ3  LYS  47           2HZ      LYS  47  -0.020 -12.923   9.247
  365    H    ASP  48           H        ASP  48  -3.321  -9.350   3.936
  366    HA   ASP  48           HA       ASP  48  -1.422  -9.323   1.813
  367    HB2  ASP  48           1HB      ASP  48  -3.825 -10.088   1.485
  368    HB3  ASP  48           2HB      ASP  48  -4.397  -8.440   1.798
  369    H    ARG  49           H        ARG  49  -3.044  -6.784   3.663
  370    HA   ARG  49           HA       ARG  49  -2.501  -4.546   1.938
  371    HB2  ARG  49           1HB      ARG  49  -2.713  -4.616   5.014
  372    HB3  ARG  49           2HB      ARG  49  -2.874  -3.180   4.004
  373    HG2  ARG  49           1HG      ARG  49  -4.937  -4.164   2.881
  374    HG3  ARG  49           2HG      ARG  49  -4.790  -5.588   3.915
  375    HD2  ARG  49           1HD      ARG  49  -4.948  -3.939   5.952
  376    HD3  ARG  49           2HD      ARG  49  -5.470  -2.755   4.745
  377    HE   ARG  49           HE       ARG  49  -7.052  -5.060   4.361
  378   HH11  ARG  49          1HH2      ARG  49  -6.420  -2.666   6.768
  379   HH12  ARG  49          2HH2      ARG  49  -7.980  -2.776   7.509
  380   HH21  ARG  49          1HH1      ARG  49  -9.047  -5.285   5.372
  381   HH22  ARG  49          2HH1      ARG  49  -9.474  -4.267   6.699
  382    H    GLU  50           H        GLU  50  -0.794  -6.009   4.684
  383    HA   GLU  50           HA       GLU  50   1.356  -4.132   4.750
  384    HB2  GLU  50           1HB      GLU  50   0.744  -5.921   6.586
  385    HB3  GLU  50           2HB      GLU  50   1.667  -7.083   5.601
  386    HG2  GLU  50           1HG      GLU  50   3.299  -6.160   7.272
  387    HG3  GLU  50           2HG      GLU  50   3.709  -5.408   5.731
  388    H    ALA  51           H        ALA  51   0.957  -7.310   3.121
  389    HA   ALA  51           HA       ALA  51   3.543  -7.676   2.074
  390    HB1  ALA  51           1HB      ALA  51   0.830  -8.512   0.856
  391    HB2  ALA  51           2HB      ALA  51   1.739  -9.440   2.042
  392    HB3  ALA  51           3HB      ALA  51   2.392  -9.219   0.411
  393    H    LEU  52           H        LEU  52   0.696  -6.066   0.624
  394    HA   LEU  52           HA       LEU  52   1.893  -5.278  -1.835
  395    HB2  LEU  52           1HB      LEU  52  -0.486  -4.199  -0.232
  396    HB3  LEU  52           2HB      LEU  52  -0.077  -3.603  -1.866
  397    HG   LEU  52           HG       LEU  52  -0.642  -6.620  -1.306
  398   HD11  LEU  52          1HD1      LEU  52  -2.726  -5.469  -0.764
  399   HD12  LEU  52          2HD1      LEU  52  -2.943  -6.246  -2.336
  400   HD13  LEU  52          3HD1      LEU  52  -2.665  -4.508  -2.250
  401   HD21  LEU  52          3HD2      LEU  52  -1.032  -6.709  -3.906
  402   HD22  LEU  52          1HD2      LEU  52   0.634  -6.370  -3.444
  403   HD23  LEU  52          2HD2      LEU  52  -0.401  -5.062  -4.000
  404    H    PHE  53           H        PHE  53   1.486  -3.636   1.228
  405    HA   PHE  53           HA       PHE  53   2.461  -1.096   0.473
  406    HB2  PHE  53           1HB      PHE  53   1.249  -1.670   2.644
  407    HB3  PHE  53           2HB      PHE  53   2.710  -2.495   3.217
  408    HD1  PHE  53           2HD      PHE  53   1.283   0.864   2.256
  409    HD2  PHE  53           1HD      PHE  53   4.811  -1.165   3.874
  410    HE1  PHE  53           2HE      PHE  53   2.271   3.047   2.873
  411    HE2  PHE  53           1HE      PHE  53   5.778   1.055   4.468
  412    HZ   PHE  53           HZ       PHE  53   4.502   3.144   3.972
  413    H    ASN  54           H        ASN  54   4.134  -3.931   1.854
  414    HA   ASN  54           HA       ASN  54   6.779  -2.828   2.016
  415    HB2  ASN  54           1HB      ASN  54   5.809  -5.753   1.730
  416    HB3  ASN  54           2HB      ASN  54   7.504  -5.333   2.056
  417   HD21  ASN  54          1HD2      ASN  54   5.929  -6.856   3.884
  418   HD22  ASN  54          2HD2      ASN  54   5.720  -5.958   5.305
  419    H    GLU  55           H        GLU  55   5.125  -4.645  -0.560
  420    HA   GLU  55           HA       GLU  55   7.361  -4.767  -2.391
  421    HB2  GLU  55           1HB      GLU  55   4.327  -5.057  -2.805
  422    HB3  GLU  55           2HB      GLU  55   5.516  -5.324  -4.114
  423    HG2  GLU  55           1HG      GLU  55   6.588  -7.208  -2.793
  424    HG3  GLU  55           2HG      GLU  55   5.508  -6.924  -1.435
  425    H    PHE  56           H        PHE  56   4.610  -2.530  -1.950
  426    HA   PHE  56           HA       PHE  56   4.928  -1.053  -4.304
  427    HB2  PHE  56           1HB      PHE  56   2.903  -0.919  -2.838
  428    HB3  PHE  56           2HB      PHE  56   3.859  -0.184  -1.534
  429    HD1  PHE  56           2HD      PHE  56   2.742   0.315  -5.134
  430    HD2  PHE  56           1HD      PHE  56   4.376   2.305  -1.576
  431    HE1  PHE  56           2HE      PHE  56   2.474   2.538  -6.228
  432    HE2  PHE  56           1HE      PHE  56   4.111   4.505  -2.711
  433    HZ   PHE  56           HZ       PHE  56   3.157   4.619  -5.017
  434    H    VAL  57           H        VAL  57   6.234  -0.519  -1.002
  435    HA   VAL  57           HA       VAL  57   7.690   1.886  -1.554
  436    HB   VAL  57           HB       VAL  57   8.047  -0.287   0.622
  437   HG11  VAL  57          1HG1      VAL  57  10.293   0.848   0.540
  438   HG12  VAL  57          2HG1      VAL  57   9.442   1.638   1.868
  439   HG13  VAL  57          3HG1      VAL  57   9.557   2.448   0.306
  440   HG21  VAL  57          3HG2      VAL  57   6.846   1.373   2.112
  441   HG22  VAL  57          1HG2      VAL  57   5.830   1.079   0.697
  442   HG23  VAL  57          2HG2      VAL  57   6.773   2.562   0.825
  443    H    ALA  58           H        ALA  58   8.665  -1.566  -1.502
  444    HA   ALA  58           HA       ALA  58  11.430  -1.138  -2.067
  445    HB1  ALA  58           1HB      ALA  58  11.444  -3.621  -2.618
  446    HB2  ALA  58           2HB      ALA  58   9.671  -3.618  -2.620
  447    HB3  ALA  58           3HB      ALA  58  10.543  -3.297  -1.125
  448    H    ALA  59           H        ALA  59   8.560  -1.689  -4.160
  449    HA   ALA  59           HA       ALA  59  10.002  -1.877  -6.657
  450    HB1  ALA  59           1HB      ALA  59   7.668  -1.733  -7.666
  451    HB2  ALA  59           2HB      ALA  59   7.014  -1.318  -6.065
  452    HB3  ALA  59           3HB      ALA  59   7.729  -2.909  -6.343
  453    H    ALA  60           H        ALA  60   8.223   0.725  -4.925
  454    HA   ALA  60           HA       ALA  60   8.352   2.712  -6.988
  455    HB1  ALA  60           1HB      ALA  60   7.761   4.336  -5.094
  456    HB2  ALA  60           2HB      ALA  60   8.057   3.031  -3.921
  457    HB3  ALA  60           3HB      ALA  60   6.736   2.893  -5.081
  458    H    ARG  61           H        ARG  61  10.435   1.932  -4.200
  459    HA   ARG  61           HA       ARG  61  12.131   4.185  -4.575
  460    HB2  ARG  61           1HB      ARG  61  11.927   3.002  -2.376
  461    HB3  ARG  61           2HB      ARG  61  12.663   1.539  -3.080
  462    HG2  ARG  61           1HG      ARG  61  14.872   2.867  -3.504
  463    HG3  ARG  61           2HG      ARG  61  14.117   4.301  -2.789
  464    HD2  ARG  61           1HD      ARG  61  14.553   1.644  -1.270
  465    HD3  ARG  61           2HD      ARG  61  15.635   3.066  -1.121
  466    HE   ARG  61           HE       ARG  61  12.935   2.779   0.012
  467   HH11  ARG  61          1HH2      ARG  61  15.256   5.112  -1.145
  468   HH12  ARG  61          2HH2      ARG  61  14.693   6.391  -0.122
  469   HH21  ARG  61          1HH1      ARG  61  12.173   4.473   1.299
  470   HH22  ARG  61          2HH1      ARG  61  12.940   6.023   1.261
  Start of MODEL   14
    1    H    ILE   5           H        ILE   5 -13.360 -10.221 -11.899
    2    HA   ILE   5           HA       ILE   5 -11.775  -9.550 -13.422
    3    HB   ILE   5           HB       ILE   5 -13.207  -6.895 -13.166
    4   HG12  ILE   5          1HG1      ILE   5 -13.652  -9.037 -15.250
    5   HG13  ILE   5          2HG1      ILE   5 -14.574  -9.006 -13.747
    6   HG21  ILE   5          1HG2      ILE   5 -11.132  -8.009 -15.009
    7   HG22  ILE   5          2HG2      ILE   5 -11.327  -6.364 -14.407
    8   HG23  ILE   5          3HG2      ILE   5 -12.372  -6.960 -15.696
    9   HD11  ILE   5          3HD1      ILE   5 -14.373  -6.662 -15.659
   10   HD12  ILE   5          1HD1      ILE   5 -15.417  -6.786 -14.243
   11   HD13  ILE   5          2HD1      ILE   5 -15.709  -7.813 -15.648
   12    H    MET   6           H        MET   6 -11.099  -9.406 -10.621
   13    HA   MET   6           HA       MET   6  -9.645  -8.381  -9.134
   14    HB2  MET   6           1HB      MET   6  -8.127  -8.182 -11.746
   15    HB3  MET   6           2HB      MET   6  -7.410  -8.014 -10.144
   16    HG2  MET   6           1HG      MET   6  -8.209 -10.297  -9.570
   17    HG3  MET   6           2HG      MET   6  -8.843 -10.465 -11.208
   18    HE1  MET   6           3HE      MET   6  -5.963 -10.857 -13.503
   19    HE2  MET   6           1HE      MET   6  -7.282  -9.701 -13.274
   20    HE3  MET   6           2HE      MET   6  -7.577 -11.428 -13.088
   21    H    GLN   7           H        GLN   7 -11.635  -6.579 -10.208
   22    HA   GLN   7           HA       GLN   7 -10.481  -4.124 -11.045
   23    HB2  GLN   7           1HB      GLN   7 -12.886  -4.755 -11.332
   24    HB3  GLN   7           2HB      GLN   7 -13.107  -4.528  -9.597
   25    HG2  GLN   7           1HG      GLN   7 -12.406  -2.190  -9.783
   26    HG3  GLN   7           2HG      GLN   7 -12.088  -2.402 -11.504
   27   HE21  GLN   7          1HE2      GLN   7 -13.834  -0.463 -11.272
   28   HE22  GLN   7          2HE2      GLN   7 -15.446  -0.959 -11.464
   29    H    ALA   8           H        ALA   8 -11.290  -5.466  -7.881
   30    HA   ALA   8           HA       ALA   8 -10.939  -3.110  -6.366
   31    HB1  ALA   8           1HB      ALA   8 -10.700  -4.628  -4.442
   32    HB2  ALA   8           2HB      ALA   8 -10.524  -5.994  -5.542
   33    HB3  ALA   8           3HB      ALA   8 -12.048  -5.111  -5.471
   34    H    LYS   9           H        LYS   9  -8.685  -5.690  -7.293
   35    HA   LYS   9           HA       LYS   9  -6.473  -4.735  -5.800
   36    HB2  LYS   9           1HB      LYS   9  -6.546  -6.415  -8.319
   37    HB3  LYS   9           2HB      LYS   9  -5.130  -6.185  -7.293
   38    HG2  LYS   9           1HG      LYS   9  -7.743  -7.227  -6.191
   39    HG3  LYS   9           2HG      LYS   9  -6.522  -8.304  -6.871
   40    HD2  LYS   9           1HD      LYS   9  -4.855  -7.420  -5.278
   41    HD3  LYS   9           2HD      LYS   9  -6.080  -6.355  -4.588
   42    HE2  LYS   9           1HE      LYS   9  -7.437  -8.320  -3.963
   43    HE3  LYS   9           2HE      LYS   9  -6.208  -9.386  -4.645
   44    HZ1  LYS   9           3HZ      LYS   9  -6.291  -8.444  -2.081
   45    HZ2  LYS   9           1HZ      LYS   9  -5.098  -7.492  -2.820
   46    HZ3  LYS   9           2HZ      LYS   9  -4.962  -9.186  -2.835
   47    H    GLU  10           H        GLU  10  -7.566  -4.152  -9.118
   48    HA   GLU  10           HA       GLU  10  -5.322  -2.610  -9.925
   49    HB2  GLU  10           1HB      GLU  10  -8.167  -2.746 -10.940
   50    HB3  GLU  10           2HB      GLU  10  -6.911  -1.773 -11.709
   51    HG2  GLU  10           1HG      GLU  10  -5.543  -3.752 -12.085
   52    HG3  GLU  10           2HG      GLU  10  -6.694  -4.753 -11.201
   53    H    ASP  11           H        ASP  11  -8.424  -1.790  -8.439
   54    HA   ASP  11           HA       ASP  11  -8.194   1.021  -8.622
   55    HB2  ASP  11           1HB      ASP  11  -9.662  -0.750  -6.661
   56    HB3  ASP  11           2HB      ASP  11  -9.812   1.006  -6.690
   57    H    PHE  12           H        PHE  12  -7.123  -1.302  -6.171
   58    HA   PHE  12           HA       PHE  12  -6.237   0.581  -4.258
   59    HB2  PHE  12           1HB      PHE  12  -6.580  -1.834  -3.788
   60    HB3  PHE  12           2HB      PHE  12  -5.164  -2.203  -4.773
   61    HD1  PHE  12           1HD      PHE  12  -6.294  -0.303  -1.768
   62    HD2  PHE  12           2HD      PHE  12  -2.976  -2.022  -3.883
   63    HE1  PHE  12           1HE      PHE  12  -4.822   0.144   0.179
   64    HE2  PHE  12           2HE      PHE  12  -1.503  -1.575  -1.939
   65    HZ   PHE  12           HZ       PHE  12  -2.427  -0.492   0.092
   66    H    LYS  13           H        LYS  13  -4.492  -1.153  -6.834
   67    HA   LYS  13           HA       LYS  13  -1.968   0.022  -6.351
   68    HB2  LYS  13           1HB      LYS  13  -3.179  -1.187  -8.842
   69    HB3  LYS  13           2HB      LYS  13  -1.497  -0.665  -8.734
   70    HG2  LYS  13           1HG      LYS  13  -1.131  -2.194  -6.842
   71    HG3  LYS  13           2HG      LYS  13  -2.817  -2.705  -6.918
   72    HD2  LYS  13           1HD      LYS  13  -2.463  -3.536  -9.218
   73    HD3  LYS  13           2HD      LYS  13  -0.772  -3.037  -9.134
   74    HE2  LYS  13           1HE      LYS  13  -0.405  -4.564  -7.237
   75    HE3  LYS  13           2HE      LYS  13  -2.096  -5.057  -7.299
   76    HZ1  LYS  13           3HZ      LYS  13  -0.201  -5.340  -9.565
   77    HZ2  LYS  13           1HZ      LYS  13  -1.776  -5.961  -9.466
   78    HZ3  LYS  13           2HZ      LYS  13  -0.555  -6.584  -8.463
   79    H    LYS  14           H        LYS  14  -4.659   0.950  -8.461
   80    HA   LYS  14           HA       LYS  14  -3.408   3.087  -9.790
   81    HB2  LYS  14           1HB      LYS  14  -5.606   2.099 -10.428
   82    HB3  LYS  14           2HB      LYS  14  -6.328   2.871  -9.015
   83    HG2  LYS  14           1HG      LYS  14  -5.688   5.079  -9.859
   84    HG3  LYS  14           2HG      LYS  14  -4.887   4.338 -11.244
   85    HD2  LYS  14           1HD      LYS  14  -7.044   3.376 -11.974
   86    HD3  LYS  14           2HD      LYS  14  -7.843   4.137 -10.598
   87    HE2  LYS  14           1HE      LYS  14  -7.167   6.359 -11.426
   88    HE3  LYS  14           2HE      LYS  14  -6.361   5.604 -12.801
   89    HZ1  LYS  14           3HZ      LYS  14  -9.249   5.716 -12.194
   90    HZ2  LYS  14           1HZ      LYS  14  -8.620   4.547 -13.251
   91    HZ3  LYS  14           2HZ      LYS  14  -8.441   6.198 -13.609
   92    H    MET  15           H        MET  15  -4.922   2.870  -6.627
   93    HA   MET  15           HA       MET  15  -4.968   5.705  -6.162
   94    HB2  MET  15           1HB      MET  15  -6.517   4.149  -5.021
   95    HB3  MET  15           2HB      MET  15  -5.146   3.418  -4.183
   96    HG2  MET  15           1HG      MET  15  -6.197   5.079  -2.728
   97    HG3  MET  15           2HG      MET  15  -4.596   5.644  -3.208
   98    HE1  MET  15           3HE      MET  15  -6.694   8.903  -2.979
   99    HE2  MET  15           1HE      MET  15  -5.223   8.057  -2.477
  100    HE3  MET  15           2HE      MET  15  -6.803   7.456  -1.980
  101    H    MET  16           H        MET  16  -2.774   3.046  -5.407
  102    HA   MET  16           HA       MET  16  -1.176   4.463  -3.532
  103    HB2  MET  16           1HB      MET  16  -0.717   1.988  -5.194
  104    HB3  MET  16           2HB      MET  16   0.519   2.629  -4.109
  105    HG2  MET  16           1HG      MET  16  -2.306   2.030  -3.202
  106    HG3  MET  16           2HG      MET  16  -0.998   0.851  -3.102
  107    HE1  MET  16           3HE      MET  16   0.219   0.529  -0.949
  108    HE2  MET  16           1HE      MET  16   1.249   1.851  -0.385
  109    HE3  MET  16           2HE      MET  16   1.283   1.364  -2.077
  110    H    GLU  17           H        GLU  17  -0.891   3.901  -7.025
  111    HA   GLU  17           HA       GLU  17   1.727   5.001  -7.248
  112    HB2  GLU  17           1HB      GLU  17   1.376   4.860  -9.644
  113    HB3  GLU  17           2HB      GLU  17   0.723   3.407  -8.886
  114    HG2  GLU  17           1HG      GLU  17  -1.537   4.509  -8.878
  115    HG3  GLU  17           2HG      GLU  17  -0.839   5.830  -9.813
  116    H    GLU  18           H        GLU  18  -1.522   6.318  -7.530
  117    HA   GLU  18           HA       GLU  18  -0.529   8.883  -8.503
  118    HB2  GLU  18           1HB      GLU  18  -2.835   9.500  -8.733
  119    HB3  GLU  18           2HB      GLU  18  -2.681   7.843  -9.318
  120    HG2  GLU  18           1HG      GLU  18  -4.493   7.556  -7.928
  121    HG3  GLU  18           2HG      GLU  18  -3.205   7.294  -6.753
  122    H    ALA  19           H        ALA  19  -0.872   7.380  -5.542
  123    HA   ALA  19           HA       ALA  19  -1.494   9.865  -4.097
  124    HB1  ALA  19           1HB      ALA  19  -1.646   8.386  -2.109
  125    HB2  ALA  19           2HB      ALA  19  -1.246   7.005  -3.131
  126    HB3  ALA  19           3HB      ALA  19  -2.746   7.893  -3.398
  127    H    LYS  20           H        LYS  20   1.122   8.979  -5.494
  128    HA   LYS  20           HA       LYS  20   3.248   8.255  -4.181
  129    HB2  LYS  20           1HB      LYS  20   2.959  10.971  -5.481
  130    HB3  LYS  20           2HB      LYS  20   4.509  10.301  -4.967
  131    HG2  LYS  20           1HG      LYS  20   2.691   8.658  -6.707
  132    HG3  LYS  20           2HG      LYS  20   3.691   9.917  -7.435
  133    HD2  LYS  20           1HD      LYS  20   5.704   8.907  -6.431
  134    HD3  LYS  20           2HD      LYS  20   4.710   7.648  -5.698
  135    HE2  LYS  20           1HE      LYS  20   5.711   6.811  -7.771
  136    HE3  LYS  20           2HE      LYS  20   3.963   6.948  -7.962
  137    HZ1  LYS  20           3HZ      LYS  20   5.732   9.182  -8.717
  138    HZ2  LYS  20           1HZ      LYS  20   4.167   8.827  -9.268
  139    HZ3  LYS  20           2HZ      LYS  20   5.483   7.885  -9.787
  140    H    PHE  21           H        PHE  21   3.870   8.294  -2.127
  141    HA   PHE  21           HA       PHE  21   3.620  10.808  -0.609
  142    HB2  PHE  21           1HB      PHE  21   2.879   9.540   1.370
  143    HB3  PHE  21           2HB      PHE  21   1.731   9.382   0.041
  144    HD1  PHE  21           1HD      PHE  21   1.806   7.315  -1.418
  145    HD2  PHE  21           2HD      PHE  21   4.007   7.639   2.257
  146    HE1  PHE  21           1HE      PHE  21   2.072   4.848  -1.359
  147    HE2  PHE  21           2HE      PHE  21   4.272   5.174   2.316
  148    HZ   PHE  21           HZ       PHE  21   3.305   3.779   0.508
  149    H    ASN  22           H        ASN  22   4.873  10.569   1.540
  150    HA   ASN  22           HA       ASN  22   7.570  10.285   1.037
  151    HB2  ASN  22           1HB      ASN  22   6.109   9.899   3.660
  152    HB3  ASN  22           2HB      ASN  22   7.849  10.124   3.504
  153   HD21  ASN  22          1HD2      ASN  22   4.773  11.745   2.530
  154   HD22  ASN  22          2HD2      ASN  22   5.386  13.318   2.700
  155    HA   PRO  23           HA       PRO  23   7.827   5.886   0.567
  156    HB2  PRO  23           1HB      PRO  23  10.511   5.741   0.135
  157    HB3  PRO  23           2HB      PRO  23   9.370   6.333  -1.087
  158    HG2  PRO  23           1HG      PRO  23  11.150   7.871   0.741
  159    HG3  PRO  23           2HG      PRO  23  10.777   8.149  -0.968
  160    HD2  PRO  23           1HD      PRO  23   9.550   9.566   1.070
  161    HD3  PRO  23           2HD      PRO  23   8.748   9.249  -0.484
  162    H    ARG  24           H        ARG  24   9.368   7.756   3.009
  163    HA   ARG  24           HA       ARG  24  10.517   5.436   4.369
  164    HB2  ARG  24           1HB      ARG  24  10.546   8.396   4.992
  165    HB3  ARG  24           2HB      ARG  24  11.290   7.168   6.019
  166    HG2  ARG  24           1HG      ARG  24  12.730   6.454   4.168
  167    HG3  ARG  24           2HG      ARG  24  11.960   7.626   3.096
  168    HD2  ARG  24           1HD      ARG  24  12.734   9.464   4.547
  169    HD3  ARG  24           2HD      ARG  24  13.500   8.298   5.621
  170    HE   ARG  24           HE       ARG  24  14.510   7.850   3.050
  171   HH11  ARG  24          1HH2      ARG  24  14.434  10.325   5.467
  172   HH12  ARG  24          2HH2      ARG  24  15.964  11.004   5.019
  173   HH21  ARG  24          1HH1      ARG  24  16.517   8.734   2.456
  174   HH22  ARG  24          2HH1      ARG  24  17.142  10.102   3.314
  175    H    ALA  25           H        ALA  25   7.524   6.754   4.129
  176    HA   ALA  25           HA       ALA  25   6.709   6.721   6.887
  177    HB1  ALA  25           1HB      ALA  25   4.426   6.892   5.960
  178    HB2  ALA  25           2HB      ALA  25   5.073   6.634   4.341
  179    HB3  ALA  25           3HB      ALA  25   5.511   8.084   5.243
  180    H    THR  26           H        THR  26   5.129   5.215   7.770
  181    HA   THR  26           HA       THR  26   5.697   2.466   6.878
  182    HB   THR  26           HB       THR  26   5.027   1.785   9.120
  183    HG1  THR  26           1HG      THR  26   4.502   3.478  10.615
  184   HG21  THR  26          3HG2      THR  26   6.805   2.882  10.389
  185   HG22  THR  26          1HG2      THR  26   6.856   4.198   9.217
  186   HG23  THR  26          2HG2      THR  26   7.352   2.575   8.741
  187    H    PHE  27           H        PHE  27   3.862   0.890   7.254
  188    HA   PHE  27           HA       PHE  27   1.647   1.607   5.660
  189    HB2  PHE  27           1HB      PHE  27   2.358  -0.708   5.842
  190    HB3  PHE  27           2HB      PHE  27   2.019  -0.709   7.573
  191    HD1  PHE  27           2HD      PHE  27   0.351  -0.025   4.285
  192    HD2  PHE  27           1HD      PHE  27  -0.082  -1.404   8.329
  193    HE1  PHE  27           2HE      PHE  27  -2.008  -0.635   3.825
  194    HE2  PHE  27           1HE      PHE  27  -2.441  -2.014   7.869
  195    HZ   PHE  27           HZ       PHE  27  -3.404  -1.631   5.617
  196    H    SER  28           H        SER  28   2.050   1.338   9.172
  197    HA   SER  28           HA       SER  28  -0.614   1.679   9.943
  198    HB2  SER  28           1HB      SER  28   0.307   2.482  12.090
  199    HB3  SER  28           2HB      SER  28   1.143   1.040  11.521
  200    HG   SER  28           HG       SER  28   2.821   2.330  10.813
  201    H    GLU  29           H        GLU  29   1.875   4.082   9.185
  202    HA   GLU  29           HA       GLU  29   0.290   6.348   9.893
  203    HB2  GLU  29           1HB      GLU  29   2.738   6.060   8.139
  204    HB3  GLU  29           2HB      GLU  29   2.012   7.610   8.568
  205    HG2  GLU  29           1HG      GLU  29   2.357   7.154  10.944
  206    HG3  GLU  29           2HG      GLU  29   3.000   5.555  10.566
  207    H    PHE  30           H        PHE  30   0.963   4.666   6.845
  208    HA   PHE  30           HA       PHE  30  -0.453   6.489   5.183
  209    HB2  PHE  30           1HB      PHE  30   1.247   4.855   4.363
  210    HB3  PHE  30           2HB      PHE  30   0.101   3.555   4.687
  211    HD1  PHE  30           2HD      PHE  30   0.669   6.635   2.687
  212    HD2  PHE  30           1HD      PHE  30  -1.735   3.114   3.218
  213    HE1  PHE  30           2HE      PHE  30  -0.418   7.046   0.496
  214    HE2  PHE  30           1HE      PHE  30  -2.821   3.526   1.028
  215    HZ   PHE  30           HZ       PHE  30  -2.163   5.491  -0.334
  216    H    ALA  31           H        ALA  31  -1.354   3.445   6.771
  217    HA   ALA  31           HA       ALA  31  -3.946   3.262   5.627
  218    HB1  ALA  31           1HB      ALA  31  -4.381   1.612   7.387
  219    HB2  ALA  31           2HB      ALA  31  -2.923   2.122   8.239
  220    HB3  ALA  31           3HB      ALA  31  -2.796   1.342   6.662
  221    H    ALA  32           H        ALA  32  -2.697   4.759   8.571
  222    HA   ALA  32           HA       ALA  32  -5.120   5.331   9.849
  223    HB1  ALA  32           1HB      ALA  32  -3.868   7.152  10.976
  224    HB2  ALA  32           2HB      ALA  32  -2.544   6.923   9.832
  225    HB3  ALA  32           3HB      ALA  32  -2.969   5.635  10.959
  226    H    LYS  33           H        LYS  33  -3.465   6.957   7.209
  227    HA   LYS  33           HA       LYS  33  -5.177   9.278   7.265
  228    HB2  LYS  33           1HB      LYS  33  -2.828   9.332   6.419
  229    HB3  LYS  33           2HB      LYS  33  -3.336   8.328   5.059
  230    HG2  LYS  33           1HG      LYS  33  -4.914  10.034   4.329
  231    HG3  LYS  33           2HG      LYS  33  -4.547  11.022   5.744
  232    HD2  LYS  33           1HD      LYS  33  -2.202  11.226   4.993
  233    HD3  LYS  33           2HD      LYS  33  -2.577  10.254   3.569
  234    HE2  LYS  33           1HE      LYS  33  -3.955  12.864   4.258
  235    HE3  LYS  33           2HE      LYS  33  -2.613  12.721   3.122
  236    HZ1  LYS  33           3HZ      LYS  33  -4.063  12.167   1.564
  237    HZ2  LYS  33           1HZ      LYS  33  -5.345  12.236   2.674
  238    HZ3  LYS  33           2HZ      LYS  33  -4.494  10.783   2.450
  239    H    HIS  34           H        HIS  34  -5.012   6.247   5.475
  240    HA   HIS  34           HA       HIS  34  -7.308   7.055   3.827
  241    HB2  HIS  34           1HB      HIS  34  -5.425   4.692   3.646
  242    HB3  HIS  34           2HB      HIS  34  -6.796   4.955   2.568
  243    HD2  HIS  34           2HD      HIS  34  -6.220   6.620   0.429
  244    HE1  HIS  34           1HE      HIS  34  -2.613   8.241   1.909
  245    HE2  HIS  34           2HE      HIS  34  -4.180   8.166  -0.089
  246    H    ALA  35           H        ALA  35  -6.860   5.730   6.769
  247    HA   ALA  35           HA       ALA  35  -8.254   3.338   6.872
  248    HB1  ALA  35           1HB      ALA  35  -8.090   5.613   8.849
  249    HB2  ALA  35           2HB      ALA  35  -7.177   4.105   8.853
  250    HB3  ALA  35           3HB      ALA  35  -8.902   4.091   9.216
  251    H    LYS  36           H        LYS  36  -9.499   6.641   6.746
  252    HA   LYS  36           HA       LYS  36 -12.225   5.816   7.240
  253    HB2  LYS  36           1HB      LYS  36 -12.763   8.187   6.886
  254    HB3  LYS  36           2HB      LYS  36 -11.411   8.009   8.008
  255    HG2  LYS  36           1HG      LYS  36  -9.826   8.415   6.153
  256    HG3  LYS  36           2HG      LYS  36 -11.183   8.620   5.045
  257    HD2  LYS  36           1HD      LYS  36 -10.727  10.833   5.630
  258    HD3  LYS  36           2HD      LYS  36 -11.979  10.410   6.797
  259    HE2  LYS  36           1HE      LYS  36 -10.258   9.882   8.474
  260    HE3  LYS  36           2HE      LYS  36  -8.992  10.268   7.308
  261    HZ1  LYS  36           3HZ      LYS  36  -9.987  12.030   9.028
  262    HZ2  LYS  36           1HZ      LYS  36 -11.017  12.309   7.711
  263    HZ3  LYS  36           2HZ      LYS  36  -9.336  12.463   7.520
  264    H    ASP  37           H        ASP  37 -10.432   5.140   4.727
  265    HA   ASP  37           HA       ASP  37 -12.231   6.031   2.604
  266    HB2  ASP  37           1HB      ASP  37  -9.724   4.338   2.538
  267    HB3  ASP  37           2HB      ASP  37 -10.636   4.843   1.116
  268    H    SER  38           H        SER  38 -13.623   4.729   1.493
  269    HA   SER  38           HA       SER  38 -14.610   2.400   2.810
  270    HB2  SER  38           1HB      SER  38 -15.197   3.656   0.130
  271    HB3  SER  38           2HB      SER  38 -15.996   2.187   0.681
  272    HG   SER  38           HG       SER  38 -16.183   4.811   1.617
  273    H    ARG  39           H        ARG  39 -12.219   2.952   0.376
  274    HA   ARG  39           HA       ARG  39 -12.260   0.336  -0.789
  275    HB2  ARG  39           1HB      ARG  39 -10.191   2.540  -0.767
  276    HB3  ARG  39           2HB      ARG  39  -9.978   1.022  -1.641
  277    HG2  ARG  39           1HG      ARG  39 -11.978   1.448  -2.963
  278    HG3  ARG  39           2HG      ARG  39 -12.326   2.902  -2.027
  279    HD2  ARG  39           1HD      ARG  39  -9.777   2.508  -3.613
  280    HD3  ARG  39           2HD      ARG  39 -11.198   3.331  -4.249
  281    HE   ARG  39           HE       ARG  39 -10.514   4.500  -1.776
  282   HH11  ARG  39          1HH2      ARG  39  -9.341   4.135  -5.011
  283   HH12  ARG  39          2HH2      ARG  39  -8.480   5.637  -5.015
  284   HH21  ARG  39          1HH1      ARG  39  -9.387   6.474  -1.775
  285   HH22  ARG  39          2HH1      ARG  39  -8.506   6.961  -3.183
  286    H    PHE  40           H        PHE  40 -11.083   1.612   2.155
  287    HA   PHE  40           HA       PHE  40  -8.900  -0.222   2.527
  288    HB2  PHE  40           1HB      PHE  40  -9.144   2.034   3.657
  289    HB3  PHE  40           2HB      PHE  40 -10.389   1.302   4.670
  290    HD1  PHE  40           2HD      PHE  40  -6.800   1.234   3.763
  291    HD2  PHE  40           1HD      PHE  40  -9.833  -0.297   6.394
  292    HE1  PHE  40           2HE      PHE  40  -5.045   0.281   5.233
  293    HE2  PHE  40           1HE      PHE  40  -8.077  -1.248   7.864
  294    HZ   PHE  40           HZ       PHE  40  -5.682  -0.960   7.285
  295    H    LYS  41           H        LYS  41 -12.206   0.020   3.842
  296    HA   LYS  41           HA       LYS  41 -11.998  -2.430   5.315
  297    HB2  LYS  41           1HB      LYS  41 -14.393  -2.130   5.731
  298    HB3  LYS  41           2HB      LYS  41 -13.530  -0.611   5.981
  299    HG2  LYS  41           1HG      LYS  41 -14.145   0.094   3.678
  300    HG3  LYS  41           2HG      LYS  41 -15.067  -1.399   3.487
  301    HD2  LYS  41           1HD      LYS  41 -15.593   0.490   5.782
  302    HD3  LYS  41           2HD      LYS  41 -16.371   0.708   4.213
  303    HE2  LYS  41           1HE      LYS  41 -17.179  -1.670   4.362
  304    HE3  LYS  41           2HE      LYS  41 -16.546  -1.728   6.006
  305    HZ1  LYS  41           3HZ      LYS  41 -18.590   0.175   4.997
  306    HZ2  LYS  41           1HZ      LYS  41 -17.970   0.143   6.576
  307    HZ3  LYS  41           2HZ      LYS  41 -18.886  -1.166   5.998
  308    H    ALA  42           H        ALA  42 -12.229  -1.837   2.061
  309    HA   ALA  42           HA       ALA  42 -14.158  -3.734   1.214
  310    HB1  ALA  42           1HB      ALA  42 -13.272  -1.949  -0.249
  311    HB2  ALA  42           2HB      ALA  42 -13.089  -3.543  -0.979
  312    HB3  ALA  42           3HB      ALA  42 -11.698  -2.742  -0.248
  313    H    ILE  43           H        ILE  43 -10.713  -3.953   1.941
  314    HA   ILE  43           HA       ILE  43 -10.725  -6.817   1.281
  315    HB   ILE  43           HB       ILE  43  -8.414  -5.066   2.144
  316   HG12  ILE  43          1HG1      ILE  43  -9.333  -5.914  -0.622
  317   HG13  ILE  43          2HG1      ILE  43  -9.384  -4.273   0.026
  318   HG21  ILE  43          1HG2      ILE  43  -8.360  -7.697   0.659
  319   HG22  ILE  43          2HG2      ILE  43  -8.306  -7.617   2.420
  320   HG23  ILE  43          3HG2      ILE  43  -7.023  -6.874   1.464
  321   HD11  ILE  43          3HD1      ILE  43  -7.017  -5.903  -0.824
  322   HD12  ILE  43          1HD1      ILE  43  -6.808  -4.703   0.451
  323   HD13  ILE  43          2HD1      ILE  43  -7.377  -4.206  -1.143
  324    H    GLU  44           H        GLU  44 -11.181  -8.228   2.833
  325    HA   GLU  44           HA       GLU  44 -11.478  -7.496   5.561
  326    HB2  GLU  44           1HB      GLU  44 -11.327 -10.211   4.230
  327    HB3  GLU  44           2HB      GLU  44 -11.758  -9.956   5.921
  328    HG2  GLU  44           1HG      GLU  44 -13.667  -8.572   5.255
  329    HG3  GLU  44           2HG      GLU  44 -13.221  -8.746   3.557
  330    H    LYS  45           H        LYS  45  -8.953  -9.238   3.783
  331    HA   LYS  45           HA       LYS  45  -7.409  -9.739   6.182
  332    HB2  LYS  45           1HB      LYS  45  -6.803 -10.163   3.247
  333    HB3  LYS  45           2HB      LYS  45  -5.726 -10.638   4.561
  334    HG2  LYS  45           1HG      LYS  45  -7.473 -12.089   5.494
  335    HG3  LYS  45           2HG      LYS  45  -8.585 -11.592   4.218
  336    HD2  LYS  45           1HD      LYS  45  -7.022 -12.506   2.522
  337    HD3  LYS  45           2HD      LYS  45  -5.956 -13.049   3.818
  338    HE2  LYS  45           1HE      LYS  45  -8.832 -13.928   3.424
  339    HE3  LYS  45           2HE      LYS  45  -7.405 -14.890   3.041
  340    HZ1  LYS  45           3HZ      LYS  45  -6.793 -14.428   5.487
  341    HZ2  LYS  45           1HZ      LYS  45  -7.953 -15.616   5.140
  342    HZ3  LYS  45           2HZ      LYS  45  -8.446 -14.081   5.673
  343    H    MET  46           H        MET  46  -5.678  -8.616   6.915
  344    HA   MET  46           HA       MET  46  -5.034  -6.096   5.537
  345    HB2  MET  46           1HB      MET  46  -4.525  -7.044   8.365
  346    HB3  MET  46           2HB      MET  46  -3.923  -5.517   7.715
  347    HG2  MET  46           1HG      MET  46  -6.218  -4.793   7.232
  348    HG3  MET  46           2HG      MET  46  -6.843  -6.334   7.822
  349    HE1  MET  46           3HE      MET  46  -8.416  -5.423   9.601
  350    HE2  MET  46           1HE      MET  46  -8.059  -3.850   8.875
  351    HE3  MET  46           2HE      MET  46  -8.039  -4.040  10.626
  352    H    LYS  47           H        LYS  47  -3.847  -9.230   6.020
  353    HA   LYS  47           HA       LYS  47  -1.056  -8.754   6.126
  354    HB2  LYS  47           1HB      LYS  47  -2.633 -11.114   5.076
  355    HB3  LYS  47           2HB      LYS  47  -0.882 -11.105   5.286
  356    HG2  LYS  47           1HG      LYS  47  -1.159 -10.628   7.685
  357    HG3  LYS  47           2HG      LYS  47  -2.913 -10.615   7.485
  358    HD2  LYS  47           1HD      LYS  47  -2.869 -12.960   6.759
  359    HD3  LYS  47           2HD      LYS  47  -1.111 -12.984   6.905
  360    HE2  LYS  47           1HE      LYS  47  -2.140 -13.973   8.903
  361    HE3  LYS  47           2HE      LYS  47  -1.314 -12.471   9.320
  362    HZ1  LYS  47           3HZ      LYS  47  -4.066 -12.135   8.525
  363    HZ2  LYS  47           1HZ      LYS  47  -3.226 -11.470   9.842
  364    HZ3  LYS  47           2HZ      LYS  47  -3.865 -13.042   9.947
  365    H    ASP  48           H        ASP  48  -3.340  -9.105   3.451
  366    HA   ASP  48           HA       ASP  48  -1.411  -9.175   1.370
  367    HB2  ASP  48           1HB      ASP  48  -3.746  -9.897   1.056
  368    HB3  ASP  48           2HB      ASP  48  -4.287  -8.235   1.288
  369    H    ARG  49           H        ARG  49  -3.077  -6.558   3.042
  370    HA   ARG  49           HA       ARG  49  -2.281  -4.457   1.311
  371    HB2  ARG  49           1HB      ARG  49  -3.066  -4.494   4.229
  372    HB3  ARG  49           2HB      ARG  49  -2.737  -3.010   3.335
  373    HG2  ARG  49           1HG      ARG  49  -4.490  -3.612   1.698
  374    HG3  ARG  49           2HG      ARG  49  -4.831  -5.082   2.611
  375    HD2  ARG  49           1HD      ARG  49  -5.432  -3.730   4.579
  376    HD3  ARG  49           2HD      ARG  49  -5.073  -2.257   3.684
  377    HE   ARG  49           HE       ARG  49  -7.442  -3.902   3.424
  378   HH11  ARG  49          1HH2      ARG  49  -5.329  -1.591   1.954
  379   HH12  ARG  49          2HH2      ARG  49  -6.529  -0.980   0.865
  380   HH21  ARG  49          1HH1      ARG  49  -9.022  -3.106   1.999
  381   HH22  ARG  49          2HH1      ARG  49  -8.620  -1.838   0.890
  382    H    GLU  50           H        GLU  50  -0.822  -5.867   4.219
  383    HA   GLU  50           HA       GLU  50   1.337  -4.049   4.430
  384    HB2  GLU  50           1HB      GLU  50   0.609  -5.625   6.228
  385    HB3  GLU  50           2HB      GLU  50   1.282  -6.951   5.281
  386    HG2  GLU  50           1HG      GLU  50   3.501  -5.898   5.352
  387    HG3  GLU  50           2HG      GLU  50   2.840  -4.542   6.265
  388    H    ALA  51           H        ALA  51   0.950  -7.125   2.719
  389    HA   ALA  51           HA       ALA  51   3.612  -7.422   1.846
  390    HB1  ALA  51           1HB      ALA  51   1.060  -8.300   0.471
  391    HB2  ALA  51           2HB      ALA  51   1.933  -9.219   1.697
  392    HB3  ALA  51           3HB      ALA  51   2.679  -8.910   0.130
  393    H    LEU  52           H        LEU  52   0.809  -5.888   0.271
  394    HA   LEU  52           HA       LEU  52   2.156  -5.112  -2.088
  395    HB2  LEU  52           1HB      LEU  52  -0.283  -3.985  -0.700
  396    HB3  LEU  52           2HB      LEU  52   0.279  -3.434  -2.279
  397    HG   LEU  52           HG       LEU  52  -0.171  -6.365  -1.757
  398   HD11  LEU  52          1HD1      LEU  52  -2.227  -4.274  -2.521
  399   HD12  LEU  52          2HD1      LEU  52  -2.280  -5.372  -1.142
  400   HD13  LEU  52          3HD1      LEU  52  -2.458  -6.003  -2.779
  401   HD21  LEU  52          3HD2      LEU  52  -0.534  -6.360  -4.204
  402   HD22  LEU  52          1HD2      LEU  52   1.034  -5.665  -3.798
  403   HD23  LEU  52          2HD2      LEU  52  -0.312  -4.611  -4.231
  404    H    PHE  53           H        PHE  53   1.648  -3.464   1.008
  405    HA   PHE  53           HA       PHE  53   2.726  -0.964   0.309
  406    HB2  PHE  53           1HB      PHE  53   1.461  -1.488   2.414
  407    HB3  PHE  53           2HB      PHE  53   2.904  -2.301   3.017
  408    HD1  PHE  53           2HD      PHE  53   1.447   0.949   2.039
  409    HD2  PHE  53           1HD      PHE  53   4.883  -1.053   3.662
  410    HE1  PHE  53           2HE      PHE  53   2.378   3.132   2.761
  411    HE2  PHE  53           1HE      PHE  53   5.814   1.131   4.383
  412    HZ   PHE  53           HZ       PHE  53   4.561   3.222   3.932
  413    H    ASN  54           H        ASN  54   4.280  -3.843   1.707
  414    HA   ASN  54           HA       ASN  54   6.869  -2.756   1.945
  415    HB2  ASN  54           1HB      ASN  54   5.944  -5.609   1.556
  416    HB3  ASN  54           2HB      ASN  54   7.605  -5.156   1.930
  417   HD21  ASN  54          1HD2      ASN  54   5.950  -6.754   3.705
  418   HD22  ASN  54          2HD2      ASN  54   5.707  -5.850   5.120
  419    H    GLU  55           H        GLU  55   5.267  -4.474  -0.709
  420    HA   GLU  55           HA       GLU  55   7.579  -4.590  -2.384
  421    HB2  GLU  55           1HB      GLU  55   4.624  -4.870  -2.954
  422    HB3  GLU  55           2HB      GLU  55   5.872  -5.081  -4.184
  423    HG2  GLU  55           1HG      GLU  55   6.890  -6.886  -2.900
  424    HG3  GLU  55           2HG      GLU  55   5.748  -6.632  -1.583
  425    H    PHE  56           H        PHE  56   4.917  -2.313  -1.989
  426    HA   PHE  56           HA       PHE  56   5.366  -0.782  -4.319
  427    HB2  PHE  56           1HB      PHE  56   3.300  -0.621  -2.995
  428    HB3  PHE  56           2HB      PHE  56   4.209   0.086  -1.660
  429    HD1  PHE  56           2HD      PHE  56   3.273   0.593  -5.233
  430    HD2  PHE  56           1HD      PHE  56   4.728   2.399  -1.619
  431    HE1  PHE  56           2HE      PHE  56   3.045   2.837  -6.264
  432    HE2  PHE  56           1HE      PHE  56   4.501   4.644  -2.648
  433    HZ   PHE  56           HZ       PHE  56   3.659   4.861  -4.971
  434    H    VAL  57           H        VAL  57   6.498  -0.337  -0.971
  435    HA   VAL  57           HA       VAL  57   7.987   2.016  -1.465
  436    HB   VAL  57           HB       VAL  57   8.260  -0.109   0.669
  437   HG11  VAL  57          1HG1      VAL  57   9.668   2.533   0.260
  438   HG12  VAL  57          2HG1      VAL  57  10.382   0.956   0.598
  439   HG13  VAL  57          3HG1      VAL  57   9.495   1.811   1.860
  440   HG21  VAL  57          3HG2      VAL  57   6.137   1.218   0.597
  441   HG22  VAL  57          1HG2      VAL  57   7.094   2.693   0.736
  442   HG23  VAL  57          2HG2      VAL  57   7.084   1.521   2.054
  443    H    ALA  58           H        ALA  58   8.898  -1.416  -1.440
  444    HA   ALA  58           HA       ALA  58  11.663  -1.007  -1.915
  445    HB1  ALA  58           1HB      ALA  58  10.754  -3.129  -1.057
  446    HB2  ALA  58           2HB      ALA  58  11.699  -3.385  -2.524
  447    HB3  ALA  58           3HB      ALA  58   9.938  -3.400  -2.596
  448    H    ALA  59           H        ALA  59   8.882  -1.428  -4.052
  449    HA   ALA  59           HA       ALA  59  10.448  -1.607  -6.452
  450    HB1  ALA  59           1HB      ALA  59   8.220  -2.596  -6.358
  451    HB2  ALA  59           2HB      ALA  59   8.260  -1.338  -7.594
  452    HB3  ALA  59           3HB      ALA  59   7.507  -1.016  -6.033
  453    H    ALA  60           H        ALA  60   8.722   0.967  -4.751
  454    HA   ALA  60           HA       ALA  60   8.973   2.929  -6.787
  455    HB1  ALA  60           1HB      ALA  60   8.636   3.257  -3.795
  456    HB2  ALA  60           2HB      ALA  60   7.336   3.151  -4.983
  457    HB3  ALA  60           3HB      ALA  60   8.425   4.538  -4.991
  458    H    ARG  61           H        ARG  61  10.959   2.087  -3.978
  459    HA   ARG  61           HA       ARG  61  12.786   4.264  -4.284
  460    HB2  ARG  61           1HB      ARG  61  12.456   3.051  -2.145
  461    HB3  ARG  61           2HB      ARG  61  13.193   1.620  -2.867
  462    HG2  ARG  61           1HG      ARG  61  15.275   2.855  -3.253
  463    HG3  ARG  61           2HG      ARG  61  14.545   4.321  -2.598
  464    HD2  ARG  61           1HD      ARG  61  14.234   3.201  -0.424
  465    HD3  ARG  61           2HD      ARG  61  14.949   1.731  -1.075
  466    HE   ARG  61           HE       ARG  61  16.778   3.829  -1.464
  467   HH11  ARG  61          1HH2      ARG  61  15.253   2.045   1.079
  468   HH12  ARG  61          2HH2      ARG  61  16.574   2.225   2.185
  469   HH21  ARG  61          1HH1      ARG  61  18.513   4.070  -0.019
  470   HH22  ARG  61          2HH1      ARG  61  18.420   3.372   1.564
  Start of MODEL   15
    1    H    ILE   5           H        ILE   5 -13.160 -10.026 -12.564
    2    HA   ILE   5           HA       ILE   5 -11.289  -9.667 -13.883
    3    HB   ILE   5           HB       ILE   5 -12.254  -6.735 -14.164
    4   HG12  ILE   5          1HG1      ILE   5 -13.124  -9.072 -16.011
    5   HG13  ILE   5          2HG1      ILE   5 -14.128  -8.509 -14.702
    6   HG21  ILE   5          1HG2      ILE   5 -10.645  -8.450 -16.181
    7   HG22  ILE   5          2HG2      ILE   5  -9.921  -7.231 -15.144
    8   HG23  ILE   5          3HG2      ILE   5 -11.062  -6.744 -16.376
    9   HD11  ILE   5          3HD1      ILE   5 -14.838  -7.489 -16.836
   10   HD12  ILE   5          1HD1      ILE   5 -13.248  -6.754 -17.026
   11   HD13  ILE   5          2HD1      ILE   5 -14.295  -6.260 -15.692
   12    H    MET   6           H        MET   6 -10.963  -9.497 -11.056
   13    HA   MET   6           HA       MET   6  -9.739  -8.496  -9.270
   14    HB2  MET   6           1HB      MET   6  -7.790  -8.531 -11.664
   15    HB3  MET   6           2HB      MET   6  -7.263  -8.364  -9.973
   16    HG2  MET   6           1HG      MET   6  -8.287 -10.619  -9.433
   17    HG3  MET   6           2HG      MET   6  -8.791 -10.782 -11.127
   18    HE1  MET   6           3HE      MET   6  -7.245 -13.025  -9.827
   19    HE2  MET   6           1HE      MET   6  -5.933 -13.375 -10.961
   20    HE3  MET   6           2HE      MET   6  -7.547 -13.020 -11.566
   21    H    GLN   7           H        GLN   7 -11.381  -6.526 -10.581
   22    HA   GLN   7           HA       GLN   7 -10.092  -4.142 -11.365
   23    HB2  GLN   7           1HB      GLN   7 -12.318  -3.062 -10.920
   24    HB3  GLN   7           2HB      GLN   7 -12.516  -4.597 -11.765
   25    HG2  GLN   7           1HG      GLN   7 -13.036  -5.718  -9.509
   26    HG3  GLN   7           2HG      GLN   7 -12.943  -4.139  -8.732
   27   HE21  GLN   7          1HE2      GLN   7 -15.042  -3.428  -8.314
   28   HE22  GLN   7          2HE2      GLN   7 -16.358  -3.587  -9.377
   29    H    ALA   8           H        ALA   8 -10.977  -5.428  -8.194
   30    HA   ALA   8           HA       ALA   8 -10.618  -3.176  -6.515
   31    HB1  ALA   8           1HB      ALA   8 -11.640  -5.393  -5.765
   32    HB2  ALA   8           2HB      ALA   8 -10.373  -4.846  -4.655
   33    HB3  ALA   8           3HB      ALA   8 -10.039  -6.132  -5.822
   34    H    LYS   9           H        LYS   9  -8.300  -5.732  -7.485
   35    HA   LYS   9           HA       LYS   9  -6.102  -4.651  -6.049
   36    HB2  LYS   9           1HB      LYS   9  -6.231  -7.067  -6.905
   37    HB3  LYS   9           2HB      LYS   9  -6.066  -6.480  -8.562
   38    HG2  LYS   9           1HG      LYS   9  -3.772  -5.520  -8.013
   39    HG3  LYS   9           2HG      LYS   9  -3.944  -6.051  -6.337
   40    HD2  LYS   9           1HD      LYS   9  -4.010  -8.461  -7.135
   41    HD3  LYS   9           2HD      LYS   9  -3.821  -7.903  -8.803
   42    HE2  LYS   9           1HE      LYS   9  -1.563  -6.914  -8.232
   43    HE3  LYS   9           2HE      LYS   9  -1.750  -7.435  -6.547
   44    HZ1  LYS   9           3HZ      LYS   9  -2.279  -9.585  -8.244
   45    HZ2  LYS   9           1HZ      LYS   9  -1.044  -9.415  -7.101
   46    HZ3  LYS   9           2HZ      LYS   9  -0.800  -8.894  -8.703
   47    H    GLU  10           H        GLU  10  -7.152  -4.224  -9.445
   48    HA   GLU  10           HA       GLU  10  -4.914  -2.677 -10.344
   49    HB2  GLU  10           1HB      GLU  10  -7.828  -2.880 -11.348
   50    HB3  GLU  10           2HB      GLU  10  -6.575  -1.986 -12.227
   51    HG2  GLU  10           1HG      GLU  10  -5.234  -4.099 -12.507
   52    HG3  GLU  10           2HG      GLU  10  -6.410  -5.005 -11.573
   53    H    ASP  11           H        ASP  11  -8.075  -1.845  -9.012
   54    HA   ASP  11           HA       ASP  11  -7.905   1.011  -9.174
   55    HB2  ASP  11           1HB      ASP  11  -9.603  -0.819  -7.350
   56    HB3  ASP  11           2HB      ASP  11  -9.767   0.937  -7.367
   57    H    PHE  12           H        PHE  12  -6.938  -1.353  -6.732
   58    HA   PHE  12           HA       PHE  12  -6.236   0.510  -4.666
   59    HB2  PHE  12           1HB      PHE  12  -6.586  -2.027  -4.289
   60    HB3  PHE  12           2HB      PHE  12  -5.098  -2.323  -5.149
   61    HD1  PHE  12           1HD      PHE  12  -6.507  -0.302  -2.271
   62    HD2  PHE  12           2HD      PHE  12  -2.953  -2.279  -3.839
   63    HE1  PHE  12           1HE      PHE  12  -5.257   0.272  -0.223
   64    HE2  PHE  12           2HE      PHE  12  -1.761  -1.721  -1.719
   65    HZ   PHE  12           HZ       PHE  12  -2.895  -0.436   0.079
   66    H    LYS  13           H        LYS  13  -4.308  -1.173  -7.129
   67    HA   LYS  13           HA       LYS  13  -1.816  -0.047  -6.485
   68    HB2  LYS  13           1HB      LYS  13  -2.356  -2.061  -8.070
   69    HB3  LYS  13           2HB      LYS  13  -2.649  -0.865  -9.327
   70    HG2  LYS  13           1HG      LYS  13  -0.292   0.037  -8.997
   71    HG3  LYS  13           2HG      LYS  13  -0.028  -1.134  -7.714
   72    HD2  LYS  13           1HD      LYS  13   1.066  -2.049  -9.686
   73    HD3  LYS  13           2HD      LYS  13  -0.375  -3.030  -9.428
   74    HE2  LYS  13           1HE      LYS  13  -1.571  -1.812 -11.259
   75    HE3  LYS  13           2HE      LYS  13  -0.207  -0.703 -11.453
   76    HZ1  LYS  13           3HZ      LYS  13   0.888  -3.203 -11.569
   77    HZ2  LYS  13           1HZ      LYS  13   0.597  -2.168 -12.878
   78    HZ3  LYS  13           2HZ      LYS  13  -0.553  -3.347 -12.452
   79    H    LYS  14           H        LYS  14  -4.328   0.893  -8.723
   80    HA   LYS  14           HA       LYS  14  -3.084   3.048 -10.005
   81    HB2  LYS  14           1HB      LYS  14  -5.289   2.039 -10.760
   82    HB3  LYS  14           2HB      LYS  14  -6.095   2.760  -9.371
   83    HG2  LYS  14           1HG      LYS  14  -5.487   5.079 -10.203
   84    HG3  LYS  14           2HG      LYS  14  -4.626   4.362 -11.569
   85    HD2  LYS  14           1HD      LYS  14  -6.817   3.404 -12.437
   86    HD3  LYS  14           2HD      LYS  14  -7.676   4.124 -11.062
   87    HE2  LYS  14           1HE      LYS  14  -7.878   5.596 -13.131
   88    HE3  LYS  14           2HE      LYS  14  -6.982   6.445 -11.859
   89    HZ1  LYS  14           3HZ      LYS  14  -5.097   6.379 -13.035
   90    HZ2  LYS  14           1HZ      LYS  14  -6.095   6.079 -14.377
   91    HZ3  LYS  14           2HZ      LYS  14  -5.351   4.787 -13.565
   92    H    MET  15           H        MET  15  -4.931   2.841  -6.978
   93    HA   MET  15           HA       MET  15  -4.916   5.654  -6.432
   94    HB2  MET  15           1HB      MET  15  -6.491   3.875  -5.352
   95    HB3  MET  15           2HB      MET  15  -5.125   3.350  -4.380
   96    HG2  MET  15           1HG      MET  15  -6.433   4.934  -3.000
   97    HG3  MET  15           2HG      MET  15  -4.949   5.773  -3.440
   98    HE1  MET  15           3HE      MET  15  -6.122   8.090  -2.858
   99    HE2  MET  15           1HE      MET  15  -7.632   7.249  -2.449
  100    HE3  MET  15           2HE      MET  15  -7.649   8.630  -3.546
  101    H    MET  16           H        MET  16  -2.777   2.954  -5.421
  102    HA   MET  16           HA       MET  16  -1.107   4.336  -3.591
  103    HB2  MET  16           1HB      MET  16  -0.457   1.932  -5.411
  104    HB3  MET  16           2HB      MET  16   0.526   2.411  -4.036
  105    HG2  MET  16           1HG      MET  16  -2.271   2.036  -3.095
  106    HG3  MET  16           2HG      MET  16  -1.795   0.634  -4.024
  107    HE1  MET  16           3HE      MET  16  -0.025   3.142  -1.578
  108    HE2  MET  16           1HE      MET  16   0.244   2.131  -0.172
  109    HE3  MET  16           2HE      MET  16  -1.381   2.510  -0.683
  110    H    GLU  17           H        GLU  17  -0.621   3.866  -7.094
  111    HA   GLU  17           HA       GLU  17   1.954   5.134  -7.189
  112    HB2  GLU  17           1HB      GLU  17   1.763   4.886  -9.630
  113    HB3  GLU  17           2HB      GLU  17   1.094   3.427  -8.878
  114    HG2  GLU  17           1HG      GLU  17  -1.216   4.508  -9.140
  115    HG3  GLU  17           2HG      GLU  17  -0.479   5.771 -10.092
  116    H    GLU  18           H        GLU  18  -1.396   6.227  -7.655
  117    HA   GLU  18           HA       GLU  18  -0.742   8.965  -8.444
  118    HB2  GLU  18           1HB      GLU  18  -3.415   7.618  -7.653
  119    HB3  GLU  18           2HB      GLU  18  -3.309   9.321  -8.154
  120    HG2  GLU  18           1HG      GLU  18  -2.431   8.606 -10.405
  121    HG3  GLU  18           2HG      GLU  18  -2.499   6.940  -9.921
  122    H    ALA  19           H        ALA  19  -1.154   7.274  -5.426
  123    HA   ALA  19           HA       ALA  19  -1.798   9.676  -3.853
  124    HB1  ALA  19           1HB      ALA  19  -1.351   6.759  -3.012
  125    HB2  ALA  19           2HB      ALA  19  -2.905   7.579  -3.173
  126    HB3  ALA  19           3HB      ALA  19  -1.794   8.051  -1.891
  127    H    LYS  20           H        LYS  20   0.887   8.741  -5.397
  128    HA   LYS  20           HA       LYS  20   3.033   8.097  -4.175
  129    HB2  LYS  20           1HB      LYS  20   2.957   9.547  -6.346
  130    HB3  LYS  20           2HB      LYS  20   3.057  10.968  -5.314
  131    HG2  LYS  20           1HG      LYS  20   5.380  10.634  -5.878
  132    HG3  LYS  20           2HG      LYS  20   5.286   9.846  -4.314
  133    HD2  LYS  20           1HD      LYS  20   5.013   7.576  -5.503
  134    HD3  LYS  20           2HD      LYS  20   5.186   8.390  -7.052
  135    HE2  LYS  20           1HE      LYS  20   7.390   7.401  -6.399
  136    HE3  LYS  20           2HE      LYS  20   7.530   9.169  -6.305
  137    HZ1  LYS  20           3HZ      LYS  20   6.593   7.736  -3.941
  138    HZ2  LYS  20           1HZ      LYS  20   7.525   9.142  -4.054
  139    HZ3  LYS  20           2HZ      LYS  20   8.244   7.624  -4.325
  140    H    PHE  21           H        PHE  21   3.771   8.222  -2.116
  141    HA   PHE  21           HA       PHE  21   3.510  10.740  -0.568
  142    HB2  PHE  21           1HB      PHE  21   2.719   9.419   1.394
  143    HB3  PHE  21           2HB      PHE  21   1.618   9.231   0.031
  144    HD1  PHE  21           1HD      PHE  21   1.707   7.071  -1.438
  145    HD2  PHE  21           2HD      PHE  21   3.979   7.407   2.231
  146    HE1  PHE  21           1HE      PHE  21   2.096   4.600  -1.442
  147    HE2  PHE  21           2HE      PHE  21   4.371   4.941   2.205
  148    HZ   PHE  21           HZ       PHE  21   3.423   3.534   0.384
  149    H    ASN  22           H        ASN  22   4.804  10.436   1.557
  150    HA   ASN  22           HA       ASN  22   7.483  10.277   1.017
  151    HB2  ASN  22           1HB      ASN  22   6.052   9.851   3.664
  152    HB3  ASN  22           2HB      ASN  22   7.800  10.075   3.559
  153   HD21  ASN  22          1HD2      ASN  22   4.773  11.623   2.377
  154   HD22  ASN  22          2HD2      ASN  22   5.322  13.217   2.574
  155    HA   PRO  23           HA       PRO  23   7.877   5.673   0.451
  156    HB2  PRO  23           1HB      PRO  23  10.593   5.510  -0.051
  157    HB3  PRO  23           2HB      PRO  23   9.433   6.140  -1.257
  158    HG2  PRO  23           1HG      PRO  23  11.236   7.697   0.622
  159    HG3  PRO  23           2HG      PRO  23  10.922   7.971  -1.112
  160    HD2  PRO  23           1HD      PRO  23   9.657   9.443   0.846
  161    HD3  PRO  23           2HD      PRO  23   8.836   9.042  -0.705
  162    H    ARG  24           H        ARG  24   9.423   7.562   2.917
  163    HA   ARG  24           HA       ARG  24  10.476   5.243   4.415
  164    HB2  ARG  24           1HB      ARG  24  10.506   8.281   4.971
  165    HB3  ARG  24           2HB      ARG  24  11.296   7.087   6.028
  166    HG2  ARG  24           1HG      ARG  24  12.805   6.384   4.111
  167    HG3  ARG  24           2HG      ARG  24  12.009   7.545   3.049
  168    HD2  ARG  24           1HD      ARG  24  12.767   9.436   4.508
  169    HD3  ARG  24           2HD      ARG  24  13.569   8.271   5.594
  170    HE   ARG  24           HE       ARG  24  14.557   7.822   2.983
  171   HH11  ARG  24          1HH2      ARG  24  14.520  10.304   5.402
  172   HH12  ARG  24          2HH2      ARG  24  16.047  10.976   4.941
  173   HH21  ARG  24          1HH1      ARG  24  16.546   8.684   2.371
  174   HH22  ARG  24          2HH1      ARG  24  17.201  10.049   3.211
  175    H    ALA  25           H        ALA  25   7.498   6.645   4.112
  176    HA   ALA  25           HA       ALA  25   6.631   6.574   6.891
  177    HB1  ALA  25           1HB      ALA  25   5.006   6.558   4.281
  178    HB2  ALA  25           2HB      ALA  25   5.446   7.990   5.187
  179    HB3  ALA  25           3HB      ALA  25   4.329   6.825   5.893
  180    H    THR  26           H        THR  26   5.132   5.017   7.666
  181    HA   THR  26           HA       THR  26   5.720   2.257   6.792
  182    HB   THR  26           HB       THR  26   5.025   1.607   9.100
  183    HG1  THR  26           1HG      THR  26   3.446   3.321   9.254
  184   HG21  THR  26          3HG2      THR  26   6.898   4.049   9.255
  185   HG22  THR  26          1HG2      THR  26   7.429   2.432   8.771
  186   HG23  THR  26          2HG2      THR  26   6.827   2.723  10.411
  187    H    PHE  27           H        PHE  27   3.866   0.768   7.095
  188    HA   PHE  27           HA       PHE  27   1.604   1.473   5.553
  189    HB2  PHE  27           1HB      PHE  27   2.385  -0.887   5.697
  190    HB3  PHE  27           2HB      PHE  27   2.116  -0.912   7.432
  191    HD1  PHE  27           2HD      PHE  27   0.218  -0.132   4.208
  192    HD2  PHE  27           1HD      PHE  27  -0.084  -1.785   8.225
  193    HE1  PHE  27           2HE      PHE  27  -2.165  -0.651   3.811
  194    HE2  PHE  27           1HE      PHE  27  -2.498  -2.299   7.800
  195    HZ   PHE  27           HZ       PHE  27  -3.528  -1.743   5.594
  196    H    SER  28           H        SER  28   2.053   1.146   9.090
  197    HA   SER  28           HA       SER  28  -0.640   1.486   9.957
  198    HB2  SER  28           1HB      SER  28   1.255   0.787  11.469
  199    HB3  SER  28           2HB      SER  28   1.955   2.396  11.337
  200    HG   SER  28           HG       SER  28  -0.444   2.910  12.000
  201    H    GLU  29           H        GLU  29   1.865   3.945   9.260
  202    HA   GLU  29           HA       GLU  29   0.249   6.229  10.002
  203    HB2  GLU  29           1HB      GLU  29   2.815   5.943   8.285
  204    HB3  GLU  29           2HB      GLU  29   2.129   7.523   8.713
  205    HG2  GLU  29           1HG      GLU  29   3.094   5.418  10.770
  206    HG3  GLU  29           2HG      GLU  29   4.027   6.831  10.278
  207    H    PHE  30           H        PHE  30   1.026   4.661   6.903
  208    HA   PHE  30           HA       PHE  30  -0.433   6.476   5.221
  209    HB2  PHE  30           1HB      PHE  30   1.372   4.859   4.461
  210    HB3  PHE  30           2HB      PHE  30   0.267   3.521   4.748
  211    HD1  PHE  30           2HD      PHE  30   0.836   6.610   2.653
  212    HD2  PHE  30           1HD      PHE  30  -1.727   3.118   3.209
  213    HE1  PHE  30           2HE      PHE  30  -0.324   7.094   0.496
  214    HE2  PHE  30           1HE      PHE  30  -2.884   3.644   1.057
  215    HZ   PHE  30           HZ       PHE  30  -2.176   5.620  -0.303
  216    H    ALA  31           H        ALA  31  -1.303   3.350   6.751
  217    HA   ALA  31           HA       ALA  31  -3.931   3.068   5.653
  218    HB1  ALA  31           1HB      ALA  31  -2.639   1.162   6.690
  219    HB2  ALA  31           2HB      ALA  31  -4.204   1.341   7.480
  220    HB3  ALA  31           3HB      ALA  31  -2.739   1.931   8.269
  221    H    ALA  32           H        ALA  32  -2.684   4.605   8.634
  222    HA   ALA  32           HA       ALA  32  -5.157   5.206   9.961
  223    HB1  ALA  32           1HB      ALA  32  -2.504   6.775   9.981
  224    HB2  ALA  32           2HB      ALA  32  -2.904   5.457  11.069
  225    HB3  ALA  32           3HB      ALA  32  -3.807   6.973  11.165
  226    H    LYS  33           H        LYS  33  -3.403   6.961   7.412
  227    HA   LYS  33           HA       LYS  33  -5.176   9.265   7.364
  228    HB2  LYS  33           1HB      LYS  33  -3.108   8.162   5.350
  229    HB3  LYS  33           2HB      LYS  33  -3.928   9.708   5.162
  230    HG2  LYS  33           1HG      LYS  33  -2.904  10.524   7.343
  231    HG3  LYS  33           2HG      LYS  33  -2.119   8.973   7.539
  232    HD2  LYS  33           1HD      LYS  33  -0.400  10.426   6.637
  233    HD3  LYS  33           2HD      LYS  33  -0.866   9.382   5.300
  234    HE2  LYS  33           1HE      LYS  33  -2.312  11.221   4.358
  235    HE3  LYS  33           2HE      LYS  33  -1.905  12.257   5.729
  236    HZ1  LYS  33           3HZ      LYS  33   0.435  12.018   5.087
  237    HZ2  LYS  33           1HZ      LYS  33  -0.502  12.761   3.887
  238    HZ3  LYS  33           2HZ      LYS  33  -0.038  11.134   3.719
  239    H    HIS  34           H        HIS  34  -4.942   6.244   5.436
  240    HA   HIS  34           HA       HIS  34  -7.311   7.014   3.838
  241    HB2  HIS  34           1HB      HIS  34  -5.298   4.693   3.592
  242    HB3  HIS  34           2HB      HIS  34  -6.683   4.891   2.503
  243    HD2  HIS  34           2HD      HIS  34  -6.362   6.945   0.571
  244    HE1  HIS  34           1HE      HIS  34  -2.579   8.288   1.860
  245    HE2  HIS  34           2HE      HIS  34  -4.331   8.489   0.037
  246    H    ALA  35           H        ALA  35  -6.796   5.638   6.815
  247    HA   ALA  35           HA       ALA  35  -8.134   3.197   6.965
  248    HB1  ALA  35           1HB      ALA  35  -8.833   4.014   9.389
  249    HB2  ALA  35           2HB      ALA  35  -7.967   5.493   8.986
  250    HB3  ALA  35           3HB      ALA  35  -7.117   3.954   9.034
  251    H    LYS  36           H        LYS  36  -9.571   6.456   6.879
  252    HA   LYS  36           HA       LYS  36 -12.273   5.583   7.285
  253    HB2  LYS  36           1HB      LYS  36 -12.804   8.034   6.817
  254    HB3  LYS  36           2HB      LYS  36 -11.387   7.936   7.873
  255    HG2  LYS  36           1HG      LYS  36  -9.858   8.221   5.833
  256    HG3  LYS  36           2HG      LYS  36 -11.274   8.361   4.792
  257    HD2  LYS  36           1HD      LYS  36 -11.980  10.455   6.099
  258    HD3  LYS  36           2HD      LYS  36 -10.473  10.344   7.011
  259    HE2  LYS  36           1HE      LYS  36 -10.643  10.749   3.940
  260    HE3  LYS  36           2HE      LYS  36 -10.198  12.001   5.115
  261    HZ1  LYS  36           3HZ      LYS  36  -8.707   9.599   4.292
  262    HZ2  LYS  36           1HZ      LYS  36  -8.445  10.265   5.825
  263    HZ3  LYS  36           2HZ      LYS  36  -8.165  11.206   4.438
  264    H    ASP  37           H        ASP  37 -10.142   5.500   4.588
  265    HA   ASP  37           HA       ASP  37 -11.939   6.030   2.429
  266    HB2  ASP  37           1HB      ASP  37  -9.322   5.815   2.275
  267    HB3  ASP  37           2HB      ASP  37  -9.555   4.067   2.248
  268    H    SER  38           H        SER  38 -13.315   4.622   1.304
  269    HA   SER  38           HA       SER  38 -14.569   2.472   2.724
  270    HB2  SER  38           1HB      SER  38 -14.771   3.477  -0.150
  271    HB3  SER  38           2HB      SER  38 -15.774   2.146   0.444
  272    HG   SER  38           HG       SER  38 -15.618   4.417   2.040
  273    H    ARG  39           H        ARG  39 -11.944   2.612   0.433
  274    HA   ARG  39           HA       ARG  39 -11.891  -0.143  -0.460
  275    HB2  ARG  39           1HB      ARG  39  -9.696   2.020  -0.464
  276    HB3  ARG  39           2HB      ARG  39  -9.565   0.450  -1.283
  277    HG2  ARG  39           1HG      ARG  39 -11.591   1.071  -2.712
  278    HG3  ARG  39           2HG      ARG  39 -11.663   2.647  -1.915
  279    HD2  ARG  39           1HD      ARG  39 -10.439   2.883  -4.097
  280    HD3  ARG  39           2HD      ARG  39  -9.307   3.156  -2.767
  281    HE   ARG  39           HE       ARG  39  -8.186   1.217  -3.363
  282   HH11  ARG  39          1HH2      ARG  39 -11.406   1.055  -4.755
  283   HH12  ARG  39          2HH2      ARG  39 -11.076  -0.394  -5.644
  284   HH21  ARG  39          1HH1      ARG  39  -7.860  -0.696  -4.471
  285   HH22  ARG  39          2HH1      ARG  39  -9.082  -1.375  -5.481
  286    H    PHE  40           H        PHE  40 -10.755   1.507   2.378
  287    HA   PHE  40           HA       PHE  40  -8.681  -0.348   3.076
  288    HB2  PHE  40           1HB      PHE  40  -8.763   1.949   4.073
  289    HB3  PHE  40           2HB      PHE  40 -10.316   1.607   4.813
  290    HD1  PHE  40           2HD      PHE  40  -6.714   0.493   4.774
  291    HD2  PHE  40           1HD      PHE  40 -10.447   0.442   7.026
  292    HE1  PHE  40           2HE      PHE  40  -5.574  -0.610   6.682
  293    HE2  PHE  40           1HE      PHE  40  -9.266  -0.665   8.930
  294    HZ   PHE  40           HZ       PHE  40  -6.828  -1.188   8.755
  295    H    LYS  41           H        LYS  41 -12.036   0.019   4.263
  296    HA   LYS  41           HA       LYS  41 -12.098  -2.372   5.877
  297    HB2  LYS  41           1HB      LYS  41 -14.551  -1.796   6.171
  298    HB3  LYS  41           2HB      LYS  41 -13.532  -0.371   6.397
  299    HG2  LYS  41           1HG      LYS  41 -14.040   0.378   4.038
  300    HG3  LYS  41           2HG      LYS  41 -15.006  -1.053   3.747
  301    HD2  LYS  41           1HD      LYS  41 -16.599   0.736   4.195
  302    HD3  LYS  41           2HD      LYS  41 -16.604  -0.285   5.633
  303    HE2  LYS  41           1HE      LYS  41 -15.159   1.357   6.841
  304    HE3  LYS  41           2HE      LYS  41 -15.001   2.340   5.383
  305    HZ1  LYS  41           3HZ      LYS  41 -16.712   3.305   6.613
  306    HZ2  LYS  41           1HZ      LYS  41 -17.422   1.813   6.992
  307    HZ3  LYS  41           2HZ      LYS  41 -17.509   2.410   5.406
  308    H    ALA  42           H        ALA  42 -12.491  -1.797   2.504
  309    HA   ALA  42           HA       ALA  42 -14.380  -3.853   1.777
  310    HB1  ALA  42           1HB      ALA  42 -13.423  -3.525  -0.534
  311    HB2  ALA  42           2HB      ALA  42 -12.038  -2.651   0.143
  312    HB3  ALA  42           3HB      ALA  42 -13.641  -1.939   0.216
  313    H    ILE  43           H        ILE  43 -10.902  -3.810   2.408
  314    HA   ILE  43           HA       ILE  43 -10.638  -6.675   1.678
  315    HB   ILE  43           HB       ILE  43  -8.439  -4.873   2.837
  316   HG12  ILE  43          1HG1      ILE  43  -9.261  -3.652   0.844
  317   HG13  ILE  43          2HG1      ILE  43  -7.738  -4.370   0.420
  318   HG21  ILE  43          1HG2      ILE  43  -6.884  -6.512   1.687
  319   HG22  ILE  43          2HG2      ILE  43  -8.267  -7.413   1.082
  320   HG23  ILE  43          3HG2      ILE  43  -7.954  -7.351   2.810
  321   HD11  ILE  43          3HD1      ILE  43  -9.247  -6.314  -0.602
  322   HD12  ILE  43          1HD1      ILE  43  -9.088  -4.786  -1.474
  323   HD13  ILE  43          2HD1      ILE  43 -10.526  -5.104  -0.499
  324    H    GLU  44           H        GLU  44 -11.074  -8.107   3.141
  325    HA   GLU  44           HA       GLU  44 -11.640  -7.539   5.896
  326    HB2  GLU  44           1HB      GLU  44 -12.742  -9.410   4.519
  327    HB3  GLU  44           2HB      GLU  44 -11.201 -10.270   4.490
  328    HG2  GLU  44           1HG      GLU  44 -11.247 -10.489   7.008
  329    HG3  GLU  44           2HG      GLU  44 -12.739  -9.556   7.085
  330    H    LYS  45           H        LYS  45  -8.897  -9.099   4.158
  331    HA   LYS  45           HA       LYS  45  -7.302  -9.430   6.649
  332    HB2  LYS  45           1HB      LYS  45  -6.857 -10.421   3.756
  333    HB3  LYS  45           2HB      LYS  45  -5.753 -10.765   5.107
  334    HG2  LYS  45           1HG      LYS  45  -7.652 -11.949   6.332
  335    HG3  LYS  45           2HG      LYS  45  -8.732 -11.622   4.969
  336    HD2  LYS  45           1HD      LYS  45  -7.240 -13.004   3.457
  337    HD3  LYS  45           2HD      LYS  45  -6.152 -13.322   4.812
  338    HE2  LYS  45           1HE      LYS  45  -8.009 -14.540   6.022
  339    HE3  LYS  45           2HE      LYS  45  -9.103 -14.221   4.663
  340    HZ1  LYS  45           3HZ      LYS  45  -6.509 -15.629   4.416
  341    HZ2  LYS  45           1HZ      LYS  45  -7.699 -15.460   3.224
  342    HZ3  LYS  45           2HZ      LYS  45  -8.004 -16.418   4.593
  343    H    MET  46           H        MET  46  -6.259  -7.668   7.206
  344    HA   MET  46           HA       MET  46  -5.314  -5.635   5.421
  345    HB2  MET  46           1HB      MET  46  -4.781  -6.179   8.403
  346    HB3  MET  46           2HB      MET  46  -4.254  -4.714   7.563
  347    HG2  MET  46           1HG      MET  46  -6.340  -4.066   8.623
  348    HG3  MET  46           2HG      MET  46  -6.803  -4.348   6.949
  349    HE1  MET  46           3HE      MET  46  -9.351  -4.559   7.611
  350    HE2  MET  46           1HE      MET  46  -8.905  -4.200   9.291
  351    HE3  MET  46           2HE      MET  46  -9.955  -5.568   8.922
  352    H    LYS  47           H        LYS  47  -4.157  -8.694   6.202
  353    HA   LYS  47           HA       LYS  47  -1.335  -8.299   6.288
  354    HB2  LYS  47           1HB      LYS  47  -3.040 -10.725   5.423
  355    HB3  LYS  47           2HB      LYS  47  -1.276 -10.797   5.651
  356    HG2  LYS  47           1HG      LYS  47  -1.572 -10.087   8.084
  357    HG3  LYS  47           2HG      LYS  47  -3.331 -10.044   7.850
  358    HD2  LYS  47           1HD      LYS  47  -3.325 -12.517   7.329
  359    HD3  LYS  47           2HD      LYS  47  -1.570 -12.566   7.539
  360    HE2  LYS  47           1HE      LYS  47  -1.838 -11.894   9.963
  361    HE3  LYS  47           2HE      LYS  47  -3.598 -11.846   9.755
  362    HZ1  LYS  47           3HZ      LYS  47  -2.675 -14.258   8.731
  363    HZ2  LYS  47           1HZ      LYS  47  -3.640 -14.006  10.099
  364    HZ3  LYS  47           2HZ      LYS  47  -1.945 -14.054  10.248
  365    H    ASP  48           H        ASP  48  -3.650  -8.874   3.654
  366    HA   ASP  48           HA       ASP  48  -1.715  -9.161   1.581
  367    HB2  ASP  48           1HB      ASP  48  -4.160  -9.898   1.360
  368    HB3  ASP  48           2HB      ASP  48  -4.654  -8.206   1.335
  369    H    ARG  49           H        ARG  49  -3.354  -6.372   2.998
  370    HA   ARG  49           HA       ARG  49  -2.594  -4.400   1.062
  371    HB2  ARG  49           1HB      ARG  49  -3.251  -4.140   4.055
  372    HB3  ARG  49           2HB      ARG  49  -3.040  -2.769   2.975
  373    HG2  ARG  49           1HG      ARG  49  -4.973  -3.544   1.556
  374    HG3  ARG  49           2HG      ARG  49  -5.176  -4.951   2.617
  375    HD2  ARG  49           1HD      ARG  49  -6.819  -3.181   3.262
  376    HD3  ARG  49           2HD      ARG  49  -5.663  -3.368   4.560
  377    HE   ARG  49           HE       ARG  49  -4.809  -1.268   4.110
  378   HH11  ARG  49          1HH2      ARG  49  -6.798  -2.275   1.401
  379   HH12  ARG  49          2HH2      ARG  49  -6.807  -0.704   0.670
  380   HH21  ARG  49          1HH1      ARG  49  -4.803   0.747   3.110
  381   HH22  ARG  49          2HH1      ARG  49  -5.676   1.004   1.637
  382    H    GLU  50           H        GLU  50  -1.089  -5.627   4.028
  383    HA   GLU  50           HA       GLU  50   1.092  -3.800   4.205
  384    HB2  GLU  50           1HB      GLU  50   0.385  -5.372   6.084
  385    HB3  GLU  50           2HB      GLU  50   1.026  -6.730   5.165
  386    HG2  GLU  50           1HG      GLU  50   3.353  -5.695   5.239
  387    HG3  GLU  50           2HG      GLU  50   2.723  -4.323   6.135
  388    H    ALA  51           H        ALA  51   0.743  -7.006   2.551
  389    HA   ALA  51           HA       ALA  51   3.386  -7.429   1.694
  390    HB1  ALA  51           1HB      ALA  51   2.359  -8.924  -0.067
  391    HB2  ALA  51           2HB      ALA  51   0.780  -8.179   0.209
  392    HB3  ALA  51           3HB      ALA  51   1.522  -9.140   1.480
  393    H    LEU  52           H        LEU  52   0.679  -5.740   0.022
  394    HA   LEU  52           HA       LEU  52   2.148  -4.927  -2.272
  395    HB2  LEU  52           1HB      LEU  52  -0.506  -4.136  -1.074
  396    HB3  LEU  52           2HB      LEU  52   0.169  -3.119  -2.340
  397    HG   LEU  52           HG       LEU  52  -1.401  -4.898  -3.274
  398   HD11  LEU  52          1HD1      LEU  52  -0.184  -5.281  -5.275
  399   HD12  LEU  52          2HD1      LEU  52   1.332  -5.648  -4.461
  400   HD13  LEU  52          3HD1      LEU  52   0.784  -3.976  -4.601
  401   HD21  LEU  52          3HD2      LEU  52  -0.706  -6.702  -1.530
  402   HD22  LEU  52          1HD2      LEU  52   0.697  -7.030  -2.531
  403   HD23  LEU  52          2HD2      LEU  52  -0.929  -7.277  -3.156
  404    H    PHE  53           H        PHE  53   1.441  -3.301   0.763
  405    HA   PHE  53           HA       PHE  53   2.482  -0.746   0.155
  406    HB2  PHE  53           1HB      PHE  53   1.114  -1.375   2.196
  407    HB3  PHE  53           2HB      PHE  53   2.481  -2.258   2.825
  408    HD1  PHE  53           1HD      PHE  53   1.240   1.163   1.965
  409    HD2  PHE  53           2HD      PHE  53   4.533  -1.071   3.733
  410    HE1  PHE  53           1HE      PHE  53   2.265   3.269   2.759
  411    HE2  PHE  53           2HE      PHE  53   5.524   1.063   4.539
  412    HZ   PHE  53           HZ       PHE  53   4.387   3.228   4.061
  413    H    ASN  54           H        ASN  54   4.052  -3.595   1.624
  414    HA   ASN  54           HA       ASN  54   6.676  -2.505   1.953
  415    HB2  ASN  54           1HB      ASN  54   5.718  -5.418   1.617
  416    HB3  ASN  54           2HB      ASN  54   7.393  -5.006   2.014
  417   HD21  ASN  54          1HD2      ASN  54   5.877  -6.568   3.798
  418   HD22  ASN  54          2HD2      ASN  54   5.548  -5.668   5.200
  419    H    GLU  55           H        GLU  55   5.152  -4.307  -0.710
  420    HA   GLU  55           HA       GLU  55   7.480  -4.507  -2.388
  421    HB2  GLU  55           1HB      GLU  55   5.404  -5.976  -2.655
  422    HB3  GLU  55           2HB      GLU  55   4.502  -4.575  -3.226
  423    HG2  GLU  55           1HG      GLU  55   6.086  -4.352  -5.217
  424    HG3  GLU  55           2HG      GLU  55   7.019  -5.722  -4.634
  425    H    PHE  56           H        PHE  56   4.751  -2.181  -2.175
  426    HA   PHE  56           HA       PHE  56   5.289  -0.654  -4.469
  427    HB2  PHE  56           1HB      PHE  56   3.144  -0.500  -3.167
  428    HB3  PHE  56           2HB      PHE  56   3.994   0.200  -1.802
  429    HD1  PHE  56           2HD      PHE  56   3.190   0.748  -5.455
  430    HD2  PHE  56           1HD      PHE  56   4.504   2.679  -1.773
  431    HE1  PHE  56           2HE      PHE  56   3.074   2.966  -6.555
  432    HE2  PHE  56           1HE      PHE  56   4.380   4.909  -2.907
  433    HZ   PHE  56           HZ       PHE  56   3.674   5.051  -5.294
  434    H    VAL  57           H        VAL  57   6.301  -0.140  -1.048
  435    HA   VAL  57           HA       VAL  57   7.856   2.239  -1.448
  436    HB   VAL  57           HB       VAL  57   7.973   0.055   0.741
  437   HG11  VAL  57          1HG1      VAL  57   9.512   2.733   0.591
  438   HG12  VAL  57          2HG1      VAL  57  10.186   1.126   0.878
  439   HG13  VAL  57          3HG1      VAL  57   9.232   1.906   2.132
  440   HG21  VAL  57          3HG2      VAL  57   6.720   2.893   0.827
  441   HG22  VAL  57          1HG2      VAL  57   6.657   1.692   2.118
  442   HG23  VAL  57          2HG2      VAL  57   5.799   1.411   0.609
  443    H    ALA  58           H        ALA  58   8.765  -1.249  -1.338
  444    HA   ALA  58           HA       ALA  58  11.566  -0.895  -1.691
  445    HB1  ALA  58           1HB      ALA  58   9.782  -3.313  -2.389
  446    HB2  ALA  58           2HB      ALA  58  10.555  -3.030  -0.831
  447    HB3  ALA  58           3HB      ALA  58  11.549  -3.369  -2.259
  448    H    ALA  59           H        ALA  59   8.881  -1.360  -4.022
  449    HA   ALA  59           HA       ALA  59  10.496  -1.549  -6.410
  450    HB1  ALA  59           1HB      ALA  59   7.501  -0.915  -6.014
  451    HB2  ALA  59           2HB      ALA  59   8.183  -2.518  -6.289
  452    HB3  ALA  59           3HB      ALA  59   8.247  -1.307  -7.576
  453    H    ALA  60           H        ALA  60   8.653   1.094  -4.802
  454    HA   ALA  60           HA       ALA  60   8.987   3.111  -6.799
  455    HB1  ALA  60           1HB      ALA  60   8.502   3.396  -3.757
  456    HB2  ALA  60           2HB      ALA  60   7.247   3.299  -4.994
  457    HB3  ALA  60           3HB      ALA  60   8.309   4.715  -4.931
  458    H    ARG  61           H        ARG  61  10.845   2.257  -3.874
  459    HA   ARG  61           HA       ARG  61  12.663   4.454  -4.091
  460    HB2  ARG  61           1HB      ARG  61  12.242   3.230  -1.916
  461    HB3  ARG  61           2HB      ARG  61  12.974   1.764  -2.576
  462    HG2  ARG  61           1HG      ARG  61  15.213   2.979  -2.791
  463    HG3  ARG  61           2HG      ARG  61  14.472   4.446  -2.146
  464    HD2  ARG  61           1HD      ARG  61  13.953   3.167  -0.000
  465    HD3  ARG  61           2HD      ARG  61  14.840   1.773  -0.677
  466    HE   ARG  61           HE       ARG  61  16.517   4.062  -0.847
  467   HH11  ARG  61          1HH2      ARG  61  15.036   2.027   1.515
  468   HH12  ARG  61          2HH2      ARG  61  16.267   2.275   2.705
  469   HH21  ARG  61          1HH1      ARG  61  18.124   4.406   0.674
  470   HH22  ARG  61          2HH1      ARG  61  18.034   3.637   2.222
  Start of MODEL   16
    1    H    ILE   5           H        ILE   5 -12.738 -10.169 -11.771
    2    HA   ILE   5           HA       ILE   5 -11.582  -9.368 -13.530
    3    HB   ILE   5           HB       ILE   5 -13.193  -6.730 -13.126
    4   HG12  ILE   5          1HG1      ILE   5 -14.833  -8.624 -13.122
    5   HG13  ILE   5          2HG1      ILE   5 -14.966  -7.792 -14.662
    6   HG21  ILE   5          1HG2      ILE   5 -11.505  -6.402 -14.890
    7   HG22  ILE   5          2HG2      ILE   5 -13.010  -6.663 -15.733
    8   HG23  ILE   5          3HG2      ILE   5 -11.831  -7.961 -15.630
    9   HD11  ILE   5          3HD1      ILE   5 -13.326  -9.696 -15.548
   10   HD12  ILE   5          1HD1      ILE   5 -15.024 -10.055 -15.265
   11   HD13  ILE   5          2HD1      ILE   5 -13.831 -10.538 -14.080
   12    H    MET   6           H        MET   6 -10.497  -9.190 -10.902
   13    HA   MET   6           HA       MET   6  -8.836  -8.172  -9.569
   14    HB2  MET   6           1HB      MET   6  -7.849  -7.534 -12.438
   15    HB3  MET   6           2HB      MET   6  -6.813  -7.484 -11.001
   16    HG2  MET   6           1HG      MET   6  -8.286 -10.036 -11.959
   17    HG3  MET   6           2HG      MET   6  -6.613  -9.673 -12.345
   18    HE1  MET   6           3HE      MET   6  -4.675 -10.116  -9.052
   19    HE2  MET   6           1HE      MET   6  -4.942  -8.850 -10.257
   20    HE3  MET   6           2HE      MET   6  -4.601 -10.496 -10.759
   21    H    GLN   7           H        GLN   7 -11.227  -6.493 -10.445
   22    HA   GLN   7           HA       GLN   7 -10.518  -3.838 -11.049
   23    HB2  GLN   7           1HB      GLN   7 -12.876  -4.793 -11.214
   24    HB3  GLN   7           2HB      GLN   7 -12.989  -4.811  -9.436
   25    HG2  GLN   7           1HG      GLN   7 -12.657  -2.265  -9.425
   26    HG3  GLN   7           2HG      GLN   7 -12.593  -2.279 -11.191
   27   HE21  GLN   7          1HE2      GLN   7 -14.526  -0.757  -9.731
   28   HE22  GLN   7          2HE2      GLN   7 -16.069  -1.401 -10.040
   29    H    ALA   8           H        ALA   8 -10.994  -5.458  -7.893
   30    HA   ALA   8           HA       ALA   8 -10.620  -3.226  -6.147
   31    HB1  ALA   8           1HB      ALA   8 -10.115  -5.003  -4.418
   32    HB2  ALA   8           2HB      ALA   8  -9.946  -6.207  -5.709
   33    HB3  ALA   8           3HB      ALA   8 -11.517  -5.457  -5.403
   34    H    LYS   9           H        LYS   9  -8.248  -5.674  -7.391
   35    HA   LYS   9           HA       LYS   9  -5.937  -4.495  -6.193
   36    HB2  LYS   9           1HB      LYS   9  -6.305  -6.391  -8.596
   37    HB3  LYS   9           2HB      LYS   9  -4.711  -6.014  -7.931
   38    HG2  LYS   9           1HG      LYS   9  -6.971  -7.275  -6.246
   39    HG3  LYS   9           2HG      LYS   9  -5.772  -8.245  -7.137
   40    HD2  LYS   9           1HD      LYS   9  -3.892  -7.209  -5.811
   41    HD3  LYS   9           2HD      LYS   9  -5.049  -6.187  -4.932
   42    HE2  LYS   9           1HE      LYS   9  -4.432  -8.205  -3.587
   43    HE3  LYS   9           2HE      LYS   9  -6.153  -8.248  -3.977
   44    HZ1  LYS   9           3HZ      LYS   9  -4.359  -9.485  -5.899
   45    HZ2  LYS   9           1HZ      LYS   9  -5.875  -9.989  -5.331
   46    HZ3  LYS   9           2HZ      LYS   9  -4.488 -10.256  -4.392
   47    H    GLU  10           H        GLU  10  -7.444  -4.073  -9.374
   48    HA   GLU  10           HA       GLU  10  -5.380  -2.541 -10.539
   49    HB2  GLU  10           1HB      GLU  10  -7.260  -3.605 -11.856
   50    HB3  GLU  10           2HB      GLU  10  -8.404  -2.464 -11.119
   51    HG2  GLU  10           1HG      GLU  10  -7.203  -0.523 -12.214
   52    HG3  GLU  10           2HG      GLU  10  -6.009  -1.635 -12.897
   53    H    ASP  11           H        ASP  11  -8.194  -1.707  -8.586
   54    HA   ASP  11           HA       ASP  11  -7.906   1.199  -8.664
   55    HB2  ASP  11           1HB      ASP  11  -9.401  -0.616  -6.661
   56    HB3  ASP  11           2HB      ASP  11  -9.537   1.151  -6.700
   57    H    PHE  12           H        PHE  12  -6.598  -1.404  -6.629
   58    HA   PHE  12           HA       PHE  12  -5.639   0.181  -4.460
   59    HB2  PHE  12           1HB      PHE  12  -5.880  -2.378  -4.473
   60    HB3  PHE  12           2HB      PHE  12  -4.448  -2.445  -5.494
   61    HD1  PHE  12           1HD      PHE  12  -2.149  -1.854  -4.585
   62    HD2  PHE  12           2HD      PHE  12  -5.677  -1.595  -2.058
   63    HE1  PHE  12           1HE      PHE  12  -0.724  -1.536  -2.587
   64    HE2  PHE  12           2HE      PHE  12  -4.215  -1.302  -0.084
   65    HZ   PHE  12           HZ       PHE  12  -1.742  -1.269  -0.327
   66    H    LYS  13           H        LYS  13  -3.822  -1.114  -7.271
   67    HA   LYS  13           HA       LYS  13  -1.359   0.204  -6.685
   68    HB2  LYS  13           1HB      LYS  13  -0.701  -0.441  -9.030
   69    HB3  LYS  13           2HB      LYS  13  -1.459  -1.798  -8.163
   70    HG2  LYS  13           1HG      LYS  13  -3.611  -1.391  -9.330
   71    HG3  LYS  13           2HG      LYS  13  -3.000   0.016 -10.150
   72    HD2  LYS  13           1HD      LYS  13  -1.562  -2.661 -10.578
   73    HD3  LYS  13           2HD      LYS  13  -3.048  -2.322 -11.456
   74    HE2  LYS  13           1HE      LYS  13  -0.603  -0.462 -11.550
   75    HE3  LYS  13           2HE      LYS  13  -0.995  -1.662 -12.785
   76    HZ1  LYS  13           3HZ      LYS  13  -2.279  -0.137 -13.703
   77    HZ2  LYS  13           1HZ      LYS  13  -2.072   0.928 -12.405
   78    HZ3  LYS  13           2HZ      LYS  13  -3.320  -0.227 -12.364
   79    H    LYS  14           H        LYS  14  -4.161   1.068  -8.676
   80    HA   LYS  14           HA       LYS  14  -3.144   3.326 -10.016
   81    HB2  LYS  14           1HB      LYS  14  -5.307   2.161 -10.643
   82    HB3  LYS  14           2HB      LYS  14  -6.073   2.804  -9.181
   83    HG2  LYS  14           1HG      LYS  14  -5.710   5.171 -10.005
   84    HG3  LYS  14           2HG      LYS  14  -4.873   4.549 -11.448
   85    HD2  LYS  14           1HD      LYS  14  -7.022   3.402 -12.195
   86    HD3  LYS  14           2HD      LYS  14  -7.856   4.047 -10.755
   87    HE2  LYS  14           1HE      LYS  14  -6.566   5.789 -12.965
   88    HE3  LYS  14           2HE      LYS  14  -8.301   5.509 -12.764
   89    HZ1  LYS  14           3HZ      LYS  14  -8.038   7.439 -11.612
   90    HZ2  LYS  14           1HZ      LYS  14  -6.469   7.074 -11.102
   91    HZ3  LYS  14           2HZ      LYS  14  -7.795   6.332 -10.348
   92    H    MET  15           H        MET  15  -4.837   3.017  -6.894
   93    HA   MET  15           HA       MET  15  -4.904   5.837  -6.341
   94    HB2  MET  15           1HB      MET  15  -6.414   4.022  -5.264
   95    HB3  MET  15           2HB      MET  15  -5.002   3.492  -4.330
   96    HG2  MET  15           1HG      MET  15  -6.324   5.024  -2.886
   97    HG3  MET  15           2HG      MET  15  -4.860   5.891  -3.333
   98    HE1  MET  15           3HE      MET  15  -5.996   8.180  -2.687
   99    HE2  MET  15           1HE      MET  15  -7.464   7.309  -2.220
  100    HE3  MET  15           2HE      MET  15  -7.567   8.715  -3.273
  101    H    MET  16           H        MET  16  -2.698   3.204  -5.321
  102    HA   MET  16           HA       MET  16  -1.025   4.698  -3.566
  103    HB2  MET  16           1HB      MET  16  -0.585   2.147  -5.213
  104    HB3  MET  16           2HB      MET  16   0.646   2.745  -4.095
  105    HG2  MET  16           1HG      MET  16  -2.221   2.043  -3.221
  106    HG3  MET  16           2HG      MET  16  -0.856   0.957  -3.082
  107    HE1  MET  16           3HE      MET  16   1.424   1.756  -1.896
  108    HE2  MET  16           1HE      MET  16   0.446   0.795  -0.795
  109    HE3  MET  16           2HE      MET  16   1.239   2.247  -0.231
  110    H    GLU  17           H        GLU  17  -0.627   4.066  -7.065
  111    HA   GLU  17           HA       GLU  17   1.961   5.338  -7.267
  112    HB2  GLU  17           1HB      GLU  17   1.760   4.974  -9.670
  113    HB3  GLU  17           2HB      GLU  17   0.996   3.575  -8.884
  114    HG2  GLU  17           1HG      GLU  17  -1.247   4.791  -9.208
  115    HG3  GLU  17           2HG      GLU  17  -0.416   5.974 -10.185
  116    H    GLU  18           H        GLU  18  -1.435   6.416  -7.690
  117    HA   GLU  18           HA       GLU  18  -0.791   9.150  -8.562
  118    HB2  GLU  18           1HB      GLU  18  -3.439   7.795  -7.700
  119    HB3  GLU  18           2HB      GLU  18  -3.351   9.481  -8.249
  120    HG2  GLU  18           1HG      GLU  18  -2.498   8.724 -10.496
  121    HG3  GLU  18           2HG      GLU  18  -2.529   7.058  -9.965
  122    H    ALA  19           H        ALA  19  -1.264   7.518  -5.475
  123    HA   ALA  19           HA       ALA  19  -1.877   9.991  -3.983
  124    HB1  ALA  19           1HB      ALA  19  -1.946   8.435  -1.971
  125    HB2  ALA  19           2HB      ALA  19  -1.471   7.101  -3.019
  126    HB3  ALA  19           3HB      ALA  19  -3.014   7.904  -3.270
  127    H    LYS  20           H        LYS  20   0.842   9.034  -5.467
  128    HA   LYS  20           HA       LYS  20   2.981   8.371  -4.195
  129    HB2  LYS  20           1HB      LYS  20   2.936   9.824  -6.375
  130    HB3  LYS  20           2HB      LYS  20   3.107  11.232  -5.338
  131    HG2  LYS  20           1HG      LYS  20   5.427  10.831  -5.727
  132    HG3  LYS  20           2HG      LYS  20   5.230   9.783  -4.327
  133    HD2  LYS  20           1HD      LYS  20   6.320   8.299  -5.844
  134    HD3  LYS  20           2HD      LYS  20   4.634   7.883  -6.161
  135    HE2  LYS  20           1HE      LYS  20   4.695   9.598  -8.122
  136    HE3  LYS  20           2HE      LYS  20   6.442   9.721  -7.848
  137    HZ1  LYS  20           3HZ      LYS  20   6.730   7.846  -8.971
  138    HZ2  LYS  20           1HZ      LYS  20   5.071   7.791  -9.310
  139    HZ3  LYS  20           2HZ      LYS  20   5.684   6.994  -7.937
  140    H    PHE  21           H        PHE  21   3.680   8.484  -2.174
  141    HA   PHE  21           HA       PHE  21   3.408  10.996  -0.608
  142    HB2  PHE  21           1HB      PHE  21   2.617   9.625   1.344
  143    HB3  PHE  21           2HB      PHE  21   1.508   9.478  -0.021
  144    HD1  PHE  21           2HD      PHE  21   1.572   7.337  -1.518
  145    HD2  PHE  21           1HD      PHE  21   3.855   7.619   2.149
  146    HE1  PHE  21           2HE      PHE  21   1.928   4.879  -1.545
  147    HE2  PHE  21           1HE      PHE  21   4.218   5.164   2.107
  148    HZ   PHE  21           HZ       PHE  21   3.262   3.782   0.262
  149    H    ASN  22           H        ASN  22   4.729  10.700   1.499
  150    HA   ASN  22           HA       ASN  22   7.403  10.533   0.969
  151    HB2  ASN  22           1HB      ASN  22   5.936  10.079   3.584
  152    HB3  ASN  22           2HB      ASN  22   7.674  10.333   3.507
  153   HD21  ASN  22          1HD2      ASN  22   8.158  12.386   1.937
  154   HD22  ASN  22          2HD2      ASN  22   7.254  13.771   2.314
  155    HA   PRO  23           HA       PRO  23   7.840   5.925   0.377
  156    HB2  PRO  23           1HB      PRO  23  10.559   5.770  -0.089
  157    HB3  PRO  23           2HB      PRO  23   9.434   6.451  -1.303
  158    HG2  PRO  23           1HG      PRO  23  11.179   7.916   0.717
  159    HG3  PRO  23           2HG      PRO  23  10.954   8.240  -1.033
  160    HD2  PRO  23           1HD      PRO  23   9.601   9.685   0.866
  161    HD3  PRO  23           2HD      PRO  23   8.835   9.295  -0.715
  162    H    ARG  24           H        ARG  24   9.391   7.781   2.866
  163    HA   ARG  24           HA       ARG  24  10.416   5.462   4.359
  164    HB2  ARG  24           1HB      ARG  24  11.343   7.197   5.936
  165    HB3  ARG  24           2HB      ARG  24  11.798   7.565   4.260
  166    HG2  ARG  24           1HG      ARG  24   9.931   9.260   4.093
  167    HG3  ARG  24           2HG      ARG  24   9.406   8.881   5.751
  168    HD2  ARG  24           1HD      ARG  24  10.779  10.947   5.784
  169    HD3  ARG  24           2HD      ARG  24  11.680   9.667   6.596
  170    HE   ARG  24           HE       ARG  24  13.248   9.684   4.876
  171   HH11  ARG  24          1HH2      ARG  24  10.411  11.481   3.842
  172   HH12  ARG  24          2HH2      ARG  24  11.182  12.115   2.427
  173   HH21  ARG  24          1HH1      ARG  24  14.197  10.501   3.000
  174   HH22  ARG  24          2HH1      ARG  24  13.312  11.562   1.958
  175    H    ALA  25           H        ALA  25   7.429   6.889   4.035
  176    HA   ALA  25           HA       ALA  25   6.524   6.836   6.798
  177    HB1  ALA  25           1HB      ALA  25   4.215   6.978   5.766
  178    HB2  ALA  25           2HB      ALA  25   4.923   6.688   4.175
  179    HB3  ALA  25           3HB      ALA  25   5.304   8.162   5.046
  180    H    THR  26           H        THR  26   5.119   5.266   7.723
  181    HA   THR  26           HA       THR  26   5.735   2.489   6.880
  182    HB   THR  26           HB       THR  26   4.497   3.561   9.509
  183    HG1  THR  26           1HG      THR  26   7.093   3.316   8.573
  184   HG21  THR  26          3HG2      THR  26   4.024   1.154   9.368
  185   HG22  THR  26          1HG2      THR  26   5.459   1.300  10.375
  186   HG23  THR  26          2HG2      THR  26   5.619   0.797   8.703
  187    H    PHE  27           H        PHE  27   3.942   0.931   7.120
  188    HA   PHE  27           HA       PHE  27   1.684   1.595   5.533
  189    HB2  PHE  27           1HB      PHE  27   2.518  -0.735   5.648
  190    HB3  PHE  27           2HB      PHE  27   2.265  -0.786   7.389
  191    HD1  PHE  27           1HD      PHE  27   0.305  -0.039   4.213
  192    HD2  PHE  27           2HD      PHE  27   0.144  -1.772   8.183
  193    HE1  PHE  27           1HE      PHE  27  -2.030  -0.673   3.829
  194    HE2  PHE  27           2HE      PHE  27  -2.216  -2.429   7.778
  195    HZ   PHE  27           HZ       PHE  27  -3.309  -1.893   5.594
  196    H    SER  28           H        SER  28   2.059   1.215   9.067
  197    HA   SER  28           HA       SER  28  -0.670   1.493   9.848
  198    HB2  SER  28           1HB      SER  28   0.288   2.054  12.107
  199    HB3  SER  28           2HB      SER  28   1.160   0.694  11.393
  200    HG   SER  28           HG       SER  28   2.090   3.246  10.777
  201    H    GLU  29           H        GLU  29   1.831   3.936   9.195
  202    HA   GLU  29           HA       GLU  29   0.235   6.191  10.031
  203    HB2  GLU  29           1HB      GLU  29   2.771   6.255   9.948
  204    HB3  GLU  29           2HB      GLU  29   2.727   6.020   8.189
  205    HG2  GLU  29           1HG      GLU  29   1.505   8.188   7.923
  206    HG3  GLU  29           2HG      GLU  29   1.485   8.447   9.665
  207    H    PHE  30           H        PHE  30   0.988   4.641   6.857
  208    HA   PHE  30           HA       PHE  30  -0.497   6.475   5.191
  209    HB2  PHE  30           1HB      PHE  30   1.325   4.863   4.381
  210    HB3  PHE  30           2HB      PHE  30   0.213   3.520   4.652
  211    HD1  PHE  30           2HD      PHE  30   0.691   6.704   2.673
  212    HD2  PHE  30           1HD      PHE  30  -1.669   3.068   3.038
  213    HE1  PHE  30           2HE      PHE  30  -0.450   7.212   0.527
  214    HE2  PHE  30           1HE      PHE  30  -2.797   3.599   0.891
  215    HZ   PHE  30           HZ       PHE  30  -2.197   5.673  -0.370
  216    H    ALA  31           H        ALA  31  -1.337   3.326   6.689
  217    HA   ALA  31           HA       ALA  31  -3.962   3.050   5.583
  218    HB1  ALA  31           1HB      ALA  31  -2.714   1.888   8.155
  219    HB2  ALA  31           2HB      ALA  31  -2.699   1.134   6.564
  220    HB3  ALA  31           3HB      ALA  31  -4.225   1.322   7.428
  221    H    ALA  32           H        ALA  32  -2.719   4.527   8.600
  222    HA   ALA  32           HA       ALA  32  -5.195   5.105   9.938
  223    HB1  ALA  32           1HB      ALA  32  -3.859   6.909  11.113
  224    HB2  ALA  32           2HB      ALA  32  -2.541   6.657   9.966
  225    HB3  ALA  32           3HB      ALA  32  -2.992   5.372  11.087
  226    H    LYS  33           H        LYS  33  -3.445   6.861   7.370
  227    HA   LYS  33           HA       LYS  33  -5.225   9.168   7.379
  228    HB2  LYS  33           1HB      LYS  33  -2.817   9.224   6.498
  229    HB3  LYS  33           2HB      LYS  33  -3.301   8.158   5.155
  230    HG2  LYS  33           1HG      LYS  33  -4.865   9.893   4.263
  231    HG3  LYS  33           2HG      LYS  33  -4.591  10.940   5.665
  232    HD2  LYS  33           1HD      LYS  33  -2.098  10.144   4.051
  233    HD3  LYS  33           2HD      LYS  33  -3.233  11.270   3.280
  234    HE2  LYS  33           1HE      LYS  33  -2.000  11.732   6.061
  235    HE3  LYS  33           2HE      LYS  33  -1.452  12.509   4.564
  236    HZ1  LYS  33           3HZ      LYS  33  -4.073  13.013   4.480
  237    HZ2  LYS  33           1HZ      LYS  33  -2.925  14.060   5.160
  238    HZ3  LYS  33           2HZ      LYS  33  -3.812  13.017   6.161
  239    H    HIS  34           H        HIS  34  -5.037   6.165   5.386
  240    HA   HIS  34           HA       HIS  34  -7.489   6.952   3.907
  241    HB2  HIS  34           1HB      HIS  34  -5.469   4.661   3.527
  242    HB3  HIS  34           2HB      HIS  34  -6.897   4.877   2.495
  243    HD2  HIS  34           2HD      HIS  34  -6.691   7.043   0.637
  244    HE1  HIS  34           1HE      HIS  34  -2.799   8.259   1.725
  245    HE2  HIS  34           2HE      HIS  34  -4.673   8.587   0.045
  246    H    ALA  35           H        ALA  35  -6.879   5.497   6.807
  247    HA   ALA  35           HA       ALA  35  -8.189   3.044   6.925
  248    HB1  ALA  35           1HB      ALA  35  -7.950   5.302   8.991
  249    HB2  ALA  35           2HB      ALA  35  -7.108   3.756   8.974
  250    HB3  ALA  35           3HB      ALA  35  -8.804   3.809   9.399
  251    H    LYS  36           H        LYS  36  -9.630   6.324   6.928
  252    HA   LYS  36           HA       LYS  36 -12.332   5.396   7.401
  253    HB2  LYS  36           1HB      LYS  36 -11.168   8.106   6.430
  254    HB3  LYS  36           2HB      LYS  36 -12.882   7.865   6.890
  255    HG2  LYS  36           1HG      LYS  36 -12.164   7.236   9.241
  256    HG3  LYS  36           2HG      LYS  36 -10.450   7.472   8.787
  257    HD2  LYS  36           1HD      LYS  36 -10.910   9.925   8.281
  258    HD3  LYS  36           2HD      LYS  36 -12.621   9.703   8.719
  259    HE2  LYS  36           1HE      LYS  36 -11.942   9.094  11.069
  260    HE3  LYS  36           2HE      LYS  36 -10.231   9.322  10.632
  261    HZ1  LYS  36           3HZ      LYS  36 -10.488  11.573  10.440
  262    HZ2  LYS  36           1HZ      LYS  36 -11.604  11.255  11.673
  263    HZ3  LYS  36           2HZ      LYS  36 -12.151  11.490  10.082
  264    H    ASP  37           H        ASP  37 -10.266   5.481   4.661
  265    HA   ASP  37           HA       ASP  37 -12.234   5.998   2.607
  266    HB2  ASP  37           1HB      ASP  37  -9.613   6.087   2.378
  267    HB3  ASP  37           2HB      ASP  37  -9.669   4.333   2.203
  268    H    SER  38           H        SER  38 -13.546   4.509   1.517
  269    HA   SER  38           HA       SER  38 -14.430   2.129   2.855
  270    HB2  SER  38           1HB      SER  38 -15.842   3.495   1.318
  271    HB3  SER  38           2HB      SER  38 -14.842   3.012  -0.049
  272    HG   SER  38           HG       SER  38 -16.569   1.633   0.036
  273    H    ARG  39           H        ARG  39 -11.889   2.712   0.615
  274    HA   ARG  39           HA       ARG  39 -11.464   0.151  -0.603
  275    HB2  ARG  39           1HB      ARG  39  -9.648   2.565  -0.065
  276    HB3  ARG  39           2HB      ARG  39  -9.025   1.114  -0.850
  277    HG2  ARG  39           1HG      ARG  39 -10.500   1.379  -2.777
  278    HG3  ARG  39           2HG      ARG  39 -11.494   2.595  -1.957
  279    HD2  ARG  39           1HD      ARG  39  -9.728   3.469  -3.725
  280    HD3  ARG  39           2HD      ARG  39  -9.821   4.304  -2.183
  281    HE   ARG  39           HE       ARG  39  -7.666   3.652  -1.734
  282   HH11  ARG  39          1HH2      ARG  39  -8.948   1.490  -4.172
  283   HH12  ARG  39          2HH2      ARG  39  -7.468   0.618  -4.346
  284   HH21  ARG  39          1HH1      ARG  39  -5.790   2.493  -1.923
  285   HH22  ARG  39          2HH1      ARG  39  -5.662   1.201  -3.047
  286    H    PHE  40           H        PHE  40 -10.566   1.544   2.464
  287    HA   PHE  40           HA       PHE  40  -8.633  -0.488   3.205
  288    HB2  PHE  40           1HB      PHE  40  -8.708   1.854   4.266
  289    HB3  PHE  40           2HB      PHE  40 -10.226   1.415   5.056
  290    HD1  PHE  40           2HD      PHE  40  -6.578   0.474   4.792
  291    HD2  PHE  40           1HD      PHE  40 -10.213  -0.019   7.122
  292    HE1  PHE  40           2HE      PHE  40  -5.323  -0.728   6.542
  293    HE2  PHE  40           1HE      PHE  40  -8.916  -1.223   8.864
  294    HZ   PHE  40           HZ       PHE  40  -6.460  -1.570   8.573
  295    H    LYS  41           H        LYS  41 -12.111   0.063   3.924
  296    HA   LYS  41           HA       LYS  41 -12.426  -2.323   5.540
  297    HB2  LYS  41           1HB      LYS  41 -14.542  -0.463   4.256
  298    HB3  LYS  41           2HB      LYS  41 -14.901  -1.644   5.535
  299    HG2  LYS  41           1HG      LYS  41 -12.983   0.782   5.872
  300    HG3  LYS  41           2HG      LYS  41 -14.693   0.772   6.386
  301    HD2  LYS  41           1HD      LYS  41 -14.222  -1.135   7.988
  302    HD3  LYS  41           2HD      LYS  41 -12.532  -1.148   7.497
  303    HE2  LYS  41           1HE      LYS  41 -12.211   1.176   8.367
  304    HE3  LYS  41           2HE      LYS  41 -13.923   1.233   8.848
  305    HZ1  LYS  41           3HZ      LYS  41 -11.809  -0.595   9.890
  306    HZ2  LYS  41           1HZ      LYS  41 -13.462  -0.798  10.224
  307    HZ3  LYS  41           2HZ      LYS  41 -12.656   0.606  10.743
  308    H    ALA  42           H        ALA  42 -12.389  -1.755   2.183
  309    HA   ALA  42           HA       ALA  42 -14.228  -3.800   1.228
  310    HB1  ALA  42           1HB      ALA  42 -11.776  -2.501  -0.090
  311    HB2  ALA  42           2HB      ALA  42 -13.418  -1.868  -0.183
  312    HB3  ALA  42           3HB      ALA  42 -13.025  -3.416  -0.935
  313    H    ILE  43           H        ILE  43 -10.778  -3.736   2.145
  314    HA   ILE  43           HA       ILE  43 -10.492  -6.632   1.459
  315    HB   ILE  43           HB       ILE  43  -8.334  -4.780   2.652
  316   HG12  ILE  43          1HG1      ILE  43  -9.090  -3.569   0.611
  317   HG13  ILE  43          2HG1      ILE  43  -7.543  -4.318   0.244
  318   HG21  ILE  43          1HG2      ILE  43  -7.826  -7.237   2.630
  319   HG22  ILE  43          2HG2      ILE  43  -6.770  -6.412   1.501
  320   HG23  ILE  43          3HG2      ILE  43  -8.142  -7.327   0.901
  321   HD11  ILE  43          3HD1      ILE  43 -10.302  -5.088  -0.728
  322   HD12  ILE  43          1HD1      ILE  43  -8.998  -6.275  -0.789
  323   HD13  ILE  43          2HD1      ILE  43  -8.854  -4.756  -1.646
  324    H    GLU  44           H        GLU  44 -11.008  -8.034   2.953
  325    HA   GLU  44           HA       GLU  44 -11.562  -7.469   5.722
  326    HB2  GLU  44           1HB      GLU  44 -11.273 -10.103   4.123
  327    HB3  GLU  44           2HB      GLU  44 -11.857 -10.044   5.804
  328    HG2  GLU  44           1HG      GLU  44 -13.801  -8.569   5.066
  329    HG3  GLU  44           2HG      GLU  44 -13.216  -8.635   3.395
  330    H    LYS  45           H        LYS  45  -8.879  -9.102   3.986
  331    HA   LYS  45           HA       LYS  45  -7.322  -9.568   6.463
  332    HB2  LYS  45           1HB      LYS  45  -6.826 -10.347   3.505
  333    HB3  LYS  45           2HB      LYS  45  -5.747 -10.797   4.858
  334    HG2  LYS  45           1HG      LYS  45  -7.663 -12.058   5.969
  335    HG3  LYS  45           2HG      LYS  45  -8.734 -11.616   4.610
  336    HD2  LYS  45           1HD      LYS  45  -7.218 -12.886   2.993
  337    HD3  LYS  45           2HD      LYS  45  -6.159 -13.337   4.357
  338    HE2  LYS  45           1HE      LYS  45  -9.133 -14.138   4.129
  339    HE3  LYS  45           2HE      LYS  45  -7.763 -15.207   3.796
  340    HZ1  LYS  45           3HZ      LYS  45  -8.333 -15.644   5.987
  341    HZ2  LYS  45           1HZ      LYS  45  -8.586 -14.014   6.371
  342    HZ3  LYS  45           2HZ      LYS  45  -7.005 -14.597   6.135
  343    H    MET  46           H        MET  46  -6.329  -7.785   7.165
  344    HA   MET  46           HA       MET  46  -5.292  -5.632   5.547
  345    HB2  MET  46           1HB      MET  46  -4.914  -6.440   8.492
  346    HB3  MET  46           2HB      MET  46  -4.312  -4.917   7.826
  347    HG2  MET  46           1HG      MET  46  -6.650  -4.207   7.239
  348    HG3  MET  46           2HG      MET  46  -7.287  -5.746   7.824
  349    HE1  MET  46           3HE      MET  46  -6.463  -6.592  10.408
  350    HE2  MET  46           1HE      MET  46  -8.134  -6.036  10.321
  351    HE3  MET  46           2HE      MET  46  -7.107  -5.538  11.653
  352    H    LYS  47           H        LYS  47  -4.179  -8.777   6.258
  353    HA   LYS  47           HA       LYS  47  -1.343  -8.404   6.413
  354    HB2  LYS  47           1HB      LYS  47  -3.046 -10.814   5.473
  355    HB3  LYS  47           2HB      LYS  47  -1.277 -10.895   5.734
  356    HG2  LYS  47           1HG      LYS  47  -1.614 -10.225   8.172
  357    HG3  LYS  47           2HG      LYS  47  -3.383 -10.177   7.908
  358    HD2  LYS  47           1HD      LYS  47  -3.366 -12.654   7.318
  359    HD3  LYS  47           2HD      LYS  47  -1.604 -12.708   7.560
  360    HE2  LYS  47           1HE      LYS  47  -1.912 -12.078   9.984
  361    HE3  LYS  47           2HE      LYS  47  -3.678 -12.036   9.743
  362    HZ1  LYS  47           3HZ      LYS  47  -3.777 -14.235   9.877
  363    HZ2  LYS  47           1HZ      LYS  47  -2.160 -14.229  10.386
  364    HZ3  LYS  47           2HZ      LYS  47  -2.529 -14.457   8.742
  365    H    ASP  48           H        ASP  48  -3.611  -8.928   3.701
  366    HA   ASP  48           HA       ASP  48  -1.631  -9.175   1.638
  367    HB2  ASP  48           1HB      ASP  48  -4.102  -9.883   1.450
  368    HB3  ASP  48           2HB      ASP  48  -4.543  -8.176   1.350
  369    H    ARG  49           H        ARG  49  -3.312  -6.425   3.106
  370    HA   ARG  49           HA       ARG  49  -2.490  -4.394   1.220
  371    HB2  ARG  49           1HB      ARG  49  -3.248  -4.177   4.199
  372    HB3  ARG  49           2HB      ARG  49  -3.005  -2.794   3.131
  373    HG2  ARG  49           1HG      ARG  49  -4.888  -3.597   1.634
  374    HG3  ARG  49           2HG      ARG  49  -5.135  -4.977   2.736
  375    HD2  ARG  49           1HD      ARG  49  -6.766  -3.165   3.281
  376    HD3  ARG  49           2HD      ARG  49  -5.656  -3.330   4.616
  377    HE   ARG  49           HE       ARG  49  -4.798  -1.228   4.141
  378   HH11  ARG  49          1HH2      ARG  49  -6.714  -2.316   1.412
  379   HH12  ARG  49          2HH2      ARG  49  -6.673  -0.779   0.615
  380   HH21  ARG  49          1HH1      ARG  49  -4.738   0.743   3.062
  381   HH22  ARG  49          2HH1      ARG  49  -5.560   0.943   1.552
  382    H    GLU  50           H        GLU  50  -1.097  -5.665   4.298
  383    HA   GLU  50           HA       GLU  50   1.121  -3.834   4.495
  384    HB2  GLU  50           1HB      GLU  50   0.265  -5.325   6.396
  385    HB3  GLU  50           2HB      GLU  50   0.941  -6.746   5.567
  386    HG2  GLU  50           1HG      GLU  50   3.272  -5.706   5.729
  387    HG3  GLU  50           2HG      GLU  50   2.593  -4.302   6.555
  388    H    ALA  51           H        ALA  51   0.784  -7.112   2.996
  389    HA   ALA  51           HA       ALA  51   3.467  -7.548   2.175
  390    HB1  ALA  51           1HB      ALA  51   2.445  -9.153   0.527
  391    HB2  ALA  51           2HB      ALA  51   0.849  -8.436   0.815
  392    HB3  ALA  51           3HB      ALA  51   1.672  -9.300   2.115
  393    H    LEU  52           H        LEU  52   0.726  -6.038   0.403
  394    HA   LEU  52           HA       LEU  52   2.089  -5.377  -2.004
  395    HB2  LEU  52           1HB      LEU  52  -0.408  -4.240  -0.658
  396    HB3  LEU  52           2HB      LEU  52   0.099  -3.744  -2.262
  397    HG   LEU  52           HG       LEU  52  -0.468  -6.696  -1.589
  398   HD11  LEU  52          1HD1      LEU  52  -2.404  -4.603  -2.765
  399   HD12  LEU  52          2HD1      LEU  52  -2.583  -5.469  -1.228
  400   HD13  LEU  52          3HD1      LEU  52  -2.700  -6.349  -2.744
  401   HD21  LEU  52          3HD2      LEU  52   0.897  -6.423  -3.635
  402   HD22  LEU  52          1HD2      LEU  52  -0.190  -5.196  -4.279
  403   HD23  LEU  52          2HD2      LEU  52  -0.712  -6.865  -4.115
  404    H    PHE  53           H        PHE  53   1.520  -3.554   0.996
  405    HA   PHE  53           HA       PHE  53   2.566  -1.020   0.204
  406    HB2  PHE  53           1HB      PHE  53   1.241  -1.494   2.327
  407    HB3  PHE  53           2HB      PHE  53   2.636  -2.331   2.995
  408    HD1  PHE  53           2HD      PHE  53   1.318   1.023   1.965
  409    HD2  PHE  53           1HD      PHE  53   4.721  -1.058   3.690
  410    HE1  PHE  53           2HE      PHE  53   2.323   3.188   2.613
  411    HE2  PHE  53           1HE      PHE  53   5.710   1.120   4.328
  412    HZ   PHE  53           HZ       PHE  53   4.512   3.240   3.786
  413    H    ASN  54           H        ASN  54   4.166  -3.839   1.740
  414    HA   ASN  54           HA       ASN  54   6.799  -2.730   1.975
  415    HB2  ASN  54           1HB      ASN  54   5.863  -5.655   1.667
  416    HB3  ASN  54           2HB      ASN  54   7.519  -5.199   2.095
  417   HD21  ASN  54          1HD2      ASN  54   5.223  -6.605   3.685
  418   HD22  ASN  54          2HD2      ASN  54   5.190  -5.751   5.154
  419    H    GLU  55           H        GLU  55   5.211  -4.593  -0.650
  420    HA   GLU  55           HA       GLU  55   7.503  -4.768  -2.413
  421    HB2  GLU  55           1HB      GLU  55   4.472  -5.039  -2.933
  422    HB3  GLU  55           2HB      GLU  55   5.697  -5.342  -4.191
  423    HG2  GLU  55           1HG      GLU  55   6.687  -7.196  -2.812
  424    HG3  GLU  55           2HG      GLU  55   5.556  -6.876  -1.507
  425    H    PHE  56           H        PHE  56   4.745  -2.476  -2.093
  426    HA   PHE  56           HA       PHE  56   5.173  -0.982  -4.455
  427    HB2  PHE  56           1HB      PHE  56   3.082  -0.820  -3.061
  428    HB3  PHE  56           2HB      PHE  56   3.995  -0.086  -1.745
  429    HD1  PHE  56           1HD      PHE  56   3.021   0.423  -5.367
  430    HD2  PHE  56           2HD      PHE  56   4.498   2.367  -1.767
  431    HE1  PHE  56           1HE      PHE  56   2.851   2.635  -6.475
  432    HE2  PHE  56           2HE      PHE  56   4.311   4.571  -2.892
  433    HZ   PHE  56           HZ       PHE  56   3.499   4.713  -5.250
  434    H    VAL  57           H        VAL  57   6.351  -0.403  -1.071
  435    HA   VAL  57           HA       VAL  57   7.891   1.972  -1.617
  436    HB   VAL  57           HB       VAL  57   8.104  -0.180   0.619
  437   HG11  VAL  57          1HG1      VAL  57   9.604   2.521   0.342
  438   HG12  VAL  57          2HG1      VAL  57  10.307   0.926   0.615
  439   HG13  VAL  57          3HG1      VAL  57   9.400   1.711   1.897
  440   HG21  VAL  57          3HG2      VAL  57   6.912   1.549   2.016
  441   HG22  VAL  57          1HG2      VAL  57   5.950   1.172   0.587
  442   HG23  VAL  57          2HG2      VAL  57   6.866   2.672   0.655
  443    H    ALA  58           H        ALA  58   8.794  -1.521  -1.477
  444    HA   ALA  58           HA       ALA  58  11.588  -1.160  -1.967
  445    HB1  ALA  58           1HB      ALA  58  10.605  -3.273  -1.012
  446    HB2  ALA  58           2HB      ALA  58  11.557  -3.644  -2.457
  447    HB3  ALA  58           3HB      ALA  58   9.789  -3.599  -2.544
  448    H    ALA  59           H        ALA  59   8.784  -1.658  -4.162
  449    HA   ALA  59           HA       ALA  59  10.329  -1.878  -6.614
  450    HB1  ALA  59           1HB      ALA  59   8.044  -1.720  -7.696
  451    HB2  ALA  59           2HB      ALA  59   7.338  -1.290  -6.125
  452    HB3  ALA  59           3HB      ALA  59   8.044  -2.890  -6.371
  453    H    ALA  60           H        ALA  60   8.470   0.750  -4.982
  454    HA   ALA  60           HA       ALA  60   8.729   2.751  -7.029
  455    HB1  ALA  60           1HB      ALA  60   8.286   3.058  -3.987
  456    HB2  ALA  60           2HB      ALA  60   7.015   2.922  -5.206
  457    HB3  ALA  60           3HB      ALA  60   8.046   4.357  -5.177
  458    H    ARG  61           H        ARG  61  10.648   2.004  -4.081
  459    HA   ARG  61           HA       ARG  61  12.452   4.216  -4.372
  460    HB2  ARG  61           1HB      ARG  61  12.038   3.047  -2.146
  461    HB3  ARG  61           2HB      ARG  61  12.792   1.560  -2.776
  462    HG2  ARG  61           1HG      ARG  61  15.005   2.784  -3.061
  463    HG3  ARG  61           2HG      ARG  61  14.255   4.280  -2.491
  464    HD2  ARG  61           1HD      ARG  61  13.843   3.178  -0.235
  465    HD3  ARG  61           2HD      ARG  61  14.629   1.707  -0.847
  466    HE   ARG  61           HE       ARG  61  16.701   2.738  -0.611
  467   HH11  ARG  61          1HH2      ARG  61  14.211   5.204  -0.564
  468   HH12  ARG  61          2HH2      ARG  61  15.291   6.477  -0.107
  469   HH21  ARG  61          1HH1      ARG  61  18.103   4.445  -0.051
  470   HH22  ARG  61          2HH1      ARG  61  17.485   6.045   0.183
  Start of MODEL   17
    1    H    ILE   5           H        ILE   5 -13.314 -10.439 -11.806
    2    HA   ILE   5           HA       ILE   5 -11.473 -10.170 -13.125
    3    HB   ILE   5           HB       ILE   5 -12.451  -7.247 -13.647
    4   HG12  ILE   5          1HG1      ILE   5 -13.195  -9.738 -15.377
    5   HG13  ILE   5          2HG1      ILE   5 -14.266  -9.129 -14.144
    6   HG21  ILE   5          1HG2      ILE   5 -11.196  -7.457 -15.825
    7   HG22  ILE   5          2HG2      ILE   5 -10.770  -9.127 -15.451
    8   HG23  ILE   5          3HG2      ILE   5 -10.089  -7.817 -14.517
    9   HD11  ILE   5          3HD1      ILE   5 -14.913  -8.246 -16.330
   10   HD12  ILE   5          1HD1      ILE   5 -13.333  -7.501 -16.546
   11   HD13  ILE   5          2HD1      ILE   5 -14.423  -6.932 -15.271
   12    H    MET   6           H        MET   6 -11.208  -9.840 -10.302
   13    HA   MET   6           HA       MET   6 -10.047  -8.747  -8.517
   14    HB2  MET   6           1HB      MET   6  -8.016  -8.867 -10.829
   15    HB3  MET   6           2HB      MET   6  -7.542  -8.617  -9.145
   16    HG2  MET   6           1HG      MET   6  -8.505 -10.862  -8.515
   17    HG3  MET   6           2HG      MET   6  -9.017 -11.133 -10.187
   18    HE1  MET   6           3HE      MET   6  -6.984 -10.551 -12.196
   19    HE2  MET   6           1HE      MET   6  -7.454 -12.239 -12.008
   20    HE3  MET   6           2HE      MET   6  -5.761 -11.801 -12.144
   21    H    GLN   7           H        GLN   7 -11.697  -6.857  -9.946
   22    HA   GLN   7           HA       GLN   7 -10.382  -4.499 -10.832
   23    HB2  GLN   7           1HB      GLN   7 -12.832  -5.002 -11.256
   24    HB3  GLN   7           2HB      GLN   7 -13.195  -4.752  -9.537
   25    HG2  GLN   7           1HG      GLN   7 -12.441  -2.329  -9.735
   26    HG3  GLN   7           2HG      GLN   7 -12.041  -2.576 -11.434
   27   HE21  GLN   7          1HE2      GLN   7 -13.892  -0.574 -10.601
   28   HE22  GLN   7          2HE2      GLN   7 -15.441  -0.997 -11.157
   29    H    ALA   8           H        ALA   8 -11.412  -5.560  -7.588
   30    HA   ALA   8           HA       ALA   8 -11.029  -3.147  -6.097
   31    HB1  ALA   8           1HB      ALA   8 -10.816  -6.112  -5.284
   32    HB2  ALA   8           2HB      ALA   8 -12.146  -5.007  -4.951
   33    HB3  ALA   8           3HB      ALA   8 -10.625  -4.800  -4.106
   34    H    LYS   9           H        LYS   9  -8.776  -5.839  -6.937
   35    HA   LYS   9           HA       LYS   9  -6.549  -4.852  -5.464
   36    HB2  LYS   9           1HB      LYS   9  -6.934  -7.275  -6.450
   37    HB3  LYS   9           2HB      LYS   9  -6.349  -6.631  -8.000
   38    HG2  LYS   9           1HG      LYS   9  -4.154  -5.986  -6.934
   39    HG3  LYS   9           2HG      LYS   9  -4.734  -6.550  -5.348
   40    HD2  LYS   9           1HD      LYS   9  -4.917  -8.932  -6.272
   41    HD3  LYS   9           2HD      LYS   9  -4.297  -8.356  -7.848
   42    HE2  LYS   9           1HE      LYS   9  -2.443  -9.372  -6.455
   43    HE3  LYS   9           2HE      LYS   9  -2.135  -7.654  -6.714
   44    HZ1  LYS   9           3HZ      LYS   9  -2.695  -7.137  -4.570
   45    HZ2  LYS   9           1HZ      LYS   9  -1.993  -8.662  -4.347
   46    HZ3  LYS   9           2HZ      LYS   9  -3.683  -8.505  -4.358
   47    H    GLU  10           H        GLU  10  -7.505  -4.409  -8.889
   48    HA   GLU  10           HA       GLU  10  -5.194  -2.886  -9.749
   49    HB2  GLU  10           1HB      GLU  10  -8.032  -3.368 -10.834
   50    HB3  GLU  10           2HB      GLU  10  -7.071  -2.070 -11.557
   51    HG2  GLU  10           1HG      GLU  10  -6.778  -4.180 -12.885
   52    HG3  GLU  10           2HG      GLU  10  -5.240  -3.738 -12.139
   53    H    ASP  11           H        ASP  11  -8.354  -2.024  -8.364
   54    HA   ASP  11           HA       ASP  11  -8.175   0.864  -8.565
   55    HB2  ASP  11           1HB      ASP  11  -9.752  -0.940  -6.624
   56    HB3  ASP  11           2HB      ASP  11  -9.946   0.811  -6.676
   57    H    PHE  12           H        PHE  12  -7.102  -1.503  -6.103
   58    HA   PHE  12           HA       PHE  12  -6.274   0.381  -4.068
   59    HB2  PHE  12           1HB      PHE  12  -6.578  -2.147  -3.709
   60    HB3  PHE  12           2HB      PHE  12  -5.116  -2.423  -4.654
   61    HD1  PHE  12           1HD      PHE  12  -6.414  -0.756  -1.524
   62    HD2  PHE  12           2HD      PHE  12  -2.835  -2.019  -3.648
   63    HE1  PHE  12           1HE      PHE  12  -5.029  -0.212   0.460
   64    HE2  PHE  12           2HE      PHE  12  -1.479  -1.486  -1.636
   65    HZ   PHE  12           HZ       PHE  12  -2.562  -0.572   0.414
   66    H    LYS  13           H        LYS  13  -4.402  -1.244  -6.727
   67    HA   LYS  13           HA       LYS  13  -1.879  -0.005  -6.220
   68    HB2  LYS  13           1HB      LYS  13  -3.099  -1.209  -8.782
   69    HB3  LYS  13           2HB      LYS  13  -1.405  -0.662  -8.683
   70    HG2  LYS  13           1HG      LYS  13  -0.990  -2.280  -6.770
   71    HG3  LYS  13           2HG      LYS  13  -2.683  -2.832  -6.878
   72    HD2  LYS  13           1HD      LYS  13  -2.282  -3.682  -9.238
   73    HD3  LYS  13           2HD      LYS  13  -0.594  -3.095  -9.173
   74    HE2  LYS  13           1HE      LYS  13  -1.747  -5.197  -7.237
   75    HE3  LYS  13           2HE      LYS  13  -0.755  -5.578  -8.645
   76    HZ1  LYS  13           3HZ      LYS  13   0.002  -4.083  -6.204
   77    HZ2  LYS  13           1HZ      LYS  13   0.905  -3.951  -7.637
   78    HZ3  LYS  13           2HZ      LYS  13   0.731  -5.460  -6.880
   79    H    LYS  14           H        LYS  14  -4.590   0.845  -8.310
   80    HA   LYS  14           HA       LYS  14  -3.451   3.017  -9.673
   81    HB2  LYS  14           1HB      LYS  14  -5.661   1.915 -10.307
   82    HB3  LYS  14           2HB      LYS  14  -6.418   2.660  -8.883
   83    HG2  LYS  14           1HG      LYS  14  -5.916   4.982  -9.783
   84    HG3  LYS  14           2HG      LYS  14  -5.087   4.263 -11.188
   85    HD2  LYS  14           1HD      LYS  14  -7.277   3.205 -11.939
   86    HD3  LYS  14           2HD      LYS  14  -8.107   3.938 -10.538
   87    HE2  LYS  14           1HE      LYS  14  -6.650   5.575 -12.734
   88    HE3  LYS  14           2HE      LYS  14  -8.401   5.333 -12.654
   89    HZ1  LYS  14           3HZ      LYS  14  -8.361   6.324 -10.412
   90    HZ2  LYS  14           1HZ      LYS  14  -7.843   7.395 -11.616
   91    HZ3  LYS  14           2HZ      LYS  14  -6.707   6.652 -10.603
   92    H    MET  15           H        MET  15  -5.169   2.824  -6.543
   93    HA   MET  15           HA       MET  15  -5.176   5.648  -6.007
   94    HB2  MET  15           1HB      MET  15  -6.670   3.834  -4.864
   95    HB3  MET  15           2HB      MET  15  -5.246   3.362  -3.917
   96    HG2  MET  15           1HG      MET  15  -6.564   4.942  -2.523
   97    HG3  MET  15           2HG      MET  15  -5.130   5.830  -3.051
   98    HE1  MET  15           3HE      MET  15  -7.954   8.566  -3.091
   99    HE2  MET  15           1HE      MET  15  -6.357   8.111  -2.480
  100    HE3  MET  15           2HE      MET  15  -7.791   7.226  -1.969
  101    H    MET  16           H        MET  16  -2.945   3.009  -5.053
  102    HA   MET  16           HA       MET  16  -1.189   4.452  -3.332
  103    HB2  MET  16           1HB      MET  16  -0.827   1.944  -5.055
  104    HB3  MET  16           2HB      MET  16   0.453   2.497  -3.977
  105    HG2  MET  16           1HG      MET  16  -2.381   1.786  -2.996
  106    HG3  MET  16           2HG      MET  16  -1.029   0.662  -2.965
  107    HE1  MET  16           3HE      MET  16   0.351   0.398  -0.740
  108    HE2  MET  16           1HE      MET  16   1.196   1.820  -0.123
  109    HE3  MET  16           2HE      MET  16   1.323   1.382  -1.819
  110    H    GLU  17           H        GLU  17  -0.935   3.876  -6.859
  111    HA   GLU  17           HA       GLU  17   1.639   5.174  -7.168
  112    HB2  GLU  17           1HB      GLU  17   1.397   4.778  -9.555
  113    HB3  GLU  17           2HB      GLU  17   0.615   3.393  -8.764
  114    HG2  GLU  17           1HG      GLU  17  -1.616   4.597  -9.085
  115    HG3  GLU  17           2HG      GLU  17  -0.802   5.825 -10.008
  116    H    GLU  18           H        GLU  18  -1.739   6.246  -7.163
  117    HA   GLU  18           HA       GLU  18  -1.161   9.011  -8.127
  118    HB2  GLU  18           1HB      GLU  18  -3.774   7.598  -7.266
  119    HB3  GLU  18           2HB      GLU  18  -3.723   9.306  -7.756
  120    HG2  GLU  18           1HG      GLU  18  -2.885   8.629 -10.049
  121    HG3  GLU  18           2HG      GLU  18  -2.894   6.947  -9.564
  122    H    ALA  19           H        ALA  19  -1.419   7.309  -5.077
  123    HA   ALA  19           HA       ALA  19  -2.076   9.712  -3.478
  124    HB1  ALA  19           1HB      ALA  19  -2.042   8.070  -1.523
  125    HB2  ALA  19           2HB      ALA  19  -1.597   6.796  -2.657
  126    HB3  ALA  19           3HB      ALA  19  -3.152   7.586  -2.816
  127    H    LYS  20           H        LYS  20   0.659   8.677  -5.011
  128    HA   LYS  20           HA       LYS  20   2.816   8.110  -3.706
  129    HB2  LYS  20           1HB      LYS  20   2.505  10.647  -5.423
  130    HB3  LYS  20           2HB      LYS  20   4.101  10.154  -4.839
  131    HG2  LYS  20           1HG      LYS  20   2.426   8.034  -6.254
  132    HG3  LYS  20           2HG      LYS  20   3.119   9.277  -7.280
  133    HD2  LYS  20           1HD      LYS  20   4.879   7.677  -5.316
  134    HD3  LYS  20           2HD      LYS  20   4.503   7.043  -6.920
  135    HE2  LYS  20           1HE      LYS  20   5.659   8.891  -8.038
  136    HE3  LYS  20           2HE      LYS  20   5.808   9.811  -6.538
  137    HZ1  LYS  20           3HZ      LYS  20   7.876   8.743  -6.982
  138    HZ2  LYS  20           1HZ      LYS  20   7.138   7.225  -7.171
  139    HZ3  LYS  20           2HZ      LYS  20   7.182   7.969  -5.642
  140    H    PHE  21           H        PHE  21   3.504   8.383  -1.709
  141    HA   PHE  21           HA       PHE  21   3.298  11.009  -0.336
  142    HB2  PHE  21           1HB      PHE  21   2.490   9.774   1.706
  143    HB3  PHE  21           2HB      PHE  21   1.375   9.567   0.354
  144    HD1  PHE  21           2HD      PHE  21   1.381   7.322  -1.009
  145    HD2  PHE  21           1HD      PHE  21   3.688   7.779   2.635
  146    HE1  PHE  21           2HE      PHE  21   1.623   4.854  -0.851
  147    HE2  PHE  21           1HE      PHE  21   3.934   5.313   2.778
  148    HZ   PHE  21           HZ       PHE  21   2.896   3.840   1.036
  149    H    ASN  22           H        ASN  22   4.642  10.834   1.771
  150    HA   ASN  22           HA       ASN  22   7.294  10.629   1.244
  151    HB2  ASN  22           1HB      ASN  22   5.846  10.193   3.873
  152    HB3  ASN  22           2HB      ASN  22   7.597  10.433   3.788
  153   HD21  ASN  22          1HD2      ASN  22   4.502  11.997   2.728
  154   HD22  ASN  22          2HD2      ASN  22   5.078  13.589   2.868
  155    HA   PRO  23           HA       PRO  23   7.681   5.988   0.720
  156    HB2  PRO  23           1HB      PRO  23  10.375   5.824   0.107
  157    HB3  PRO  23           2HB      PRO  23   9.167   6.429  -1.064
  158    HG2  PRO  23           1HG      PRO  23  11.044   8.006   0.714
  159    HG3  PRO  23           2HG      PRO  23  10.654   8.254  -1.004
  160    HD2  PRO  23           1HD      PRO  23   9.478   9.753   0.980
  161    HD3  PRO  23           2HD      PRO  23   8.599   9.347  -0.527
  162    H    ARG  24           H        ARG  24   9.295   7.948   3.090
  163    HA   ARG  24           HA       ARG  24  10.429   5.668   4.605
  164    HB2  ARG  24           1HB      ARG  24  10.422   8.712   5.129
  165    HB3  ARG  24           2HB      ARG  24  11.310   7.530   6.135
  166    HG2  ARG  24           1HG      ARG  24  12.740   6.871   4.158
  167    HG3  ARG  24           2HG      ARG  24  11.820   7.960   3.099
  168    HD2  ARG  24           1HD      ARG  24  13.954   9.054   3.789
  169    HD3  ARG  24           2HD      ARG  24  12.577   9.950   4.481
  170    HE   ARG  24           HE       ARG  24  13.466   7.904   6.302
  171   HH11  ARG  24          1HH2      ARG  24  14.386  11.037   5.056
  172   HH12  ARG  24          2HH2      ARG  24  15.280  11.477   6.472
  173   HH21  ARG  24          1HH1      ARG  24  14.615   8.506   8.142
  174   HH22  ARG  24          2HH1      ARG  24  15.409  10.043   8.217
  175    H    ALA  25           H        ALA  25   7.415   7.069   4.369
  176    HA   ALA  25           HA       ALA  25   6.612   6.996   7.179
  177    HB1  ALA  25           1HB      ALA  25   5.341   8.369   5.506
  178    HB2  ALA  25           2HB      ALA  25   4.269   7.168   6.223
  179    HB3  ALA  25           3HB      ALA  25   4.929   6.923   4.602
  180    H    THR  26           H        THR  26   5.301   5.357   8.105
  181    HA   THR  26           HA       THR  26   5.898   2.600   7.162
  182    HB   THR  26           HB       THR  26   5.202   1.948   9.472
  183    HG1  THR  26           1HG      THR  26   4.109   3.265  10.688
  184   HG21  THR  26          3HG2      THR  26   7.593   2.854   9.167
  185   HG22  THR  26          1HG2      THR  26   6.944   3.125  10.790
  186   HG23  THR  26          2HG2      THR  26   6.998   4.457   9.639
  187    H    PHE  27           H        PHE  27   4.077   1.023   7.527
  188    HA   PHE  27           HA       PHE  27   1.830   1.644   5.881
  189    HB2  PHE  27           1HB      PHE  27   2.681  -0.686   6.170
  190    HB3  PHE  27           2HB      PHE  27   2.290  -0.646   7.885
  191    HD1  PHE  27           1HD      PHE  27   0.661  -0.153   4.492
  192    HD2  PHE  27           2HD      PHE  27   0.039  -1.432   8.593
  193    HE1  PHE  27           1HE      PHE  27  -1.657  -0.776   3.945
  194    HE2  PHE  27           2HE      PHE  27  -2.286  -2.075   8.026
  195    HZ   PHE  27           HZ       PHE  27  -3.140  -1.761   5.704
  196    H    SER  28           H        SER  28   2.138   1.442   9.450
  197    HA   SER  28           HA       SER  28  -0.606   1.807  10.178
  198    HB2  SER  28           1HB      SER  28   0.351   2.522  12.396
  199    HB3  SER  28           2HB      SER  28   1.246   1.129  11.773
  200    HG   SER  28           HG       SER  28   2.899   2.411  12.050
  201    H    GLU  29           H        GLU  29   1.917   4.211   9.358
  202    HA   GLU  29           HA       GLU  29   0.303   6.557  10.012
  203    HB2  GLU  29           1HB      GLU  29   2.877   6.178   8.343
  204    HB3  GLU  29           2HB      GLU  29   2.174   7.780   8.666
  205    HG2  GLU  29           1HG      GLU  29   3.120   5.810  10.871
  206    HG3  GLU  29           2HG      GLU  29   4.061   7.191  10.296
  207    H    PHE  30           H        PHE  30   1.109   4.814   6.960
  208    HA   PHE  30           HA       PHE  30  -0.333   6.561   5.170
  209    HB2  PHE  30           1HB      PHE  30   1.473   4.984   4.397
  210    HB3  PHE  30           2HB      PHE  30   0.497   3.599   4.897
  211    HD1  PHE  30           1HD      PHE  30   0.440   6.630   2.619
  212    HD2  PHE  30           2HD      PHE  30  -1.252   2.685   3.356
  213    HE1  PHE  30           1HE      PHE  30  -0.864   6.775   0.510
  214    HE2  PHE  30           2HE      PHE  30  -2.529   2.850   1.235
  215    HZ   PHE  30           HZ       PHE  30  -2.345   4.897  -0.191
  216    H    ALA  31           H        ALA  31  -1.190   3.454   6.790
  217    HA   ALA  31           HA       ALA  31  -3.811   3.132   5.673
  218    HB1  ALA  31           1HB      ALA  31  -4.073   1.417   7.525
  219    HB2  ALA  31           2HB      ALA  31  -2.605   2.031   8.290
  220    HB3  ALA  31           3HB      ALA  31  -2.513   1.256   6.717
  221    H    ALA  32           H        ALA  32  -2.626   4.661   8.677
  222    HA   ALA  32           HA       ALA  32  -5.150   5.267   9.931
  223    HB1  ALA  32           1HB      ALA  32  -3.009   5.529  11.176
  224    HB2  ALA  32           2HB      ALA  32  -3.805   7.101  11.105
  225    HB3  ALA  32           3HB      ALA  32  -2.442   6.746  10.026
  226    H    LYS  33           H        LYS  33  -3.256   6.962   7.423
  227    HA   LYS  33           HA       LYS  33  -4.960   9.307   7.347
  228    HB2  LYS  33           1HB      LYS  33  -2.443   9.086   6.517
  229    HB3  LYS  33           2HB      LYS  33  -3.122   8.378   5.058
  230    HG2  LYS  33           1HG      LYS  33  -2.963  10.710   4.433
  231    HG3  LYS  33           2HG      LYS  33  -4.655  10.601   4.957
  232    HD2  LYS  33           1HD      LYS  33  -3.902  11.419   7.312
  233    HD3  LYS  33           2HD      LYS  33  -2.269  11.624   6.668
  234    HE2  LYS  33           1HE      LYS  33  -3.149  13.326   5.018
  235    HE3  LYS  33           2HE      LYS  33  -4.782  13.130   5.708
  236    HZ1  LYS  33           3HZ      LYS  33  -2.733  14.769   6.651
  237    HZ2  LYS  33           1HZ      LYS  33  -2.900  13.526   7.795
  238    HZ3  LYS  33           2HZ      LYS  33  -4.244  14.482   7.371
  239    H    HIS  34           H        HIS  34  -4.712   6.334   5.348
  240    HA   HIS  34           HA       HIS  34  -7.045   7.135   3.694
  241    HB2  HIS  34           1HB      HIS  34  -5.046   4.797   3.502
  242    HB3  HIS  34           2HB      HIS  34  -6.387   5.025   2.361
  243    HD2  HIS  34           2HD      HIS  34  -5.639   6.708   0.208
  244    HE1  HIS  34           1HE      HIS  34  -2.375   8.614   2.070
  245    HE2  HIS  34           2HE      HIS  34  -3.725   8.452  -0.073
  246    H    ALA  35           H        ALA  35  -6.653   5.678   6.659
  247    HA   ALA  35           HA       ALA  35  -8.031   3.267   6.722
  248    HB1  ALA  35           1HB      ALA  35  -8.833   4.090   9.129
  249    HB2  ALA  35           2HB      ALA  35  -7.913   5.552   8.768
  250    HB3  ALA  35           3HB      ALA  35  -7.097   4.000   8.844
  251    H    LYS  36           H        LYS  36  -9.403   6.560   6.534
  252    HA   LYS  36           HA       LYS  36 -12.129   5.703   6.868
  253    HB2  LYS  36           1HB      LYS  36 -10.907   8.368   5.848
  254    HB3  LYS  36           2HB      LYS  36 -12.619   8.156   6.299
  255    HG2  LYS  36           1HG      LYS  36 -11.887   7.607   8.700
  256    HG3  LYS  36           2HG      LYS  36 -10.202   7.855   8.218
  257    HD2  LYS  36           1HD      LYS  36 -10.778   9.975   9.220
  258    HD3  LYS  36           2HD      LYS  36 -10.939  10.316   7.487
  259    HE2  LYS  36           1HE      LYS  36 -12.908  11.250   8.716
  260    HE3  LYS  36           2HE      LYS  36 -13.475   9.904   7.729
  261    HZ1  LYS  36           3HZ      LYS  36 -14.066  10.092  10.248
  262    HZ2  LYS  36           1HZ      LYS  36 -12.558   9.347  10.455
  263    HZ3  LYS  36           2HZ      LYS  36 -13.770   8.581   9.537
  264    H    ASP  37           H        ASP  37  -9.959   5.593   4.216
  265    HA   ASP  37           HA       ASP  37 -11.765   6.165   2.043
  266    HB2  ASP  37           1HB      ASP  37  -9.203   4.440   2.068
  267    HB3  ASP  37           2HB      ASP  37 -10.034   4.984   0.625
  268    H    SER  38           H        SER  38 -13.044   4.760   0.880
  269    HA   SER  38           HA       SER  38 -14.234   2.535   2.196
  270    HB2  SER  38           1HB      SER  38 -15.472   4.018   0.648
  271    HB3  SER  38           2HB      SER  38 -14.463   3.483  -0.700
  272    HG   SER  38           HG       SER  38 -15.261   1.375  -0.340
  273    H    ARG  39           H        ARG  39 -11.743   2.824  -0.243
  274    HA   ARG  39           HA       ARG  39 -11.616   0.091  -1.196
  275    HB2  ARG  39           1HB      ARG  39  -9.489   2.343  -1.126
  276    HB3  ARG  39           2HB      ARG  39  -9.277   0.799  -2.009
  277    HG2  ARG  39           1HG      ARG  39 -11.338   1.343  -3.426
  278    HG3  ARG  39           2HG      ARG  39 -11.512   2.889  -2.560
  279    HD2  ARG  39           1HD      ARG  39  -9.207   3.596  -3.423
  280    HD3  ARG  39           2HD      ARG  39  -9.117   2.064  -4.321
  281    HE   ARG  39           HE       ARG  39 -10.659   2.873  -5.857
  282   HH11  ARG  39          1HH2      ARG  39 -10.706   4.955  -3.035
  283   HH12  ARG  39          2HH2      ARG  39 -11.659   6.181  -3.797
  284   HH21  ARG  39          1HH1      ARG  39 -11.933   4.487  -6.810
  285   HH22  ARG  39          2HH1      ARG  39 -12.349   5.914  -5.924
  286    H    PHE  40           H        PHE  40 -10.430   1.702   1.662
  287    HA   PHE  40           HA       PHE  40  -8.289  -0.121   2.265
  288    HB2  PHE  40           1HB      PHE  40  -8.487   2.233   3.250
  289    HB3  PHE  40           2HB      PHE  40  -9.867   1.693   4.216
  290    HD1  PHE  40           2HD      PHE  40  -6.183   1.188   3.643
  291    HD2  PHE  40           1HD      PHE  40  -9.533   0.247   6.262
  292    HE1  PHE  40           2HE      PHE  40  -4.643   0.198   5.283
  293    HE2  PHE  40           1HE      PHE  40  -7.957  -0.764   7.892
  294    HZ   PHE  40           HZ       PHE  40  -5.503  -0.798   7.408
  295    H    LYS  41           H        LYS  41 -11.597   0.204   3.608
  296    HA   LYS  41           HA       LYS  41 -11.515  -2.215   5.233
  297    HB2  LYS  41           1HB      LYS  41 -13.816  -1.665   5.889
  298    HB3  LYS  41           2HB      LYS  41 -12.974  -0.105   5.735
  299    HG2  LYS  41           1HG      LYS  41 -13.973   0.203   3.413
  300    HG3  LYS  41           2HG      LYS  41 -14.814  -1.344   3.555
  301    HD2  LYS  41           1HD      LYS  41 -16.055  -0.364   5.638
  302    HD3  LYS  41           2HD      LYS  41 -15.361   1.219   5.192
  303    HE2  LYS  41           1HE      LYS  41 -17.222  -0.501   3.397
  304    HE3  LYS  41           2HE      LYS  41 -17.668   1.009   4.201
  305    HZ1  LYS  41           3HZ      LYS  41 -17.090   1.302   1.865
  306    HZ2  LYS  41           1HZ      LYS  41 -15.520   0.738   2.170
  307    HZ3  LYS  41           2HZ      LYS  41 -16.062   2.182   2.889
  308    H    ALA  42           H        ALA  42 -12.101  -1.599   1.856
  309    HA   ALA  42           HA       ALA  42 -14.029  -3.660   1.208
  310    HB1  ALA  42           1HB      ALA  42 -11.798  -2.413  -0.525
  311    HB2  ALA  42           2HB      ALA  42 -13.413  -1.735  -0.348
  312    HB3  ALA  42           3HB      ALA  42 -13.204  -3.291  -1.147
  313    H    ILE  43           H        ILE  43 -10.516  -3.652   1.584
  314    HA   ILE  43           HA       ILE  43 -10.265  -6.512   0.787
  315    HB   ILE  43           HB       ILE  43  -8.202  -4.498   1.997
  316   HG12  ILE  43          1HG1      ILE  43  -8.475  -5.425  -0.970
  317   HG13  ILE  43          2HG1      ILE  43  -9.107  -3.895  -0.377
  318   HG21  ILE  43          1HG2      ILE  43  -7.586  -6.948   2.380
  319   HG22  ILE  43          2HG2      ILE  43  -6.481  -6.253   1.222
  320   HG23  ILE  43          3HG2      ILE  43  -7.784  -7.298   0.671
  321   HD11  ILE  43          3HD1      ILE  43  -6.925  -3.584  -1.447
  322   HD12  ILE  43          1HD1      ILE  43  -6.152  -4.680  -0.311
  323   HD13  ILE  43          2HD1      ILE  43  -6.842  -3.145   0.244
  324    H    GLU  44           H        GLU  44 -10.815  -8.011   2.269
  325    HA   GLU  44           HA       GLU  44 -11.389  -7.467   5.045
  326    HB2  GLU  44           1HB      GLU  44 -12.583  -9.209   3.635
  327    HB3  GLU  44           2HB      GLU  44 -11.084 -10.161   3.538
  328    HG2  GLU  44           1HG      GLU  44 -11.111 -10.477   6.064
  329    HG3  GLU  44           2HG      GLU  44 -12.575  -9.489   6.183
  330    H    LYS  45           H        LYS  45  -8.783  -9.200   3.263
  331    HA   LYS  45           HA       LYS  45  -7.278  -9.926   5.649
  332    HB2  LYS  45           1HB      LYS  45  -6.542 -10.109   2.644
  333    HB3  LYS  45           2HB      LYS  45  -5.578 -10.801   3.974
  334    HG2  LYS  45           1HG      LYS  45  -7.551 -12.292   4.637
  335    HG3  LYS  45           2HG      LYS  45  -8.503 -11.588   3.310
  336    HD2  LYS  45           1HD      LYS  45  -7.650 -13.729   2.445
  337    HD3  LYS  45           2HD      LYS  45  -6.683 -12.488   1.642
  338    HE2  LYS  45           1HE      LYS  45  -4.799 -12.911   3.277
  339    HE3  LYS  45           2HE      LYS  45  -5.789 -14.113   4.123
  340    HZ1  LYS  45           3HZ      LYS  45  -5.484 -15.617   2.495
  341    HZ2  LYS  45           1HZ      LYS  45  -4.109 -14.690   2.138
  342    HZ3  LYS  45           2HZ      LYS  45  -5.534 -14.468   1.239
  343    H    MET  46           H        MET  46  -6.352  -8.351   6.733
  344    HA   MET  46           HA       MET  46  -5.277  -5.901   5.746
  345    HB2  MET  46           1HB      MET  46  -4.454  -5.645   8.125
  346    HB3  MET  46           2HB      MET  46  -6.160  -6.112   8.060
  347    HG2  MET  46           1HG      MET  46  -5.548  -8.531   8.498
  348    HG3  MET  46           2HG      MET  46  -3.836  -8.099   8.554
  349    HE1  MET  46           3HE      MET  46  -3.118  -5.877  10.194
  350    HE2  MET  46           1HE      MET  46  -2.635  -7.451  10.831
  351    HE3  MET  46           2HE      MET  46  -3.362  -6.254  11.891
  352    H    LYS  47           H        LYS  47  -4.014  -9.097   6.142
  353    HA   LYS  47           HA       LYS  47  -1.215  -8.612   6.171
  354    HB2  LYS  47           1HB      LYS  47  -2.855 -11.023   5.148
  355    HB3  LYS  47           2HB      LYS  47  -1.095 -11.081   5.373
  356    HG2  LYS  47           1HG      LYS  47  -3.116 -10.519   7.670
  357    HG3  LYS  47           2HG      LYS  47  -2.418 -12.125   7.327
  358    HD2  LYS  47           1HD      LYS  47  -0.080 -11.225   7.769
  359    HD3  LYS  47           2HD      LYS  47  -0.739  -9.627   8.101
  360    HE2  LYS  47           1HE      LYS  47  -1.994 -10.504  10.075
  361    HE3  LYS  47           2HE      LYS  47  -1.365 -12.138   9.749
  362    HZ1  LYS  47           3HZ      LYS  47   0.881 -10.588   9.741
  363    HZ2  LYS  47           1HZ      LYS  47   0.332 -11.516  11.053
  364    HZ3  LYS  47           2HZ      LYS  47  -0.057  -9.866  10.966
  365    H    ASP  48           H        ASP  48  -3.527  -8.992   3.504
  366    HA   ASP  48           HA       ASP  48  -1.585  -9.103   1.386
  367    HB2  ASP  48           1HB      ASP  48  -3.986  -9.858   1.101
  368    HB3  ASP  48           2HB      ASP  48  -4.547  -8.204   1.358
  369    H    ARG  49           H        ARG  49  -3.272  -6.428   3.069
  370    HA   ARG  49           HA       ARG  49  -2.411  -4.323   1.266
  371    HB2  ARG  49           1HB      ARG  49  -3.263  -4.164   4.233
  372    HB3  ARG  49           2HB      ARG  49  -2.890  -2.757   3.238
  373    HG2  ARG  49           1HG      ARG  49  -4.745  -3.592   1.584
  374    HG3  ARG  49           2HG      ARG  49  -5.212  -4.736   2.862
  375    HD2  ARG  49           1HD      ARG  49  -5.148  -1.660   3.187
  376    HD3  ARG  49           2HD      ARG  49  -6.612  -2.613   2.934
  377    HE   ARG  49           HE       ARG  49  -5.016  -2.413   5.393
  378   HH11  ARG  49          1HH2      ARG  49  -7.496  -4.244   3.728
  379   HH12  ARG  49          2HH2      ARG  49  -8.178  -4.874   5.180
  380   HH21  ARG  49          1HH1      ARG  49  -5.892  -3.303   7.256
  381   HH22  ARG  49          2HH1      ARG  49  -7.271  -4.348   7.166
  382    H    GLU  50           H        GLU  50  -1.017  -5.735   4.267
  383    HA   GLU  50           HA       GLU  50   1.191  -3.928   4.524
  384    HB2  GLU  50           1HB      GLU  50   0.362  -5.476   6.378
  385    HB3  GLU  50           2HB      GLU  50   1.009  -6.875   5.484
  386    HG2  GLU  50           1HG      GLU  50   3.359  -5.890   5.661
  387    HG3  GLU  50           2HG      GLU  50   2.719  -4.489   6.526
  388    H    ALA  51           H        ALA  51   0.816  -7.116   2.864
  389    HA   ALA  51           HA       ALA  51   3.493  -7.525   1.988
  390    HB1  ALA  51           1HB      ALA  51   2.430  -9.074   0.296
  391    HB2  ALA  51           2HB      ALA  51   0.842  -8.371   0.656
  392    HB3  ALA  51           3HB      ALA  51   1.702  -9.282   1.899
  393    H    LEU  52           H        LEU  52   0.714  -5.908   0.349
  394    HA   LEU  52           HA       LEU  52   2.006  -5.169  -2.088
  395    HB2  LEU  52           1HB      LEU  52  -0.438  -4.076  -0.598
  396    HB3  LEU  52           2HB      LEU  52   0.012  -3.473  -2.195
  397    HG   LEU  52           HG       LEU  52  -0.524  -6.487  -1.691
  398   HD11  LEU  52          1HD1      LEU  52  -2.635  -5.323  -1.143
  399   HD12  LEU  52          2HD1      LEU  52  -2.816  -6.093  -2.711
  400   HD13  LEU  52          3HD1      LEU  52  -2.542  -4.362  -2.613
  401   HD21  LEU  52          3HD2      LEU  52  -0.853  -6.499  -4.198
  402   HD22  LEU  52          1HD2      LEU  52   0.752  -6.001  -3.780
  403   HD23  LEU  52          2HD2      LEU  52  -0.432  -4.802  -4.289
  404    H    PHE  53           H        PHE  53   1.546  -3.440   0.989
  405    HA   PHE  53           HA       PHE  53   2.648  -0.907   0.268
  406    HB2  PHE  53           1HB      PHE  53   1.432  -1.104   2.358
  407    HB3  PHE  53           2HB      PHE  53   2.438  -2.428   2.914
  408    HD1  PHE  53           2HD      PHE  53   2.651   1.226   1.944
  409    HD2  PHE  53           1HD      PHE  53   4.473  -1.974   4.258
  410    HE1  PHE  53           2HE      PHE  53   4.301   2.811   2.908
  411    HE2  PHE  53           1HE      PHE  53   6.106  -0.364   5.187
  412    HZ   PHE  53           HZ       PHE  53   6.023   2.021   4.509
  413    H    ASN  54           H        ASN  54   4.210  -3.794   1.740
  414    HA   ASN  54           HA       ASN  54   6.872  -2.742   1.901
  415    HB2  ASN  54           1HB      ASN  54   5.859  -5.649   1.638
  416    HB3  ASN  54           2HB      ASN  54   7.544  -5.235   2.006
  417   HD21  ASN  54          1HD2      ASN  54   5.296  -6.592   3.682
  418   HD22  ASN  54          2HD2      ASN  54   5.323  -5.730   5.147
  419    H    GLU  55           H        GLU  55   5.166  -4.604  -0.650
  420    HA   GLU  55           HA       GLU  55   7.411  -4.845  -2.440
  421    HB2  GLU  55           1HB      GLU  55   4.973  -6.123  -2.366
  422    HB3  GLU  55           2HB      GLU  55   4.555  -4.900  -3.579
  423    HG2  GLU  55           1HG      GLU  55   6.897  -6.936  -3.769
  424    HG3  GLU  55           2HG      GLU  55   5.405  -6.983  -4.711
  425    H    PHE  56           H        PHE  56   4.706  -2.499  -2.147
  426    HA   PHE  56           HA       PHE  56   5.108  -1.050  -4.546
  427    HB2  PHE  56           1HB      PHE  56   3.031  -0.828  -3.136
  428    HB3  PHE  56           2HB      PHE  56   3.972  -0.103  -1.824
  429    HD1  PHE  56           2HD      PHE  56   2.956   0.392  -5.446
  430    HD2  PHE  56           1HD      PHE  56   4.510   2.358  -1.883
  431    HE1  PHE  56           2HE      PHE  56   2.794   2.597  -6.572
  432    HE2  PHE  56           1HE      PHE  56   4.347   4.551  -3.037
  433    HZ   PHE  56           HZ       PHE  56   3.496   4.678  -5.381
  434    H    VAL  57           H        VAL  57   6.350  -0.426  -1.191
  435    HA   VAL  57           HA       VAL  57   7.897   1.931  -1.793
  436    HB   VAL  57           HB       VAL  57   8.121  -0.188   0.470
  437   HG11  VAL  57          1HG1      VAL  57  10.344   0.889   0.430
  438   HG12  VAL  57          2HG1      VAL  57   9.462   1.704   1.711
  439   HG13  VAL  57          3HG1      VAL  57   9.654   2.493   0.148
  440   HG21  VAL  57          3HG2      VAL  57   5.980   1.201   0.444
  441   HG22  VAL  57          1HG2      VAL  57   6.927   2.688   0.491
  442   HG23  VAL  57          2HG2      VAL  57   6.959   1.570   1.852
  443    H    ALA  58           H        ALA  58   8.777  -1.572  -1.619
  444    HA   ALA  58           HA       ALA  58  11.568  -1.242  -2.147
  445    HB1  ALA  58           1HB      ALA  58  10.572  -3.333  -1.149
  446    HB2  ALA  58           2HB      ALA  58  11.508  -3.739  -2.595
  447    HB3  ALA  58           3HB      ALA  58   9.736  -3.676  -2.668
  448    H    ALA  59           H        ALA  59   8.734  -1.758  -4.309
  449    HA   ALA  59           HA       ALA  59  10.255  -2.006  -6.781
  450    HB1  ALA  59           1HB      ALA  59   7.979  -3.021  -6.483
  451    HB2  ALA  59           2HB      ALA  59   7.952  -1.879  -7.829
  452    HB3  ALA  59           3HB      ALA  59   7.268  -1.421  -6.255
  453    H    ALA  60           H        ALA  60   8.400   0.636  -5.156
  454    HA   ALA  60           HA       ALA  60   8.642   2.611  -7.237
  455    HB1  ALA  60           1HB      ALA  60   8.164   2.946  -4.203
  456    HB2  ALA  60           2HB      ALA  60   6.910   2.797  -5.439
  457    HB3  ALA  60           3HB      ALA  60   7.935   4.237  -5.401
  458    H    ARG  61           H        ARG  61  10.578   1.931  -4.251
  459    HA   ARG  61           HA       ARG  61  12.361   4.170  -4.619
  460    HB2  ARG  61           1HB      ARG  61  11.978   3.093  -2.357
  461    HB3  ARG  61           2HB      ARG  61  12.730   1.586  -2.932
  462    HG2  ARG  61           1HG      ARG  61  14.955   2.799  -3.269
  463    HG3  ARG  61           2HG      ARG  61  14.205   4.328  -2.746
  464    HD2  ARG  61           1HD      ARG  61  14.440   1.798  -0.985
  465    HD3  ARG  61           2HD      ARG  61  15.533   3.207  -0.906
  466    HE   ARG  61           HE       ARG  61  12.885   4.179  -0.676
  467   HH11  ARG  61          1HH2      ARG  61  15.100   2.169   1.107
  468   HH12  ARG  61          2HH2      ARG  61  14.436   2.582   2.651
  469   HH21  ARG  61          1HH1      ARG  61  12.023   4.707   1.328
  470   HH22  ARG  61          2HH1      ARG  61  12.689   4.025   2.775
  Start of MODEL   18
    1    H    ILE   5           H        ILE   5 -12.472 -10.762 -11.828
    2    HA   ILE   5           HA       ILE   5 -11.191  -9.923 -13.578
    3    HB   ILE   5           HB       ILE   5 -12.954  -7.395 -13.065
    4   HG12  ILE   5          1HG1      ILE   5 -13.549  -9.689 -15.075
    5   HG13  ILE   5          2HG1      ILE   5 -14.222  -9.673 -13.453
    6   HG21  ILE   5          1HG2      ILE   5 -11.055  -8.114 -15.362
    7   HG22  ILE   5          2HG2      ILE   5 -11.431  -6.538 -14.693
    8   HG23  ILE   5          3HG2      ILE   5 -12.554  -7.302 -15.791
    9   HD11  ILE   5          3HD1      ILE   5 -15.807  -8.734 -15.156
   10   HD12  ILE   5          1HD1      ILE   5 -14.681  -7.412 -15.462
   11   HD13  ILE   5          2HD1      ILE   5 -15.428  -7.593 -13.872
   12    H    MET   6           H        MET   6 -10.261  -9.553 -10.713
   13    HA   MET   6           HA       MET   6  -8.697  -8.374  -9.386
   14    HB2  MET   6           1HB      MET   6  -7.532  -7.933 -12.220
   15    HB3  MET   6           2HB      MET   6  -6.609  -7.708 -10.725
   16    HG2  MET   6           1HG      MET   6  -7.885 -10.398 -11.560
   17    HG3  MET   6           2HG      MET   6  -6.188  -9.977 -11.826
   18    HE1  MET   6           3HE      MET   6  -5.456 -12.154 -10.515
   19    HE2  MET   6           1HE      MET   6  -7.153 -12.556 -10.251
   20    HE3  MET   6           2HE      MET   6  -6.022 -12.582  -8.907
   21    H    GLN   7           H        GLN   7 -11.074  -6.810 -10.623
   22    HA   GLN   7           HA       GLN   7 -10.315  -4.169 -11.330
   23    HB2  GLN   7           1HB      GLN   7 -12.659  -5.176 -11.619
   24    HB3  GLN   7           2HB      GLN   7 -12.916  -5.031  -9.867
   25    HG2  GLN   7           1HG      GLN   7 -12.609  -2.504 -10.037
   26    HG3  GLN   7           2HG      GLN   7 -12.357  -2.655 -11.782
   27   HE21  GLN   7          1HE2      GLN   7 -14.249  -1.726 -12.671
   28   HE22  GLN   7          2HE2      GLN   7 -15.832  -2.160 -12.230
   29    H    ALA   8           H        ALA   8 -11.155  -5.534  -8.125
   30    HA   ALA   8           HA       ALA   8 -10.877  -3.151  -6.567
   31    HB1  ALA   8           1HB      ALA   8 -10.697  -4.760  -4.623
   32    HB2  ALA   8           2HB      ALA   8 -10.464  -6.102  -5.761
   33    HB3  ALA   8           3HB      ALA   8 -12.004  -5.238  -5.718
   34    H    LYS   9           H        LYS   9  -8.562  -5.752  -7.499
   35    HA   LYS   9           HA       LYS   9  -6.353  -4.773  -5.977
   36    HB2  LYS   9           1HB      LYS   9  -6.687  -7.161  -7.140
   37    HB3  LYS   9           2HB      LYS   9  -6.063  -6.383  -8.588
   38    HG2  LYS   9           1HG      LYS   9  -4.044  -7.285  -7.659
   39    HG3  LYS   9           2HG      LYS   9  -4.004  -5.630  -7.016
   40    HD2  LYS   9           1HD      LYS   9  -5.130  -6.522  -4.865
   41    HD3  LYS   9           2HD      LYS   9  -5.005  -8.154  -5.527
   42    HE2  LYS   9           1HE      LYS   9  -2.497  -7.941  -5.585
   43    HE3  LYS   9           2HE      LYS   9  -2.643  -6.308  -4.905
   44    HZ1  LYS   9           3HZ      LYS   9  -2.739  -8.798  -3.548
   45    HZ2  LYS   9           1HZ      LYS   9  -4.198  -7.965  -3.301
   46    HZ3  LYS   9           2HZ      LYS   9  -2.720  -7.230  -2.893
   47    H    GLU  10           H        GLU  10  -7.323  -4.234  -9.354
   48    HA   GLU  10           HA       GLU  10  -5.056  -2.637 -10.152
   49    HB2  GLU  10           1HB      GLU  10  -7.914  -2.984 -11.240
   50    HB3  GLU  10           2HB      GLU  10  -6.751  -1.907 -12.036
   51    HG2  GLU  10           1HG      GLU  10  -6.247  -4.922 -11.571
   52    HG3  GLU  10           2HG      GLU  10  -6.855  -4.252 -13.082
   53    H    ASP  11           H        ASP  11  -8.256  -1.864  -8.789
   54    HA   ASP  11           HA       ASP  11  -8.110   1.018  -8.933
   55    HB2  ASP  11           1HB      ASP  11  -9.659  -0.866  -7.049
   56    HB3  ASP  11           2HB      ASP  11  -9.879   0.890  -7.055
   57    H    PHE  12           H        PHE  12  -7.004  -1.365  -6.508
   58    HA   PHE  12           HA       PHE  12  -6.179   0.499  -4.460
   59    HB2  PHE  12           1HB      PHE  12  -6.475  -2.040  -4.140
   60    HB3  PHE  12           2HB      PHE  12  -4.998  -2.284  -5.066
   61    HD1  PHE  12           2HD      PHE  12  -6.348  -0.522  -2.017
   62    HD2  PHE  12           1HD      PHE  12  -2.769  -2.071  -3.932
   63    HE1  PHE  12           2HE      PHE  12  -5.024   0.000   0.015
   64    HE2  PHE  12           1HE      PHE  12  -1.456  -1.533  -1.883
   65    HZ   PHE  12           HZ       PHE  12  -2.578  -0.491   0.094
   66    H    LYS  13           H        LYS  13  -4.330  -1.023  -7.195
   67    HA   LYS  13           HA       LYS  13  -1.806   0.184  -6.700
   68    HB2  LYS  13           1HB      LYS  13  -3.155  -0.904  -9.239
   69    HB3  LYS  13           2HB      LYS  13  -1.467  -0.399  -9.241
   70    HG2  LYS  13           1HG      LYS  13  -2.532  -2.535  -7.293
   71    HG3  LYS  13           2HG      LYS  13  -1.915  -2.951  -8.912
   72    HD2  LYS  13           1HD      LYS  13   0.329  -1.950  -8.358
   73    HD3  LYS  13           2HD      LYS  13  -0.251  -1.459  -6.767
   74    HE2  LYS  13           1HE      LYS  13  -0.590  -3.821  -6.125
   75    HE3  LYS  13           2HE      LYS  13  -0.051  -4.367  -7.726
   76    HZ1  LYS  13           3HZ      LYS  13   1.543  -3.038  -5.588
   77    HZ2  LYS  13           1HZ      LYS  13   2.053  -2.978  -7.209
   78    HZ3  LYS  13           2HZ      LYS  13   1.876  -4.479  -6.428
   79    H    LYS  14           H        LYS  14  -4.501   1.196  -8.718
   80    HA   LYS  14           HA       LYS  14  -3.345   3.496  -9.911
   81    HB2  LYS  14           1HB      LYS  14  -6.245   2.751  -9.287
   82    HB3  LYS  14           2HB      LYS  14  -5.822   4.227 -10.186
   83    HG2  LYS  14           1HG      LYS  14  -4.668   2.845 -11.958
   84    HG3  LYS  14           2HG      LYS  14  -5.046   1.363 -11.073
   85    HD2  LYS  14           1HD      LYS  14  -7.527   1.810 -11.357
   86    HD3  LYS  14           2HD      LYS  14  -7.150   3.307 -12.233
   87    HE2  LYS  14           1HE      LYS  14  -5.984   1.969 -14.026
   88    HE3  LYS  14           2HE      LYS  14  -6.376   0.467 -13.149
   89    HZ1  LYS  14           3HZ      LYS  14  -7.948   1.673 -15.002
   90    HZ2  LYS  14           1HZ      LYS  14  -8.650   2.189 -13.547
   91    HZ3  LYS  14           2HZ      LYS  14  -8.469   0.527 -13.864
   92    H    MET  15           H        MET  15  -5.084   3.026  -6.842
   93    HA   MET  15           HA       MET  15  -5.160   5.807  -6.145
   94    HB2  MET  15           1HB      MET  15  -6.665   3.974  -5.138
   95    HB3  MET  15           2HB      MET  15  -5.254   3.359  -4.254
   96    HG2  MET  15           1HG      MET  15  -6.517   4.837  -2.711
   97    HG3  MET  15           2HG      MET  15  -5.032   5.685  -3.135
   98    HE1  MET  15           3HE      MET  15  -7.496   8.692  -2.960
   99    HE2  MET  15           1HE      MET  15  -5.850   8.135  -2.625
  100    HE3  MET  15           2HE      MET  15  -7.232   7.330  -1.888
  101    H    MET  16           H        MET  16  -2.921   3.128  -5.250
  102    HA   MET  16           HA       MET  16  -1.220   4.523  -3.437
  103    HB2  MET  16           1HB      MET  16  -0.798   2.050  -5.212
  104    HB3  MET  16           2HB      MET  16   0.443   2.584  -4.076
  105    HG2  MET  16           1HG      MET  16  -2.415   1.843  -3.218
  106    HG3  MET  16           2HG      MET  16  -1.053   0.731  -3.153
  107    HE1  MET  16           3HE      MET  16   1.041   1.834  -0.199
  108    HE2  MET  16           1HE      MET  16   1.248   1.448  -1.911
  109    HE3  MET  16           2HE      MET  16   0.239   0.431  -0.886
  110    H    GLU  17           H        GLU  17  -0.822   4.054  -6.967
  111    HA   GLU  17           HA       GLU  17   1.760   5.343  -7.104
  112    HB2  GLU  17           1HB      GLU  17   1.557   5.078  -9.529
  113    HB3  GLU  17           2HB      GLU  17   0.842   3.631  -8.789
  114    HG2  GLU  17           1HG      GLU  17  -1.438   4.794  -9.041
  115    HG3  GLU  17           2HG      GLU  17  -0.647   6.031  -9.989
  116    H    GLU  18           H        GLU  18  -1.641   6.422  -7.492
  117    HA   GLU  18           HA       GLU  18  -1.015   9.182  -8.278
  118    HB2  GLU  18           1HB      GLU  18  -3.660   7.804  -7.447
  119    HB3  GLU  18           2HB      GLU  18  -3.574   9.496  -7.958
  120    HG2  GLU  18           1HG      GLU  18  -2.744   8.801 -10.217
  121    HG3  GLU  18           2HG      GLU  18  -2.746   7.125  -9.731
  122    H    ALA  19           H        ALA  19  -1.420   7.456  -5.242
  123    HA   ALA  19           HA       ALA  19  -2.073   9.857  -3.644
  124    HB1  ALA  19           1HB      ALA  19  -3.157   7.727  -2.982
  125    HB2  ALA  19           2HB      ALA  19  -2.054   8.205  -1.697
  126    HB3  ALA  19           3HB      ALA  19  -1.596   6.932  -2.829
  127    H    LYS  20           H        LYS  20   0.651   8.845  -5.175
  128    HA   LYS  20           HA       LYS  20   2.789   8.206  -3.869
  129    HB2  LYS  20           1HB      LYS  20   2.767   9.521  -6.136
  130    HB3  LYS  20           2HB      LYS  20   2.965  10.984  -5.177
  131    HG2  LYS  20           1HG      LYS  20   5.264  10.517  -5.546
  132    HG3  LYS  20           2HG      LYS  20   5.050   9.559  -4.091
  133    HD2  LYS  20           1HD      LYS  20   6.095   7.934  -5.470
  134    HD3  LYS  20           2HD      LYS  20   4.406   7.573  -5.860
  135    HE2  LYS  20           1HE      LYS  20   5.686   7.739  -7.977
  136    HE3  LYS  20           2HE      LYS  20   4.650   9.175  -7.884
  137    HZ1  LYS  20           3HZ      LYS  20   7.376   9.137  -8.157
  138    HZ2  LYS  20           1HZ      LYS  20   7.132   9.563  -6.535
  139    HZ3  LYS  20           2HZ      LYS  20   6.418  10.482  -7.776
  140    H    PHE  21           H        PHE  21   3.511   8.432  -1.870
  141    HA   PHE  21           HA       PHE  21   3.292  11.029  -0.449
  142    HB2  PHE  21           1HB      PHE  21   2.499   9.779   1.582
  143    HB3  PHE  21           2HB      PHE  21   1.368   9.605   0.238
  144    HD1  PHE  21           2HD      PHE  21   1.328   7.395  -1.136
  145    HD2  PHE  21           1HD      PHE  21   3.693   7.761   2.465
  146    HE1  PHE  21           2HE      PHE  21   1.567   4.925  -1.048
  147    HE2  PHE  21           1HE      PHE  21   3.942   5.283   2.549
  148    HZ   PHE  21           HZ       PHE  21   2.877   3.854   0.784
  149    H    ASN  22           H        ASN  22   4.618  10.820   1.676
  150    HA   ASN  22           HA       ASN  22   7.283  10.619   1.170
  151    HB2  ASN  22           1HB      ASN  22   5.800  10.173   3.778
  152    HB3  ASN  22           2HB      ASN  22   7.550  10.394   3.716
  153   HD21  ASN  22          1HD2      ASN  22   8.160  12.447   2.299
  154   HD22  ASN  22          2HD2      ASN  22   7.250  13.848   2.605
  155    HA   PRO  23           HA       PRO  23   7.684   6.002   0.590
  156    HB2  PRO  23           1HB      PRO  23  10.381   5.846   0.037
  157    HB3  PRO  23           2HB      PRO  23   9.207   6.477  -1.153
  158    HG2  PRO  23           1HG      PRO  23  11.040   8.007   0.714
  159    HG3  PRO  23           2HG      PRO  23  10.701   8.288  -1.019
  160    HD2  PRO  23           1HD      PRO  23   9.456   9.765   0.949
  161    HD3  PRO  23           2HD      PRO  23   8.617   9.366  -0.587
  162    H    ARG  24           H        ARG  24   9.264   7.922   3.034
  163    HA   ARG  24           HA       ARG  24  10.376   5.625   4.531
  164    HB2  ARG  24           1HB      ARG  24  10.345   8.662   5.126
  165    HB3  ARG  24           2HB      ARG  24  11.178   7.462   6.156
  166    HG2  ARG  24           1HG      ARG  24  12.671   6.820   4.218
  167    HG3  ARG  24           2HG      ARG  24  11.834   7.978   3.174
  168    HD2  ARG  24           1HD      ARG  24  12.601   9.876   4.674
  169    HD3  ARG  24           2HD      ARG  24  13.465   8.693   5.680
  170    HE   ARG  24           HE       ARG  24  15.122   8.555   4.056
  171   HH11  ARG  24          1HH2      ARG  24  12.298  10.063   2.610
  172   HH12  ARG  24          2HH2      ARG  24  13.125  10.496   1.150
  173   HH21  ARG  24          1HH1      ARG  24  16.153   9.116   2.128
  174   HH22  ARG  24          2HH1      ARG  24  15.298   9.962   0.884
  175    H    ALA  25           H        ALA  25   7.359   7.058   4.267
  176    HA   ALA  25           HA       ALA  25   6.508   6.924   7.043
  177    HB1  ALA  25           1HB      ALA  25   4.186   7.087   6.062
  178    HB2  ALA  25           2HB      ALA  25   4.869   6.867   4.446
  179    HB3  ALA  25           3HB      ALA  25   5.261   8.305   5.372
  180    H    THR  26           H        THR  26   5.213   5.277   7.949
  181    HA   THR  26           HA       THR  26   5.829   2.540   6.987
  182    HB   THR  26           HB       THR  26   5.164   1.856   9.287
  183    HG1  THR  26           1HG      THR  26   3.564   3.618   9.382
  184   HG21  THR  26          3HG2      THR  26   6.947   4.359   9.462
  185   HG22  THR  26          1HG2      THR  26   7.537   2.763   8.964
  186   HG23  THR  26          2HG2      THR  26   6.915   3.015  10.598
  187    H    PHE  27           H        PHE  27   4.011   0.946   7.373
  188    HA   PHE  27           HA       PHE  27   1.743   1.553   5.751
  189    HB2  PHE  27           1HB      PHE  27   2.602  -0.772   6.061
  190    HB3  PHE  27           2HB      PHE  27   2.214  -0.716   7.773
  191    HD1  PHE  27           1HD      PHE  27   0.611  -0.321   4.367
  192    HD2  PHE  27           2HD      PHE  27  -0.047  -1.421   8.507
  193    HE1  PHE  27           1HE      PHE  27  -1.720  -0.946   3.830
  194    HE2  PHE  27           2HE      PHE  27  -2.386  -2.060   7.955
  195    HZ   PHE  27           HZ       PHE  27  -3.228  -1.827   5.616
  196    H    SER  28           H        SER  28   2.110   1.373   9.316
  197    HA   SER  28           HA       SER  28  -0.608   1.724  10.095
  198    HB2  SER  28           1HB      SER  28   0.381   2.477  12.283
  199    HB3  SER  28           2HB      SER  28   1.257   1.072  11.666
  200    HG   SER  28           HG       SER  28   2.951   2.301  11.239
  201    H    GLU  29           H        GLU  29   1.893   4.151   9.256
  202    HA   GLU  29           HA       GLU  29   0.275   6.483   9.903
  203    HB2  GLU  29           1HB      GLU  29   2.834   6.120   8.209
  204    HB3  GLU  29           2HB      GLU  29   2.123   7.719   8.546
  205    HG2  GLU  29           1HG      GLU  29   3.103   5.748  10.717
  206    HG3  GLU  29           2HG      GLU  29   4.025   7.137  10.140
  207    H    PHE  30           H        PHE  30   1.046   4.728   6.862
  208    HA   PHE  30           HA       PHE  30  -0.400   6.458   5.076
  209    HB2  PHE  30           1HB      PHE  30   1.374   4.839   4.312
  210    HB3  PHE  30           2HB      PHE  30   0.364   3.483   4.816
  211    HD1  PHE  30           1HD      PHE  30   0.444   6.466   2.496
  212    HD2  PHE  30           2HD      PHE  30  -1.465   2.651   3.331
  213    HE1  PHE  30           1HE      PHE  30  -0.865   6.644   0.393
  214    HE2  PHE  30           2HE      PHE  30  -2.749   2.843   1.210
  215    HZ   PHE  30           HZ       PHE  30  -2.460   4.845  -0.261
  216    H    ALA  31           H        ALA  31  -1.262   3.386   6.751
  217    HA   ALA  31           HA       ALA  31  -3.910   3.063   5.695
  218    HB1  ALA  31           1HB      ALA  31  -4.136   1.442   7.683
  219    HB2  ALA  31           2HB      ALA  31  -2.569   1.994   8.258
  220    HB3  ALA  31           3HB      ALA  31  -2.688   1.155   6.714
  221    H    ALA  32           H        ALA  32  -2.641   4.650   8.633
  222    HA   ALA  32           HA       ALA  32  -5.106   5.265   9.959
  223    HB1  ALA  32           1HB      ALA  32  -3.754   7.146  11.035
  224    HB2  ALA  32           2HB      ALA  32  -2.429   6.783   9.919
  225    HB3  ALA  32           3HB      ALA  32  -2.931   5.585  11.116
  226    H    LYS  33           H        LYS  33  -3.332   6.938   7.356
  227    HA   LYS  33           HA       LYS  33  -5.097   9.254   7.291
  228    HB2  LYS  33           1HB      LYS  33  -2.670   9.300   6.468
  229    HB3  LYS  33           2HB      LYS  33  -3.129   8.238   5.111
  230    HG2  LYS  33           1HG      LYS  33  -4.760   9.990   4.263
  231    HG3  LYS  33           2HG      LYS  33  -4.352  11.047   5.640
  232    HD2  LYS  33           1HD      LYS  33  -1.950  11.182   4.806
  233    HD3  LYS  33           2HD      LYS  33  -2.383  10.151   3.427
  234    HE2  LYS  33           1HE      LYS  33  -4.015  11.889   2.620
  235    HE3  LYS  33           2HE      LYS  33  -3.611  12.920   4.013
  236    HZ1  LYS  33           3HZ      LYS  33  -2.366  13.550   2.046
  237    HZ2  LYS  33           1HZ      LYS  33  -1.696  11.999   1.931
  238    HZ3  LYS  33           2HZ      LYS  33  -1.321  12.989   3.262
  239    H    HIS  34           H        HIS  34  -4.860   6.209   5.343
  240    HA   HIS  34           HA       HIS  34  -7.249   6.953   3.750
  241    HB2  HIS  34           1HB      HIS  34  -5.223   4.647   3.546
  242    HB3  HIS  34           2HB      HIS  34  -6.623   4.795   2.467
  243    HD2  HIS  34           2HD      HIS  34  -6.345   6.804   0.470
  244    HE1  HIS  34           1HE      HIS  34  -2.554   8.213   1.661
  245    HE2  HIS  34           2HE      HIS  34  -4.345   8.371  -0.130
  246    H    ALA  35           H        ALA  35  -6.767   5.599   6.735
  247    HA   ALA  35           HA       ALA  35  -8.113   3.178   6.917
  248    HB1  ALA  35           1HB      ALA  35  -7.976   5.536   8.880
  249    HB2  ALA  35           2HB      ALA  35  -7.105   4.008   8.975
  250    HB3  ALA  35           3HB      ALA  35  -8.820   4.047   9.322
  251    H    LYS  36           H        LYS  36  -9.543   6.439   6.761
  252    HA   LYS  36           HA       LYS  36 -12.259   5.544   7.085
  253    HB2  LYS  36           1HB      LYS  36 -12.800   7.999   6.667
  254    HB3  LYS  36           2HB      LYS  36 -11.425   7.879   7.788
  255    HG2  LYS  36           1HG      LYS  36  -9.804   8.223   5.835
  256    HG3  LYS  36           2HG      LYS  36 -11.178   8.384   4.726
  257    HD2  LYS  36           1HD      LYS  36 -11.971  10.429   5.988
  258    HD3  LYS  36           2HD      LYS  36 -10.598  10.283   7.095
  259    HE2  LYS  36           1HE      LYS  36  -8.996  10.647   5.174
  260    HE3  LYS  36           2HE      LYS  36 -10.372  10.788   4.055
  261    HZ1  LYS  36           3HZ      LYS  36 -11.184  12.634   5.575
  262    HZ2  LYS  36           1HZ      LYS  36  -9.798  12.986   4.656
  263    HZ3  LYS  36           2HZ      LYS  36  -9.648  12.605   6.305
  264    H    ASP  37           H        ASP  37 -10.047   5.540   4.447
  265    HA   ASP  37           HA       ASP  37 -11.793   6.135   2.250
  266    HB2  ASP  37           1HB      ASP  37  -9.182   5.948   2.199
  267    HB3  ASP  37           2HB      ASP  37  -9.397   4.210   2.079
  268    H    SER  38           H        SER  38 -13.129   4.793   1.030
  269    HA   SER  38           HA       SER  38 -14.393   2.597   2.298
  270    HB2  SER  38           1HB      SER  38 -14.539   3.712  -0.519
  271    HB3  SER  38           2HB      SER  38 -15.535   2.342  -0.020
  272    HG   SER  38           HG       SER  38 -16.394   3.667   1.623
  273    H    ARG  39           H        ARG  39 -11.831   2.779  -0.082
  274    HA   ARG  39           HA       ARG  39 -11.772   0.001  -0.931
  275    HB2  ARG  39           1HB      ARG  39  -9.664   2.254  -1.062
  276    HB3  ARG  39           2HB      ARG  39  -9.421   0.649  -1.787
  277    HG2  ARG  39           1HG      ARG  39 -11.438   0.998  -3.268
  278    HG3  ARG  39           2HG      ARG  39 -11.710   2.595  -2.536
  279    HD2  ARG  39           1HD      ARG  39  -9.134   1.829  -4.054
  280    HD3  ARG  39           2HD      ARG  39 -10.488   2.708  -4.783
  281    HE   ARG  39           HE       ARG  39  -8.516   3.758  -2.905
  282   HH11  ARG  39          1HH2      ARG  39 -11.763   4.190  -4.168
  283   HH12  ARG  39          2HH2      ARG  39 -11.809   5.884  -3.813
  284   HH21  ARG  39          1HH1      ARG  39  -8.642   5.972  -2.432
  285   HH22  ARG  39          2HH1      ARG  39 -10.061   6.878  -2.840
  286    H    PHE  40           H        PHE  40 -10.570   1.693   1.874
  287    HA   PHE  40           HA       PHE  40  -8.442  -0.154   2.520
  288    HB2  PHE  40           1HB      PHE  40  -8.574   2.212   3.417
  289    HB3  PHE  40           2HB      PHE  40  -9.974   1.772   4.386
  290    HD1  PHE  40           2HD      PHE  40  -6.322   1.088   3.846
  291    HD2  PHE  40           1HD      PHE  40  -9.692   0.478   6.521
  292    HE1  PHE  40           2HE      PHE  40  -4.817   0.144   5.547
  293    HE2  PHE  40           1HE      PHE  40  -8.153  -0.486   8.222
  294    HZ   PHE  40           HZ       PHE  40  -5.706  -0.661   7.738
  295    H    LYS  41           H        LYS  41 -11.747   0.297   3.877
  296    HA   LYS  41           HA       LYS  41 -11.708  -2.056   5.565
  297    HB2  LYS  41           1HB      LYS  41 -14.037  -1.468   6.129
  298    HB3  LYS  41           2HB      LYS  41 -13.144   0.064   5.979
  299    HG2  LYS  41           1HG      LYS  41 -14.030   0.357   3.626
  300    HG3  LYS  41           2HG      LYS  41 -14.921  -1.166   3.745
  301    HD2  LYS  41           1HD      LYS  41 -16.275  -0.190   5.674
  302    HD3  LYS  41           2HD      LYS  41 -15.430   1.352   5.457
  303    HE2  LYS  41           1HE      LYS  41 -16.367   1.525   3.115
  304    HE3  LYS  41           2HE      LYS  41 -17.194  -0.022   3.317
  305    HZ1  LYS  41           3HZ      LYS  41 -17.629   2.426   4.953
  306    HZ2  LYS  41           1HZ      LYS  41 -18.406   0.935   5.187
  307    HZ3  LYS  41           2HZ      LYS  41 -18.674   1.818   3.759
  308    H    ALA  42           H        ALA  42 -12.288  -1.561   2.189
  309    HA   ALA  42           HA       ALA  42 -14.201  -3.633   1.579
  310    HB1  ALA  42           1HB      ALA  42 -13.338  -3.376  -0.768
  311    HB2  ALA  42           2HB      ALA  42 -11.941  -2.484  -0.171
  312    HB3  ALA  42           3HB      ALA  42 -13.554  -1.780  -0.044
  313    H    ILE  43           H        ILE  43 -10.708  -3.663   2.090
  314    HA   ILE  43           HA       ILE  43 -10.537  -6.543   1.359
  315    HB   ILE  43           HB       ILE  43  -8.295  -4.810   2.566
  316   HG12  ILE  43          1HG1      ILE  43  -9.062  -3.483   0.613
  317   HG13  ILE  43          2HG1      ILE  43  -7.562  -4.266   0.153
  318   HG21  ILE  43          1HG2      ILE  43  -6.825  -6.439   1.333
  319   HG22  ILE  43          2HG2      ILE  43  -8.224  -7.251   0.664
  320   HG23  ILE  43          3HG2      ILE  43  -7.927  -7.300   2.391
  321   HD11  ILE  43          3HD1      ILE  43 -10.381  -4.872  -0.744
  322   HD12  ILE  43          1HD1      ILE  43  -9.130  -6.105  -0.918
  323   HD13  ILE  43          2HD1      ILE  43  -8.956  -4.549  -1.710
  324    H    GLU  44           H        GLU  44 -11.046  -7.970   2.877
  325    HA   GLU  44           HA       GLU  44 -11.601  -7.419   5.644
  326    HB2  GLU  44           1HB      GLU  44 -11.296 -10.040   4.026
  327    HB3  GLU  44           2HB      GLU  44 -11.896  -9.996   5.699
  328    HG2  GLU  44           1HG      GLU  44 -13.829  -8.520   4.945
  329    HG3  GLU  44           2HG      GLU  44 -13.228  -8.584   3.282
  330    H    LYS  45           H        LYS  45  -8.933  -9.080   3.928
  331    HA   LYS  45           HA       LYS  45  -7.408  -9.645   6.368
  332    HB2  LYS  45           1HB      LYS  45  -6.753 -10.065   3.375
  333    HB3  LYS  45           2HB      LYS  45  -5.707 -10.610   4.698
  334    HG2  LYS  45           1HG      LYS  45  -7.503 -12.121   5.557
  335    HG3  LYS  45           2HG      LYS  45  -8.635 -11.557   4.316
  336    HD2  LYS  45           1HD      LYS  45  -5.950 -12.870   3.501
  337    HD3  LYS  45           2HD      LYS  45  -7.359 -13.864   3.898
  338    HE2  LYS  45           1HE      LYS  45  -7.410 -11.706   1.705
  339    HE3  LYS  45           2HE      LYS  45  -7.145 -13.424   1.399
  340    HZ1  LYS  45           3HZ      LYS  45  -9.385 -13.270   1.150
  341    HZ2  LYS  45           1HZ      LYS  45  -9.569 -12.050   2.312
  342    HZ3  LYS  45           2HZ      LYS  45  -9.311 -13.659   2.801
  343    H    MET  46           H        MET  46  -5.776  -8.460   7.106
  344    HA   MET  46           HA       MET  46  -5.083  -5.844   5.941
  345    HB2  MET  46           1HB      MET  46  -3.962  -5.555   8.253
  346    HB3  MET  46           2HB      MET  46  -5.723  -5.732   8.286
  347    HG2  MET  46           1HG      MET  46  -5.531  -8.144   8.931
  348    HG3  MET  46           2HG      MET  46  -3.765  -8.075   8.790
  349    HE1  MET  46           3HE      MET  46  -4.340  -8.418  12.655
  350    HE2  MET  46           1HE      MET  46  -3.521  -9.062  11.222
  351    HE3  MET  46           2HE      MET  46  -5.275  -9.160  11.357
  352    H    LYS  47           H        LYS  47  -3.825  -9.052   6.490
  353    HA   LYS  47           HA       LYS  47  -1.020  -8.580   6.398
  354    HB2  LYS  47           1HB      LYS  47  -2.656 -11.085   5.590
  355    HB3  LYS  47           2HB      LYS  47  -0.888 -11.062   5.759
  356    HG2  LYS  47           1HG      LYS  47  -1.145 -10.400   8.213
  357    HG3  LYS  47           2HG      LYS  47  -2.905 -10.447   8.014
  358    HD2  LYS  47           1HD      LYS  47  -2.290 -12.594   9.025
  359    HD3  LYS  47           2HD      LYS  47  -2.678 -12.968   7.346
  360    HE2  LYS  47           1HE      LYS  47  -0.228 -13.040   6.790
  361    HE3  LYS  47           2HE      LYS  47   0.180 -12.579   8.454
  362    HZ1  LYS  47           3HZ      LYS  47   0.174 -15.057   7.816
  363    HZ2  LYS  47           1HZ      LYS  47  -1.517 -14.950   7.907
  364    HZ3  LYS  47           2HZ      LYS  47  -0.563 -14.607   9.276
  365    H    ASP  48           H        ASP  48  -3.431  -9.193   3.816
  366    HA   ASP  48           HA       ASP  48  -1.547  -9.485   1.679
  367    HB2  ASP  48           1HB      ASP  48  -3.982 -10.236   1.559
  368    HB3  ASP  48           2HB      ASP  48  -4.493  -8.545   1.548
  369    H    ARG  49           H        ARG  49  -3.215  -6.675   3.084
  370    HA   ARG  49           HA       ARG  49  -2.347  -4.723   1.129
  371    HB2  ARG  49           1HB      ARG  49  -3.268  -4.426   4.056
  372    HB3  ARG  49           2HB      ARG  49  -2.868  -3.041   3.017
  373    HG2  ARG  49           1HG      ARG  49  -4.635  -3.775   1.348
  374    HG3  ARG  49           2HG      ARG  49  -5.032  -5.143   2.415
  375    HD2  ARG  49           1HD      ARG  49  -5.249  -2.205   3.313
  376    HD3  ARG  49           2HD      ARG  49  -6.599  -3.126   2.646
  377    HE   ARG  49           HE       ARG  49  -5.430  -4.610   4.763
  378   HH11  ARG  49          1HH2      ARG  49  -7.346  -1.793   4.202
  379   HH12  ARG  49          2HH2      ARG  49  -8.103  -1.833   5.757
  380   HH21  ARG  49          1HH1      ARG  49  -6.426  -4.658   6.805
  381   HH22  ARG  49          2HH1      ARG  49  -7.579  -3.444   7.232
  382    H    GLU  50           H        GLU  50  -0.959  -5.952   4.195
  383    HA   GLU  50           HA       GLU  50   1.210  -4.102   4.412
  384    HB2  GLU  50           1HB      GLU  50   0.392  -5.642   6.283
  385    HB3  GLU  50           2HB      GLU  50   1.117  -7.020   5.433
  386    HG2  GLU  50           1HG      GLU  50   3.403  -5.907   5.607
  387    HG3  GLU  50           2HG      GLU  50   2.676  -4.545   6.461
  388    H    ALA  51           H        ALA  51   0.904  -7.322   2.799
  389    HA   ALA  51           HA       ALA  51   3.591  -7.711   1.961
  390    HB1  ALA  51           1HB      ALA  51   1.013  -8.570   0.516
  391    HB2  ALA  51           2HB      ALA  51   1.780  -9.468   1.826
  392    HB3  ALA  51           3HB      ALA  51   2.618  -9.281   0.281
  393    H    LEU  52           H        LEU  52   0.831  -6.137   0.253
  394    HA   LEU  52           HA       LEU  52   2.240  -5.395  -2.103
  395    HB2  LEU  52           1HB      LEU  52  -0.395  -4.630  -0.866
  396    HB3  LEU  52           2HB      LEU  52   0.194  -3.634  -2.188
  397    HG   LEU  52           HG       LEU  52  -1.323  -5.493  -3.018
  398   HD11  LEU  52          1HD1      LEU  52  -0.110  -5.950  -4.952
  399   HD12  LEU  52          2HD1      LEU  52   1.390  -6.286  -4.129
  400   HD13  LEU  52          3HD1      LEU  52   0.861  -4.633  -4.334
  401   HD21  LEU  52          3HD2      LEU  52   0.836  -7.489  -2.167
  402   HD22  LEU  52          1HD2      LEU  52  -0.742  -7.820  -2.834
  403   HD23  LEU  52          2HD2      LEU  52  -0.599  -7.175  -1.247
  404    H    PHE  53           H        PHE  53   1.591  -3.651   0.903
  405    HA   PHE  53           HA       PHE  53   2.615  -1.085   0.201
  406    HB2  PHE  53           1HB      PHE  53   1.335  -1.385   2.256
  407    HB3  PHE  53           2HB      PHE  53   2.430  -2.621   2.840
  408    HD1  PHE  53           2HD      PHE  53   2.297   1.023   1.921
  409    HD2  PHE  53           1HD      PHE  53   4.453  -2.029   4.128
  410    HE1  PHE  53           2HE      PHE  53   3.782   2.745   2.897
  411    HE2  PHE  53           1HE      PHE  53   5.933  -0.282   5.079
  412    HZ   PHE  53           HZ       PHE  53   5.598   2.097   4.450
  413    H    ASN  54           H        ASN  54   4.228  -3.935   1.709
  414    HA   ASN  54           HA       ASN  54   6.859  -2.824   1.941
  415    HB2  ASN  54           1HB      ASN  54   5.925  -5.748   1.634
  416    HB3  ASN  54           2HB      ASN  54   7.591  -5.293   2.034
  417   HD21  ASN  54          1HD2      ASN  54   5.460  -6.767   3.684
  418   HD22  ASN  54          2HD2      ASN  54   5.390  -5.900   5.145
  419    H    GLU  55           H        GLU  55   5.263  -4.687  -0.684
  420    HA   GLU  55           HA       GLU  55   7.560  -4.871  -2.421
  421    HB2  GLU  55           1HB      GLU  55   5.510  -6.398  -2.596
  422    HB3  GLU  55           2HB      GLU  55   4.558  -5.024  -3.185
  423    HG2  GLU  55           1HG      GLU  55   6.079  -4.811  -5.203
  424    HG3  GLU  55           2HG      GLU  55   7.069  -6.150  -4.608
  425    H    PHE  56           H        PHE  56   4.798  -2.582  -2.141
  426    HA   PHE  56           HA       PHE  56   5.234  -1.075  -4.492
  427    HB2  PHE  56           1HB      PHE  56   3.125  -0.922  -3.121
  428    HB3  PHE  56           2HB      PHE  56   4.014  -0.174  -1.798
  429    HD1  PHE  56           2HD      PHE  56   3.019   0.305  -5.416
  430    HD2  PHE  56           1HD      PHE  56   4.520   2.288  -1.851
  431    HE1  PHE  56           2HE      PHE  56   2.823   2.507  -6.544
  432    HE2  PHE  56           1HE      PHE  56   4.324   4.484  -3.002
  433    HZ   PHE  56           HZ       PHE  56   3.488   4.598  -5.350
  434    H    VAL  57           H        VAL  57   6.376  -0.473  -1.102
  435    HA   VAL  57           HA       VAL  57   7.891   1.922  -1.624
  436    HB   VAL  57           HB       VAL  57   8.115  -0.239   0.594
  437   HG11  VAL  57          1HG1      VAL  57   9.357   1.649   1.911
  438   HG12  VAL  57          2HG1      VAL  57   9.554   2.486   0.371
  439   HG13  VAL  57          3HG1      VAL  57  10.290   0.903   0.611
  440   HG21  VAL  57          3HG2      VAL  57   5.935   1.077   0.527
  441   HG22  VAL  57          1HG2      VAL  57   6.835   2.587   0.662
  442   HG23  VAL  57          2HG2      VAL  57   6.854   1.419   1.981
  443    H    ALA  58           H        ALA  58   8.829  -1.565  -1.486
  444    HA   ALA  58           HA       ALA  58  11.619  -1.191  -1.971
  445    HB1  ALA  58           1HB      ALA  58  10.656  -3.306  -1.013
  446    HB2  ALA  58           2HB      ALA  58  11.601  -3.674  -2.463
  447    HB3  ALA  58           3HB      ALA  58   9.833  -3.637  -2.540
  448    H    ALA  59           H        ALA  59   8.834  -1.735  -4.179
  449    HA   ALA  59           HA       ALA  59  10.374  -1.934  -6.629
  450    HB1  ALA  59           1HB      ALA  59   8.084  -1.799  -7.706
  451    HB2  ALA  59           2HB      ALA  59   7.383  -1.376  -6.132
  452    HB3  ALA  59           3HB      ALA  59   8.102  -2.970  -6.380
  453    H    ALA  60           H        ALA  60   8.523   0.690  -4.989
  454    HA   ALA  60           HA       ALA  60   8.731   2.675  -7.050
  455    HB1  ALA  60           1HB      ALA  60   8.324   2.997  -4.008
  456    HB2  ALA  60           2HB      ALA  60   7.042   2.857  -5.213
  457    HB3  ALA  60           3HB      ALA  60   8.069   4.294  -5.196
  458    H    ARG  61           H        ARG  61  10.724   1.928  -4.177
  459    HA   ARG  61           HA       ARG  61  12.490   4.163  -4.468
  460    HB2  ARG  61           1HB      ARG  61  12.120   2.956  -2.246
  461    HB3  ARG  61           2HB      ARG  61  12.905   1.502  -2.901
  462    HG2  ARG  61           1HG      ARG  61  15.071   2.804  -3.196
  463    HG3  ARG  61           2HG      ARG  61  14.284   4.248  -2.548
  464    HD2  ARG  61           1HD      ARG  61  13.908   2.960  -0.344
  465    HD3  ARG  61           2HD      ARG  61  14.863   1.634  -1.034
  466    HE   ARG  61           HE       ARG  61  16.806   2.891  -0.703
  467   HH11  ARG  61          1HH2      ARG  61  14.032   5.026  -0.463
  468   HH12  ARG  61          2HH2      ARG  61  14.956   6.376   0.104
  469   HH21  ARG  61          1HH1      ARG  61  17.994   4.704  -0.017
  470   HH22  ARG  61          2HH1      ARG  61  17.190   6.191   0.356
  Start of MODEL   19
    1    H    ILE   5           H        ILE   5 -13.790 -10.457 -11.361
    2    HA   ILE   5           HA       ILE   5 -12.096 -10.040 -12.891
    3    HB   ILE   5           HB       ILE   5 -13.238  -7.198 -13.117
    4   HG12  ILE   5          1HG1      ILE   5 -14.224  -9.640 -14.717
    5   HG13  ILE   5          2HG1      ILE   5 -15.087  -9.017 -13.327
    6   HG21  ILE   5          1HG2      ILE   5 -12.326  -7.181 -15.411
    7   HG22  ILE   5          2HG2      ILE   5 -11.891  -8.893 -15.309
    8   HG23  ILE   5          3HG2      ILE   5 -11.015  -7.692 -14.362
    9   HD11  ILE   5          3HD1      ILE   5 -14.537  -7.466 -15.885
   10   HD12  ILE   5          1HD1      ILE   5 -15.370  -6.825 -14.463
   11   HD13  ILE   5          2HD1      ILE   5 -16.092  -8.140 -15.391
   12    H    MET   6           H        MET   6 -11.503  -9.719 -10.121
   13    HA   MET   6           HA       MET   6 -10.131  -8.611  -8.540
   14    HB2  MET   6           1HB      MET   6  -8.381  -8.507 -11.067
   15    HB3  MET   6           2HB      MET   6  -7.788  -8.465  -9.404
   16    HG2  MET   6           1HG      MET   6  -7.500 -10.766  -9.938
   17    HG3  MET   6           2HG      MET   6  -9.088 -10.800  -9.168
   18    HE1  MET   6           3HE      MET   6  -9.607 -13.111 -10.282
   19    HE2  MET   6           1HE      MET   6  -8.003 -13.093 -11.037
   20    HE3  MET   6           2HE      MET   6  -9.436 -13.456 -12.001
   21    H    GLN   7           H        GLN   7 -12.001  -6.805  -9.838
   22    HA   GLN   7           HA       GLN   7 -10.800  -4.440 -10.826
   23    HB2  GLN   7           1HB      GLN   7 -13.217  -4.972 -11.124
   24    HB3  GLN   7           2HB      GLN   7 -13.488  -4.775  -9.391
   25    HG2  GLN   7           1HG      GLN   7 -12.871  -2.356  -9.536
   26    HG3  GLN   7           2HG      GLN   7 -12.425  -2.531 -11.231
   27   HE21  GLN   7          1HE2      GLN   7 -14.027  -1.807 -12.592
   28   HE22  GLN   7          2HE2      GLN   7 -15.688  -1.805 -12.250
   29    H    ALA   8           H        ALA   8 -11.628  -5.507  -7.559
   30    HA   ALA   8           HA       ALA   8 -11.226  -3.084  -6.134
   31    HB1  ALA   8           1HB      ALA   8 -12.332  -5.115  -5.142
   32    HB2  ALA   8           2HB      ALA   8 -10.995  -4.566  -4.125
   33    HB3  ALA   8           3HB      ALA   8 -10.795  -5.971  -5.179
   34    H    LYS   9           H        LYS   9  -8.990  -5.742  -6.960
   35    HA   LYS   9           HA       LYS   9  -6.763  -4.660  -5.581
   36    HB2  LYS   9           1HB      LYS   9  -6.985  -7.090  -6.328
   37    HB3  LYS   9           2HB      LYS   9  -6.785  -6.560  -7.994
   38    HG2  LYS   9           1HG      LYS   9  -4.505  -5.683  -7.478
   39    HG3  LYS   9           2HG      LYS   9  -4.697  -6.108  -5.782
   40    HD2  LYS   9           1HD      LYS   9  -4.838  -8.553  -6.432
   41    HD3  LYS   9           2HD      LYS   9  -4.599  -8.100  -8.123
   42    HE2  LYS   9           1HE      LYS   9  -2.572  -7.547  -5.866
   43    HE3  LYS   9           2HE      LYS   9  -2.407  -8.817  -7.090
   44    HZ1  LYS   9           3HZ      LYS   9  -2.358  -5.879  -7.460
   45    HZ2  LYS   9           1HZ      LYS   9  -2.667  -6.926  -8.755
   46    HZ3  LYS   9           2HZ      LYS   9  -1.188  -7.022  -7.925
   47    H    GLU  10           H        GLU  10  -7.871  -4.365  -8.955
   48    HA   GLU  10           HA       GLU  10  -5.644  -2.955 -10.007
   49    HB2  GLU  10           1HB      GLU  10  -8.565  -3.081 -10.860
   50    HB3  GLU  10           2HB      GLU  10  -7.347  -2.214 -11.804
   51    HG2  GLU  10           1HG      GLU  10  -6.046  -4.325 -12.135
   52    HG3  GLU  10           2HG      GLU  10  -7.164  -5.213 -11.101
   53    H    ASP  11           H        ASP  11  -8.523  -1.948  -8.337
   54    HA   ASP  11           HA       ASP  11  -8.219   0.913  -8.711
   55    HB2  ASP  11           1HB      ASP  11  -9.837  -0.681  -6.653
   56    HB3  ASP  11           2HB      ASP  11  -9.948   1.066  -6.849
   57    H    PHE  12           H        PHE  12  -7.145  -1.426  -6.289
   58    HA   PHE  12           HA       PHE  12  -6.298   0.421  -4.285
   59    HB2  PHE  12           1HB      PHE  12  -6.620  -2.034  -3.855
   60    HB3  PHE  12           2HB      PHE  12  -5.265  -2.397  -4.909
   61    HD1  PHE  12           2HD      PHE  12  -6.166  -0.369  -1.857
   62    HD2  PHE  12           1HD      PHE  12  -2.973  -2.422  -3.975
   63    HE1  PHE  12           2HE      PHE  12  -4.597   0.108  -0.002
   64    HE2  PHE  12           1HE      PHE  12  -1.437  -1.929  -2.064
   65    HZ   PHE  12           HZ       PHE  12  -2.251  -0.681  -0.083
   66    H    LYS  13           H        LYS  13  -4.354  -1.257  -6.809
   67    HA   LYS  13           HA       LYS  13  -1.874  -0.013  -6.227
   68    HB2  LYS  13           1HB      LYS  13  -1.204  -0.798  -8.525
   69    HB3  LYS  13           2HB      LYS  13  -1.996  -2.049  -7.575
   70    HG2  LYS  13           1HG      LYS  13  -4.138  -1.627  -8.785
   71    HG3  LYS  13           2HG      LYS  13  -3.410  -0.354  -9.738
   72    HD2  LYS  13           1HD      LYS  13  -3.448  -2.357 -11.161
   73    HD3  LYS  13           2HD      LYS  13  -1.776  -2.060 -10.702
   74    HE2  LYS  13           1HE      LYS  13  -3.407  -3.955  -8.958
   75    HE3  LYS  13           2HE      LYS  13  -2.801  -4.556 -10.497
   76    HZ1  LYS  13           3HZ      LYS  13  -1.411  -4.463  -8.178
   77    HZ2  LYS  13           1HZ      LYS  13  -0.854  -3.084  -8.995
   78    HZ3  LYS  13           2HZ      LYS  13  -0.734  -4.605  -9.732
   79    H    LYS  14           H        LYS  14  -4.516   0.790  -8.374
   80    HA   LYS  14           HA       LYS  14  -3.347   2.904  -9.792
   81    HB2  LYS  14           1HB      LYS  14  -5.526   1.822 -10.452
   82    HB3  LYS  14           2HB      LYS  14  -6.312   2.589  -9.079
   83    HG2  LYS  14           1HG      LYS  14  -5.759   4.866 -10.019
   84    HG3  LYS  14           2HG      LYS  14  -4.911   4.111 -11.367
   85    HD2  LYS  14           1HD      LYS  14  -7.075   3.067 -12.129
   86    HD3  LYS  14           2HD      LYS  14  -7.916   3.841 -10.782
   87    HE2  LYS  14           1HE      LYS  14  -7.307   6.110 -11.700
   88    HE3  LYS  14           2HE      LYS  14  -6.449   5.342 -13.043
   89    HZ1  LYS  14           3HZ      LYS  14  -8.404   5.490 -14.035
   90    HZ2  LYS  14           1HZ      LYS  14  -9.263   5.664 -12.582
   91    HZ3  LYS  14           2HZ      LYS  14  -8.804   4.123 -13.114
   92    H    MET  15           H        MET  15  -5.093   2.784  -6.734
   93    HA   MET  15           HA       MET  15  -5.135   5.627  -6.327
   94    HB2  MET  15           1HB      MET  15  -6.700   3.898  -5.191
   95    HB3  MET  15           2HB      MET  15  -5.335   3.436  -4.184
   96    HG2  MET  15           1HG      MET  15  -6.635   5.087  -2.899
   97    HG3  MET  15           2HG      MET  15  -5.173   5.928  -3.433
   98    HE1  MET  15           3HE      MET  15  -6.422   8.211  -2.932
   99    HE2  MET  15           1HE      MET  15  -7.912   7.363  -2.486
  100    HE3  MET  15           2HE      MET  15  -7.960   8.687  -3.649
  101    H    MET  16           H        MET  16  -3.016   3.004  -5.211
  102    HA   MET  16           HA       MET  16  -1.386   4.482  -3.415
  103    HB2  MET  16           1HB      MET  16  -0.920   1.935  -5.020
  104    HB3  MET  16           2HB      MET  16   0.285   2.536  -3.899
  105    HG2  MET  16           1HG      MET  16  -2.601   1.909  -3.070
  106    HG3  MET  16           2HG      MET  16  -1.280   0.772  -2.898
  107    HE1  MET  16           3HE      MET  16  -0.019   0.577  -0.619
  108    HE2  MET  16           1HE      MET  16   0.820   2.014  -0.011
  109    HE3  MET  16           2HE      MET  16   1.026   1.514  -1.681
  110    H    GLU  17           H        GLU  17  -0.931   3.810  -6.865
  111    HA   GLU  17           HA       GLU  17   1.664   5.026  -7.027
  112    HB2  GLU  17           1HB      GLU  17   1.515   4.627  -9.410
  113    HB3  GLU  17           2HB      GLU  17   0.676   3.274  -8.653
  114    HG2  GLU  17           1HG      GLU  17  -1.513   4.515  -9.079
  115    HG3  GLU  17           2HG      GLU  17  -0.631   5.713  -9.981
  116    H    GLU  18           H        GLU  18  -1.671   6.135  -7.496
  117    HA   GLU  18           HA       GLU  18  -0.991   8.805  -8.466
  118    HB2  GLU  18           1HB      GLU  18  -3.651   7.525  -7.619
  119    HB3  GLU  18           2HB      GLU  18  -3.536   9.209  -8.167
  120    HG2  GLU  18           1HG      GLU  18  -2.659   8.431 -10.383
  121    HG3  GLU  18           2HG      GLU  18  -2.721   6.771  -9.849
  122    H    ALA  19           H        ALA  19  -1.457   7.280  -5.372
  123    HA   ALA  19           HA       ALA  19  -2.033   9.790  -3.970
  124    HB1  ALA  19           1HB      ALA  19  -1.728   6.939  -2.916
  125    HB2  ALA  19           2HB      ALA  19  -3.246   7.774  -3.234
  126    HB3  ALA  19           3HB      ALA  19  -2.186   8.325  -1.932
  127    H    LYS  20           H        LYS  20   0.633   8.669  -5.367
  128    HA   LYS  20           HA       LYS  20   2.714   7.998  -4.010
  129    HB2  LYS  20           1HB      LYS  20   2.753   9.294  -6.269
  130    HB3  LYS  20           2HB      LYS  20   2.884  10.773  -5.317
  131    HG2  LYS  20           1HG      LYS  20   5.191  10.300  -5.718
  132    HG3  LYS  20           2HG      LYS  20   4.971   9.533  -4.153
  133    HD2  LYS  20           1HD      LYS  20   4.543   7.287  -5.398
  134    HD3  LYS  20           2HD      LYS  20   4.967   8.110  -6.891
  135    HE2  LYS  20           1HE      LYS  20   6.828   7.780  -4.469
  136    HE3  LYS  20           2HE      LYS  20   6.956   6.882  -5.998
  137    HZ1  LYS  20           3HZ      LYS  20   8.345   8.599  -6.438
  138    HZ2  LYS  20           1HZ      LYS  20   7.531   9.685  -5.421
  139    HZ3  LYS  20           2HZ      LYS  20   6.888   9.313  -6.944
  140    H    PHE  21           H        PHE  21   3.388   8.232  -1.945
  141    HA   PHE  21           HA       PHE  21   3.178  10.861  -0.598
  142    HB2  PHE  21           1HB      PHE  21   2.274   9.730   1.424
  143    HB3  PHE  21           2HB      PHE  21   1.230   9.446   0.038
  144    HD1  PHE  21           1HD      PHE  21   1.326   7.203  -1.241
  145    HD2  PHE  21           2HD      PHE  21   3.473   7.789   2.496
  146    HE1  PHE  21           1HE      PHE  21   1.607   4.731  -1.007
  147    HE2  PHE  21           2HE      PHE  21   3.745   5.314   2.707
  148    HZ   PHE  21           HZ       PHE  21   2.806   3.794   0.957
  149    H    ASN  22           H        ASN  22   4.390  10.679   1.577
  150    HA   ASN  22           HA       ASN  22   7.066  10.428   1.163
  151    HB2  ASN  22           1HB      ASN  22   5.516  10.082   3.759
  152    HB3  ASN  22           2HB      ASN  22   7.275  10.240   3.711
  153   HD21  ASN  22          1HD2      ASN  22   8.017  12.230   2.324
  154   HD22  ASN  22          2HD2      ASN  22   7.148  13.668   2.560
  155    HA   PRO  23           HA       PRO  23   7.352   5.841   0.729
  156    HB2  PRO  23           1HB      PRO  23  10.028   5.663   0.090
  157    HB3  PRO  23           2HB      PRO  23   8.798   6.237  -1.072
  158    HG2  PRO  23           1HG      PRO  23  10.709   7.867   0.614
  159    HG3  PRO  23           2HG      PRO  23  10.267   8.079  -1.098
  160    HD2  PRO  23           1HD      PRO  23   9.145   9.597   0.917
  161    HD3  PRO  23           2HD      PRO  23   8.248   9.192  -0.571
  162    H    ARG  24           H        ARG  24   9.057   7.834   3.000
  163    HA   ARG  24           HA       ARG  24  10.224   5.586   4.496
  164    HB2  ARG  24           1HB      ARG  24  10.237   8.629   4.967
  165    HB3  ARG  24           2HB      ARG  24  11.078   7.484   6.024
  166    HG2  ARG  24           1HG      ARG  24  12.497   6.735   4.094
  167    HG3  ARG  24           2HG      ARG  24  11.639   7.841   3.023
  168    HD2  ARG  24           1HD      ARG  24  12.464   9.795   4.391
  169    HD3  ARG  24           2HD      ARG  24  13.337   8.669   5.439
  170    HE   ARG  24           HE       ARG  24  14.951   8.418   3.785
  171   HH11  ARG  24          1HH2      ARG  24  12.092   9.862   2.365
  172   HH12  ARG  24          2HH2      ARG  24  12.877  10.227   0.862
  173   HH21  ARG  24          1HH1      ARG  24  15.927   8.878   1.822
  174   HH22  ARG  24          2HH1      ARG  24  15.044   9.668   0.560
  175    H    ALA  25           H        ALA  25   7.226   6.989   4.321
  176    HA   ALA  25           HA       ALA  25   6.506   7.023   7.128
  177    HB1  ALA  25           1HB      ALA  25   4.750   6.866   4.610
  178    HB2  ALA  25           2HB      ALA  25   5.197   8.338   5.462
  179    HB3  ALA  25           3HB      ALA  25   4.145   7.163   6.245
  180    H    THR  26           H        THR  26   5.174   5.460   8.158
  181    HA   THR  26           HA       THR  26   5.778   2.693   7.336
  182    HB   THR  26           HB       THR  26   4.506   3.753   9.930
  183    HG1  THR  26           1HG      THR  26   6.786   4.336   9.190
  184   HG21  THR  26          3HG2      THR  26   5.500   1.493  10.822
  185   HG22  THR  26          1HG2      THR  26   5.626   0.998   9.134
  186   HG23  THR  26          2HG2      THR  26   4.044   1.363   9.831
  187    H    PHE  27           H        PHE  27   4.042   1.114   7.545
  188    HA   PHE  27           HA       PHE  27   1.811   1.703   5.926
  189    HB2  PHE  27           1HB      PHE  27   2.747  -0.586   6.104
  190    HB3  PHE  27           2HB      PHE  27   2.371  -0.649   7.819
  191    HD1  PHE  27           2HD      PHE  27   0.736  -0.124   4.437
  192    HD2  PHE  27           1HD      PHE  27   0.145  -1.475   8.533
  193    HE1  PHE  27           2HE      PHE  27  -1.585  -0.817   3.883
  194    HE2  PHE  27           1HE      PHE  27  -2.191  -2.161   7.955
  195    HZ   PHE  27           HZ       PHE  27  -3.042  -1.839   5.637
  196    H    SER  28           H        SER  28   2.119   1.305   9.475
  197    HA   SER  28           HA       SER  28  -0.628   1.554  10.187
  198    HB2  SER  28           1HB      SER  28   0.268   2.113  12.470
  199    HB3  SER  28           2HB      SER  28   1.149   0.745  11.779
  200    HG   SER  28           HG       SER  28   2.139   3.258  11.165
  201    H    GLU  29           H        GLU  29   1.878   3.975   9.584
  202    HA   GLU  29           HA       GLU  29   0.292   6.212  10.432
  203    HB2  GLU  29           1HB      GLU  29   2.818   6.275  10.335
  204    HB3  GLU  29           2HB      GLU  29   2.749   6.097   8.586
  205    HG2  GLU  29           1HG      GLU  29   1.500   8.256   8.413
  206    HG3  GLU  29           2HG      GLU  29   1.549   8.455  10.152
  207    H    PHE  30           H        PHE  30   1.085   4.733   7.270
  208    HA   PHE  30           HA       PHE  30  -0.389   6.568   5.642
  209    HB2  PHE  30           1HB      PHE  30   1.471   5.063   4.807
  210    HB3  PHE  30           2HB      PHE  30   0.419   3.672   5.052
  211    HD1  PHE  30           1HD      PHE  30   0.642   6.980   3.240
  212    HD2  PHE  30           2HD      PHE  30  -1.295   3.081   3.334
  213    HE1  PHE  30           1HE      PHE  30  -0.488   7.476   1.068
  214    HE2  PHE  30           2HE      PHE  30  -2.407   3.599   1.153
  215    HZ   PHE  30           HZ       PHE  30  -1.996   5.787   0.023
  216    H    ALA  31           H        ALA  31  -1.186   3.367   6.997
  217    HA   ALA  31           HA       ALA  31  -3.752   3.055   5.812
  218    HB1  ALA  31           1HB      ALA  31  -2.588   1.121   6.815
  219    HB2  ALA  31           2HB      ALA  31  -4.090   1.360   7.712
  220    HB3  ALA  31           3HB      ALA  31  -2.553   1.894   8.393
  221    H    ALA  32           H        ALA  32  -2.703   4.484   8.902
  222    HA   ALA  32           HA       ALA  32  -5.271   5.026  10.053
  223    HB1  ALA  32           1HB      ALA  32  -3.155   5.197  11.369
  224    HB2  ALA  32           2HB      ALA  32  -4.031   6.729  11.439
  225    HB3  ALA  32           3HB      ALA  32  -2.619   6.541  10.378
  226    H    LYS  33           H        LYS  33  -3.302   6.815   7.737
  227    HA   LYS  33           HA       LYS  33  -4.956   9.183   7.787
  228    HB2  LYS  33           1HB      LYS  33  -2.515   9.159   7.043
  229    HB3  LYS  33           2HB      LYS  33  -2.990   8.229   5.627
  230    HG2  LYS  33           1HG      LYS  33  -4.468  10.097   4.848
  231    HG3  LYS  33           2HG      LYS  33  -4.090  11.026   6.300
  232    HD2  LYS  33           1HD      LYS  33  -1.659  11.120   5.582
  233    HD3  LYS  33           2HD      LYS  33  -2.076  10.225   4.115
  234    HE2  LYS  33           1HE      LYS  33  -3.234  12.982   4.870
  235    HE3  LYS  33           2HE      LYS  33  -1.995  12.703   3.636
  236    HZ1  LYS  33           3HZ      LYS  33  -4.046  12.782   2.506
  237    HZ2  LYS  33           1HZ      LYS  33  -4.815  11.780   3.643
  238    HZ3  LYS  33           2HZ      LYS  33  -3.649  11.132   2.595
  239    H    HIS  34           H        HIS  34  -4.764   6.339   5.610
  240    HA   HIS  34           HA       HIS  34  -7.075   7.304   4.022
  241    HB2  HIS  34           1HB      HIS  34  -5.104   4.995   3.569
  242    HB3  HIS  34           2HB      HIS  34  -6.422   5.414   2.462
  243    HD2  HIS  34           2HD      HIS  34  -2.869   6.706   3.405
  244    HE1  HIS  34           1HE      HIS  34  -4.371   9.353   0.531
  245    HE2  HIS  34           2HE      HIS  34  -2.324   8.691   1.843
  246    H    ALA  35           H        ALA  35  -6.673   5.652   6.819
  247    HA   ALA  35           HA       ALA  35  -8.009   3.217   6.665
  248    HB1  ALA  35           1HB      ALA  35  -8.869   3.869   9.101
  249    HB2  ALA  35           2HB      ALA  35  -7.878   5.306   8.876
  250    HB3  ALA  35           3HB      ALA  35  -7.132   3.712   8.842
  251    H    LYS  36           H        LYS  36  -9.389   6.481   6.648
  252    HA   LYS  36           HA       LYS  36 -12.127   5.626   6.973
  253    HB2  LYS  36           1HB      LYS  36 -10.875   8.297   6.073
  254    HB3  LYS  36           2HB      LYS  36 -12.599   8.094   6.429
  255    HG2  LYS  36           1HG      LYS  36 -12.025   7.429   8.799
  256    HG3  LYS  36           2HG      LYS  36 -10.308   7.632   8.440
  257    HD2  LYS  36           1HD      LYS  36 -10.687  10.069   7.967
  258    HD3  LYS  36           2HD      LYS  36 -12.409   9.874   8.306
  259    HE2  LYS  36           1HE      LYS  36 -11.871   9.220  10.676
  260    HE3  LYS  36           2HE      LYS  36 -10.145   9.408  10.338
  261    HZ1  LYS  36           3HZ      LYS  36 -12.163  11.537   9.994
  262    HZ2  LYS  36           1HZ      LYS  36 -10.487  11.691   9.849
  263    HZ3  LYS  36           2HZ      LYS  36 -11.178  11.366  11.367
  264    H    ASP  37           H        ASP  37  -9.970   5.604   4.349
  265    HA   ASP  37           HA       ASP  37 -11.768   6.245   2.213
  266    HB2  ASP  37           1HB      ASP  37  -9.206   4.556   2.209
  267    HB3  ASP  37           2HB      ASP  37 -10.036   5.100   0.771
  268    H    SER  38           H        SER  38 -13.089   4.901   1.057
  269    HA   SER  38           HA       SER  38 -14.257   2.602   2.286
  270    HB2  SER  38           1HB      SER  38 -14.501   3.841  -0.493
  271    HB3  SER  38           2HB      SER  38 -15.429   2.412  -0.030
  272    HG   SER  38           HG       SER  38 -16.063   3.727   1.848
  273    H    ARG  39           H        ARG  39 -11.751   3.034  -0.137
  274    HA   ARG  39           HA       ARG  39 -11.576   0.382  -1.197
  275    HB2  ARG  39           1HB      ARG  39  -9.467   2.600  -0.965
  276    HB3  ARG  39           2HB      ARG  39  -9.204   1.094  -1.864
  277    HG2  ARG  39           1HG      ARG  39 -11.182   1.658  -3.339
  278    HG3  ARG  39           2HG      ARG  39 -11.398   3.169  -2.451
  279    HD2  ARG  39           1HD      ARG  39  -9.089   3.899  -3.186
  280    HD3  ARG  39           2HD      ARG  39  -8.932   2.400  -4.103
  281    HE   ARG  39           HE       ARG  39 -10.384   3.248  -5.707
  282   HH11  ARG  39          1HH2      ARG  39 -10.619   5.199  -2.813
  283   HH12  ARG  39          2HH2      ARG  39 -11.546   6.447  -3.583
  284   HH21  ARG  39          1HH1      ARG  39 -11.607   4.864  -6.672
  285   HH22  ARG  39          2HH1      ARG  39 -12.103   6.253  -5.763
  286    H    PHE  40           H        PHE  40 -10.540   1.816   1.751
  287    HA   PHE  40           HA       PHE  40  -8.492  -0.082   2.377
  288    HB2  PHE  40           1HB      PHE  40  -8.770   2.266   3.438
  289    HB3  PHE  40           2HB      PHE  40 -10.093   1.603   4.390
  290    HD1  PHE  40           2HD      PHE  40  -9.675  -0.246   6.108
  291    HD2  PHE  40           1HD      PHE  40  -6.424   1.617   3.906
  292    HE1  PHE  40           2HE      PHE  40  -8.010  -1.275   7.672
  293    HE2  PHE  40           1HE      PHE  40  -4.784   0.556   5.435
  294    HZ   PHE  40           HZ       PHE  40  -5.567  -0.873   7.326
  295    H    LYS  41           H        LYS  41 -11.896   0.291   3.291
  296    HA   LYS  41           HA       LYS  41 -12.103  -2.090   4.896
  297    HB2  LYS  41           1HB      LYS  41 -14.369  -0.406   3.660
  298    HB3  LYS  41           2HB      LYS  41 -14.546  -1.529   5.021
  299    HG2  LYS  41           1HG      LYS  41 -12.743   0.978   5.096
  300    HG3  LYS  41           2HG      LYS  41 -14.403   0.952   5.682
  301    HD2  LYS  41           1HD      LYS  41 -13.794  -0.811   7.387
  302    HD3  LYS  41           2HD      LYS  41 -12.132  -0.823   6.814
  303    HE2  LYS  41           1HE      LYS  41 -12.315   0.600   8.876
  304    HE3  LYS  41           2HE      LYS  41 -11.899   1.601   7.479
  305    HZ1  LYS  41           3HZ      LYS  41 -13.972   2.482   7.358
  306    HZ2  LYS  41           1HZ      LYS  41 -13.859   2.254   9.036
  307    HZ3  LYS  41           2HZ      LYS  41 -14.714   1.141   8.080
  308    H    ALA  42           H        ALA  42 -12.094  -1.559   1.557
  309    HA   ALA  42           HA       ALA  42 -13.963  -3.555   0.652
  310    HB1  ALA  42           1HB      ALA  42 -13.034  -1.662  -0.786
  311    HB2  ALA  42           2HB      ALA  42 -12.813  -3.249  -1.530
  312    HB3  ALA  42           3HB      ALA  42 -11.460  -2.429  -0.733
  313    H    ILE  43           H        ILE  43 -10.535  -3.601   1.557
  314    HA   ILE  43           HA       ILE  43 -10.359  -6.499   0.948
  315    HB   ILE  43           HB       ILE  43  -8.167  -4.600   1.964
  316   HG12  ILE  43          1HG1      ILE  43  -8.682  -5.496  -0.948
  317   HG13  ILE  43          2HG1      ILE  43  -9.059  -3.890  -0.340
  318   HG21  ILE  43          1HG2      ILE  43  -7.821  -7.332   0.564
  319   HG22  ILE  43          2HG2      ILE  43  -7.879  -7.193   2.311
  320   HG23  ILE  43          3HG2      ILE  43  -6.580  -6.406   1.420
  321   HD11  ILE  43          3HD1      ILE  43  -6.931  -3.739  -1.485
  322   HD12  ILE  43          1HD1      ILE  43  -6.300  -5.140  -0.618
  323   HD13  ILE  43          2HD1      ILE  43  -6.593  -3.634   0.238
  324    H    GLU  44           H        GLU  44 -10.964  -7.808   2.503
  325    HA   GLU  44           HA       GLU  44 -11.482  -7.084   5.227
  326    HB2  GLU  44           1HB      GLU  44 -11.265  -9.787   3.786
  327    HB3  GLU  44           2HB      GLU  44 -11.807  -9.621   5.465
  328    HG2  GLU  44           1HG      GLU  44 -13.720  -8.162   4.708
  329    HG3  GLU  44           2HG      GLU  44 -13.175  -8.296   3.040
  330    H    LYS  45           H        LYS  45  -8.873  -8.916   3.594
  331    HA   LYS  45           HA       LYS  45  -7.419  -9.486   6.050
  332    HB2  LYS  45           1HB      LYS  45  -6.669  -9.865   3.092
  333    HB3  LYS  45           2HB      LYS  45  -5.696 -10.450   4.453
  334    HG2  LYS  45           1HG      LYS  45  -7.638 -11.879   5.217
  335    HG3  LYS  45           2HG      LYS  45  -8.595 -11.298   3.849
  336    HD2  LYS  45           1HD      LYS  45  -6.962 -12.333   2.244
  337    HD3  LYS  45           2HD      LYS  45  -5.959 -12.883   3.589
  338    HE2  LYS  45           1HE      LYS  45  -7.409 -14.766   2.761
  339    HE3  LYS  45           2HE      LYS  45  -7.890 -14.316   4.409
  340    HZ1  LYS  45           3HZ      LYS  45  -9.151 -13.047   2.067
  341    HZ2  LYS  45           1HZ      LYS  45  -9.745 -13.190   3.646
  342    HZ3  LYS  45           2HZ      LYS  45  -9.700 -14.554   2.629
  343    H    MET  46           H        MET  46  -5.842  -8.375   6.870
  344    HA   MET  46           HA       MET  46  -5.025  -5.806   5.710
  345    HB2  MET  46           1HB      MET  46  -3.976  -5.557   8.072
  346    HB3  MET  46           2HB      MET  46  -5.734  -5.566   7.989
  347    HG2  MET  46           1HG      MET  46  -5.870  -7.882   8.764
  348    HG3  MET  46           2HG      MET  46  -4.135  -8.134   8.571
  349    HE1  MET  46           3HE      MET  46  -2.493  -6.520  11.586
  350    HE2  MET  46           1HE      MET  46  -2.388  -6.429   9.827
  351    HE3  MET  46           2HE      MET  46  -2.533  -7.993  10.616
  352    H    LYS  47           H        LYS  47  -3.879  -9.028   6.257
  353    HA   LYS  47           HA       LYS  47  -1.063  -8.571   6.362
  354    HB2  LYS  47           1HB      LYS  47  -2.671 -11.003   5.395
  355    HB3  LYS  47           2HB      LYS  47  -0.913 -11.022   5.626
  356    HG2  LYS  47           1HG      LYS  47  -1.240 -10.420   8.061
  357    HG3  LYS  47           2HG      LYS  47  -2.992 -10.431   7.817
  358    HD2  LYS  47           1HD      LYS  47  -2.911 -12.874   7.232
  359    HD3  LYS  47           2HD      LYS  47  -1.152 -12.877   7.413
  360    HE2  LYS  47           1HE      LYS  47  -2.239 -13.781   9.494
  361    HE3  LYS  47           2HE      LYS  47  -1.425 -12.247   9.857
  362    HZ1  LYS  47           3HZ      LYS  47  -3.384 -11.140  10.040
  363    HZ2  LYS  47           1HZ      LYS  47  -3.904 -12.672  10.554
  364    HZ3  LYS  47           2HZ      LYS  47  -4.207 -12.160   8.962
  365    H    ASP  48           H        ASP  48  -3.319  -9.054   3.686
  366    HA   ASP  48           HA       ASP  48  -1.365  -9.284   1.632
  367    HB2  ASP  48           1HB      ASP  48  -3.801  -9.995   1.373
  368    HB3  ASP  48           2HB      ASP  48  -4.279  -8.292   1.392
  369    H    ARG  49           H        ARG  49  -2.972  -6.554   3.168
  370    HA   ARG  49           HA       ARG  49  -2.209  -4.525   1.308
  371    HB2  ARG  49           1HB      ARG  49  -2.910  -4.370   4.279
  372    HB3  ARG  49           2HB      ARG  49  -2.653  -2.957   3.274
  373    HG2  ARG  49           1HG      ARG  49  -4.535  -3.680   1.767
  374    HG3  ARG  49           2HG      ARG  49  -4.810  -5.096   2.785
  375    HD2  ARG  49           1HD      ARG  49  -6.434  -3.294   3.396
  376    HD3  ARG  49           2HD      ARG  49  -5.313  -3.549   4.733
  377    HE   ARG  49           HE       ARG  49  -4.402  -1.447   4.360
  378   HH11  ARG  49          1HH2      ARG  49  -6.287  -2.357   1.597
  379   HH12  ARG  49          2HH2      ARG  49  -6.174  -0.804   0.845
  380   HH21  ARG  49          1HH1      ARG  49  -4.200   0.551   3.341
  381   HH22  ARG  49          2HH1      ARG  49  -5.002   0.847   1.834
  382    H    GLU  50           H        GLU  50  -0.695  -5.800   4.255
  383    HA   GLU  50           HA       GLU  50   1.489  -3.994   4.410
  384    HB2  GLU  50           1HB      GLU  50   1.187  -6.873   5.401
  385    HB3  GLU  50           2HB      GLU  50   2.572  -5.850   5.800
  386    HG2  GLU  50           1HG      GLU  50   1.067  -4.199   6.920
  387    HG3  GLU  50           2HG      GLU  50  -0.338  -5.144   6.463
  388    H    ALA  51           H        ALA  51   1.087  -7.172   2.813
  389    HA   ALA  51           HA       ALA  51   3.718  -7.557   1.907
  390    HB1  ALA  51           1HB      ALA  51   2.694  -9.116   0.228
  391    HB2  ALA  51           2HB      ALA  51   1.100  -8.438   0.568
  392    HB3  ALA  51           3HB      ALA  51   1.950  -9.334   1.819
  393    H    LEU  52           H        LEU  52   0.935  -5.971   0.292
  394    HA   LEU  52           HA       LEU  52   2.242  -5.244  -2.115
  395    HB2  LEU  52           1HB      LEU  52  -0.200  -4.126  -0.665
  396    HB3  LEU  52           2HB      LEU  52   0.295  -3.565  -2.271
  397    HG   LEU  52           HG       LEU  52  -0.208  -6.551  -1.734
  398   HD11  LEU  52          1HD1      LEU  52  -2.323  -5.485  -1.142
  399   HD12  LEU  52          2HD1      LEU  52  -2.528  -6.231  -2.721
  400   HD13  LEU  52          3HD1      LEU  52  -2.286  -4.494  -2.594
  401   HD21  LEU  52          3HD2      LEU  52  -0.533  -6.660  -4.252
  402   HD22  LEU  52          1HD2      LEU  52   1.047  -5.989  -3.873
  403   HD23  LEU  52          2HD2      LEU  52  -0.257  -4.914  -4.357
  404    H    PHE  53           H        PHE  53   1.715  -3.502   0.897
  405    HA   PHE  53           HA       PHE  53   2.796  -1.001   0.176
  406    HB2  PHE  53           1HB      PHE  53   1.549  -1.182   2.243
  407    HB3  PHE  53           2HB      PHE  53   2.584  -2.467   2.829
  408    HD1  PHE  53           2HD      PHE  53   2.715   1.162   1.759
  409    HD2  PHE  53           1HD      PHE  53   4.569  -1.954   4.180
  410    HE1  PHE  53           2HE      PHE  53   4.327   2.806   2.722
  411    HE2  PHE  53           1HE      PHE  53   6.166  -0.279   5.102
  412    HZ   PHE  53           HZ       PHE  53   6.035   2.086   4.371
  413    H    ASN  54           H        ASN  54   4.356  -3.848   1.670
  414    HA   ASN  54           HA       ASN  54   6.987  -2.778   1.900
  415    HB2  ASN  54           1HB      ASN  54   6.017  -5.678   1.601
  416    HB3  ASN  54           2HB      ASN  54   7.699  -5.261   1.962
  417   HD21  ASN  54          1HD2      ASN  54   5.036  -6.321   3.568
  418   HD22  ASN  54          2HD2      ASN  54   5.256  -5.541   5.057
  419    H    GLU  55           H        GLU  55   5.390  -4.575  -0.721
  420    HA   GLU  55           HA       GLU  55   7.662  -4.732  -2.477
  421    HB2  GLU  55           1HB      GLU  55   4.660  -5.087  -2.954
  422    HB3  GLU  55           2HB      GLU  55   5.858  -5.336  -4.231
  423    HG2  GLU  55           1HG      GLU  55   5.860  -6.870  -1.558
  424    HG3  GLU  55           2HG      GLU  55   5.190  -7.509  -3.058
  425    H    PHE  56           H        PHE  56   4.939  -2.486  -2.152
  426    HA   PHE  56           HA       PHE  56   5.322  -1.038  -4.516
  427    HB2  PHE  56           1HB      PHE  56   3.265  -0.861  -3.121
  428    HB3  PHE  56           2HB      PHE  56   4.190  -0.130  -1.817
  429    HD1  PHE  56           1HD      PHE  56   3.162   0.342  -5.409
  430    HD2  PHE  56           2HD      PHE  56   4.712   2.308  -1.838
  431    HE1  PHE  56           1HE      PHE  56   2.963   2.562  -6.525
  432    HE2  PHE  56           2HE      PHE  56   4.487   4.526  -2.978
  433    HZ   PHE  56           HZ       PHE  56   3.620   4.644  -5.315
  434    H    VAL  57           H        VAL  57   6.526  -0.420  -1.191
  435    HA   VAL  57           HA       VAL  57   8.022   1.954  -1.761
  436    HB   VAL  57           HB       VAL  57   8.308  -0.129   0.471
  437   HG11  VAL  57          1HG1      VAL  57  10.508   0.970   0.415
  438   HG12  VAL  57          2HG1      VAL  57   9.618   1.821   1.679
  439   HG13  VAL  57          3HG1      VAL  57   9.784   2.558   0.081
  440   HG21  VAL  57          3HG2      VAL  57   6.115   1.170   0.440
  441   HG22  VAL  57          1HG2      VAL  57   7.027   2.681   0.493
  442   HG23  VAL  57          2HG2      VAL  57   7.089   1.569   1.850
  443    H    ALA  58           H        ALA  58   8.956  -1.503  -1.596
  444    HA   ALA  58           HA       ALA  58  11.730  -1.139  -2.094
  445    HB1  ALA  58           1HB      ALA  58  11.729  -3.603  -2.603
  446    HB2  ALA  58           2HB      ALA  58   9.964  -3.582  -2.663
  447    HB3  ALA  58           3HB      ALA  58  10.791  -3.256  -1.144
  448    H    ALA  59           H        ALA  59   8.935  -1.634  -4.263
  449    HA   ALA  59           HA       ALA  59  10.459  -1.882  -6.699
  450    HB1  ALA  59           1HB      ALA  59   7.477  -1.301  -6.243
  451    HB2  ALA  59           2HB      ALA  59   8.185  -2.901  -6.451
  452    HB3  ALA  59           3HB      ALA  59   8.197  -1.754  -7.797
  453    H    ALA  60           H        ALA  60   8.600   0.742  -5.105
  454    HA   ALA  60           HA       ALA  60   8.816   2.697  -7.172
  455    HB1  ALA  60           1HB      ALA  60   7.132   2.892  -5.333
  456    HB2  ALA  60           2HB      ALA  60   8.150   4.334  -5.354
  457    HB3  ALA  60           3HB      ALA  60   8.422   3.070  -4.142
  458    H    ARG  61           H        ARG  61  10.783   1.983  -4.292
  459    HA   ARG  61           HA       ARG  61  12.546   4.200  -4.647
  460    HB2  ARG  61           1HB      ARG  61  12.253   3.060  -2.424
  461    HB3  ARG  61           2HB      ARG  61  12.996   1.593  -3.069
  462    HG2  ARG  61           1HG      ARG  61  15.172   2.830  -3.439
  463    HG3  ARG  61           2HG      ARG  61  14.426   4.329  -2.873
  464    HD2  ARG  61           1HD      ARG  61  14.735   1.804  -1.164
  465    HD3  ARG  61           2HD      ARG  61  15.834   3.206  -1.100
  466    HE   ARG  61           HE       ARG  61  13.189   4.159  -0.766
  467   HH11  ARG  61          1HH2      ARG  61  15.494   2.160   0.832
  468   HH12  ARG  61          2HH2      ARG  61  14.931   2.532   2.424
  469   HH21  ARG  61          1HH1      ARG  61  12.420   4.660   1.314
  470   HH22  ARG  61          2HH1      ARG  61  13.180   3.954   2.703
  Start of MODEL   20
    1    H    ILE   5           H        ILE   5 -13.234 -10.292 -11.321
    2    HA   ILE   5           HA       ILE   5 -12.114  -9.491 -13.154
    3    HB   ILE   5           HB       ILE   5 -13.680  -6.827 -12.671
    4   HG12  ILE   5          1HG1      ILE   5 -14.736  -9.258 -14.330
    5   HG13  ILE   5          2HG1      ILE   5 -15.214  -8.984 -12.665
    6   HG21  ILE   5          1HG2      ILE   5 -13.532  -6.577 -15.208
    7   HG22  ILE   5          2HG2      ILE   5 -12.677  -8.116 -15.327
    8   HG23  ILE   5          3HG2      ILE   5 -11.914  -6.749 -14.546
    9   HD11  ILE   5          3HD1      ILE   5 -15.724  -7.002 -14.935
   10   HD12  ILE   5          1HD1      ILE   5 -16.216  -6.800 -13.245
   11   HD13  ILE   5          2HD1      ILE   5 -16.911  -8.089 -14.224
   12    H    MET   6           H        MET   6 -10.951  -9.295 -10.498
   13    HA   MET   6           HA       MET   6  -9.261  -8.256  -9.206
   14    HB2  MET   6           1HB      MET   6  -8.335  -7.683 -12.110
   15    HB3  MET   6           2HB      MET   6  -7.278  -7.508 -10.695
   16    HG2  MET   6           1HG      MET   6  -7.565  -9.970 -10.173
   17    HG3  MET   6           2HG      MET   6  -8.630 -10.142 -11.581
   18    HE1  MET   6           3HE      MET   6  -7.232 -12.031 -12.713
   19    HE2  MET   6           1HE      MET   6  -6.296 -12.041 -11.207
   20    HE3  MET   6           2HE      MET   6  -5.472 -12.042 -12.764
   21    H    GLN   7           H        GLN   7 -11.683  -6.591 -10.077
   22    HA   GLN   7           HA       GLN   7 -11.008  -3.941 -10.740
   23    HB2  GLN   7           1HB      GLN   7 -13.369  -4.899 -10.807
   24    HB3  GLN   7           2HB      GLN   7 -13.417  -4.893  -9.032
   25    HG2  GLN   7           1HG      GLN   7 -13.111  -2.348  -9.064
   26    HG3  GLN   7           2HG      GLN   7 -13.100  -2.376 -10.825
   27   HE21  GLN   7          1HE2      GLN   7 -14.985  -0.839  -9.335
   28   HE22  GLN   7          2HE2      GLN   7 -16.539  -1.483  -9.578
   29    H    ALA   8           H        ALA   8 -11.397  -5.492  -7.538
   30    HA   ALA   8           HA       ALA   8 -10.964  -3.229  -5.855
   31    HB1  ALA   8           1HB      ALA   8 -10.442  -4.971  -4.087
   32    HB2  ALA   8           2HB      ALA   8 -10.307  -6.210  -5.350
   33    HB3  ALA   8           3HB      ALA   8 -11.864  -5.443  -5.033
   34    H    LYS   9           H        LYS   9  -8.620  -5.739  -7.062
   35    HA   LYS   9           HA       LYS   9  -6.284  -4.566  -5.908
   36    HB2  LYS   9           1HB      LYS   9  -6.647  -6.509  -8.284
   37    HB3  LYS   9           2HB      LYS   9  -5.066  -6.138  -7.558
   38    HG2  LYS   9           1HG      LYS   9  -5.881  -7.039  -5.319
   39    HG3  LYS   9           2HG      LYS   9  -7.457  -7.425  -6.058
   40    HD2  LYS   9           1HD      LYS   9  -6.314  -9.045  -7.652
   41    HD3  LYS   9           2HD      LYS   9  -4.741  -8.657  -6.929
   42    HE2  LYS   9           1HE      LYS   9  -5.534  -9.570  -4.706
   43    HE3  LYS   9           2HE      LYS   9  -7.109  -9.964  -5.434
   44    HZ1  LYS   9           3HZ      LYS   9  -4.939 -10.952  -6.999
   45    HZ2  LYS   9           1HZ      LYS   9  -6.266 -11.782  -6.347
   46    HZ3  LYS   9           2HZ      LYS   9  -4.871 -11.545  -5.408
   47    H    GLU  10           H        GLU  10  -7.780  -4.235  -9.107
   48    HA   GLU  10           HA       GLU  10  -5.726  -2.738 -10.353
   49    HB2  GLU  10           1HB      GLU  10  -7.558  -3.905 -11.641
   50    HB3  GLU  10           2HB      GLU  10  -8.752  -2.790 -10.959
   51    HG2  GLU  10           1HG      GLU  10  -7.617  -0.851 -12.119
   52    HG3  GLU  10           2HG      GLU  10  -6.389  -1.934 -12.767
   53    H    ASP  11           H        ASP  11  -8.554  -1.851  -8.453
   54    HA   ASP  11           HA       ASP  11  -8.240   1.063  -8.683
   55    HB2  ASP  11           1HB      ASP  11  -9.924  -0.670  -6.759
   56    HB3  ASP  11           2HB      ASP  11 -10.002   1.095  -6.808
   57    H    PHE  12           H        PHE  12  -7.044  -1.476  -6.526
   58    HA   PHE  12           HA       PHE  12  -6.165   0.217  -4.341
   59    HB2  PHE  12           1HB      PHE  12  -6.537  -2.352  -4.239
   60    HB3  PHE  12           2HB      PHE  12  -5.036  -2.543  -5.137
   61    HD1  PHE  12           2HD      PHE  12  -6.514  -1.392  -1.884
   62    HD2  PHE  12           1HD      PHE  12  -2.791  -1.999  -4.068
   63    HE1  PHE  12           2HE      PHE  12  -5.216  -1.004   0.196
   64    HE2  PHE  12           1HE      PHE  12  -1.522  -1.582  -1.969
   65    HZ   PHE  12           HZ       PHE  12  -2.723  -1.089   0.161
   66    H    LYS  13           H        LYS  13  -4.257  -1.376  -6.978
   67    HA   LYS  13           HA       LYS  13  -1.728  -0.266  -6.329
   68    HB2  LYS  13           1HB      LYS  13  -1.020  -1.091  -8.570
   69    HB3  LYS  13           2HB      LYS  13  -2.097  -2.290  -7.825
   70    HG2  LYS  13           1HG      LYS  13  -4.030  -1.266  -9.181
   71    HG3  LYS  13           2HG      LYS  13  -2.864  -0.264 -10.031
   72    HD2  LYS  13           1HD      LYS  13  -2.914  -3.350 -10.097
   73    HD3  LYS  13           2HD      LYS  13  -3.469  -2.285 -11.395
   74    HE2  LYS  13           1HE      LYS  13  -1.062  -1.343 -11.527
   75    HE3  LYS  13           2HE      LYS  13  -0.581  -2.661 -10.443
   76    HZ1  LYS  13           3HZ      LYS  13  -0.375  -3.152 -12.861
   77    HZ2  LYS  13           1HZ      LYS  13  -2.067  -3.099 -12.974
   78    HZ3  LYS  13           2HZ      LYS  13  -1.314  -4.269 -11.995
   79    H    LYS  14           H        LYS  14  -4.255   0.813  -8.611
   80    HA   LYS  14           HA       LYS  14  -2.937   3.056  -9.759
   81    HB2  LYS  14           1HB      LYS  14  -5.940   2.474  -9.321
   82    HB3  LYS  14           2HB      LYS  14  -5.373   3.905 -10.196
   83    HG2  LYS  14           1HG      LYS  14  -4.212   2.399 -11.896
   84    HG3  LYS  14           2HG      LYS  14  -4.771   1.000 -11.024
   85    HD2  LYS  14           1HD      LYS  14  -6.358   1.205 -12.839
   86    HD3  LYS  14           2HD      LYS  14  -7.242   1.854 -11.449
   87    HE2  LYS  14           1HE      LYS  14  -7.543   3.356 -13.434
   88    HE3  LYS  14           2HE      LYS  14  -6.563   4.215 -12.247
   89    HZ1  LYS  14           3HZ      LYS  14  -4.973   2.582 -13.960
   90    HZ2  LYS  14           1HZ      LYS  14  -4.842   4.240 -13.622
   91    HZ3  LYS  14           2HZ      LYS  14  -5.896   3.704 -14.840
   92    H    MET  15           H        MET  15  -4.997   2.743  -6.859
   93    HA   MET  15           HA       MET  15  -5.079   5.499  -6.195
   94    HB2  MET  15           1HB      MET  15  -6.610   3.786  -5.124
   95    HB3  MET  15           2HB      MET  15  -5.225   3.074  -4.293
   96    HG2  MET  15           1HG      MET  15  -6.478   4.617  -2.731
   97    HG3  MET  15           2HG      MET  15  -4.864   5.262  -3.026
   98    HE1  MET  15           3HE      MET  15  -6.961   7.091  -1.820
   99    HE2  MET  15           1HE      MET  15  -6.998   8.544  -2.818
  100    HE3  MET  15           2HE      MET  15  -5.462   7.808  -2.390
  101    H    MET  16           H        MET  16  -2.781   2.925  -5.275
  102    HA   MET  16           HA       MET  16  -1.103   4.459  -3.532
  103    HB2  MET  16           1HB      MET  16  -0.483   1.975  -5.236
  104    HB3  MET  16           2HB      MET  16   0.598   2.582  -3.989
  105    HG2  MET  16           1HG      MET  16  -2.293   1.688  -3.416
  106    HG3  MET  16           2HG      MET  16  -0.910   0.631  -3.214
  107    HE1  MET  16           3HE      MET  16   0.299   0.458  -0.820
  108    HE2  MET  16           1HE      MET  16   0.914   1.952  -0.119
  109    HE3  MET  16           2HE      MET  16   1.262   1.559  -1.788
  110    H    GLU  17           H        GLU  17  -0.916   4.021  -7.071
  111    HA   GLU  17           HA       GLU  17   1.616   5.316  -7.511
  112    HB2  GLU  17           1HB      GLU  17  -0.862   4.862  -9.298
  113    HB3  GLU  17           2HB      GLU  17   0.657   5.524  -9.945
  114    HG2  GLU  17           1HG      GLU  17   0.427   2.795  -8.544
  115    HG3  GLU  17           2HG      GLU  17   0.402   3.010 -10.279
  116    H    GLU  18           H        GLU  18  -1.710   6.561  -7.950
  117    HA   GLU  18           HA       GLU  18  -0.884   9.280  -8.498
  118    HB2  GLU  18           1HB      GLU  18  -3.325   9.810  -8.507
  119    HB3  GLU  18           2HB      GLU  18  -3.060   8.275  -9.366
  120    HG2  GLU  18           1HG      GLU  18  -3.717   7.043  -7.252
  121    HG3  GLU  18           2HG      GLU  18  -4.051   8.532  -6.445
  122    H    ALA  19           H        ALA  19  -1.360   7.457  -5.557
  123    HA   ALA  19           HA       ALA  19  -1.958   9.792  -3.829
  124    HB1  ALA  19           1HB      ALA  19  -1.446   6.848  -3.113
  125    HB2  ALA  19           2HB      ALA  19  -3.011   7.629  -3.228
  126    HB3  ALA  19           3HB      ALA  19  -1.909   8.079  -1.938
  127    H    LYS  20           H        LYS  20   0.748   8.812  -5.410
  128    HA   LYS  20           HA       LYS  20   2.889   8.155  -4.138
  129    HB2  LYS  20           1HB      LYS  20   2.870   9.483  -6.390
  130    HB3  LYS  20           2HB      LYS  20   2.977  10.960  -5.435
  131    HG2  LYS  20           1HG      LYS  20   5.303  10.561  -5.968
  132    HG3  LYS  20           2HG      LYS  20   5.189   9.834  -4.365
  133    HD2  LYS  20           1HD      LYS  20   4.837   7.528  -5.531
  134    HD3  LYS  20           2HD      LYS  20   5.134   8.328  -7.079
  135    HE2  LYS  20           1HE      LYS  20   7.260   7.266  -6.303
  136    HE3  LYS  20           2HE      LYS  20   7.462   9.024  -6.186
  137    HZ1  LYS  20           3HZ      LYS  20   6.373   7.551  -3.891
  138    HZ2  LYS  20           1HZ      LYS  20   7.289   8.975  -3.920
  139    HZ3  LYS  20           2HZ      LYS  20   8.043   7.477  -4.190
  140    H    PHE  21           H        PHE  21   3.604   8.330  -2.104
  141    HA   PHE  21           HA       PHE  21   3.386  10.898  -0.615
  142    HB2  PHE  21           1HB      PHE  21   2.570   9.598   1.384
  143    HB3  PHE  21           2HB      PHE  21   1.457   9.433   0.021
  144    HD1  PHE  21           1HD      PHE  21   1.430   7.229  -1.379
  145    HD2  PHE  21           2HD      PHE  21   3.812   7.569   2.222
  146    HE1  PHE  21           1HE      PHE  21   1.717   4.757  -1.337
  147    HE2  PHE  21           2HE      PHE  21   4.101   5.093   2.250
  148    HZ   PHE  21           HZ       PHE  21   3.061   3.679   0.470
  149    H    ASN  22           H        ASN  22   4.714  10.646   1.503
  150    HA   ASN  22           HA       ASN  22   7.389  10.442   0.981
  151    HB2  ASN  22           1HB      ASN  22   5.924   9.998   3.607
  152    HB3  ASN  22           2HB      ASN  22   7.671  10.242   3.529
  153   HD21  ASN  22          1HD2      ASN  22   4.535  11.808   2.690
  154   HD22  ASN  22          2HD2      ASN  22   5.124  13.399   2.757
  155    HA   PRO  23           HA       PRO  23   7.778   5.813   0.375
  156    HB2  PRO  23           1HB      PRO  23  10.488   5.626  -0.144
  157    HB3  PRO  23           2HB      PRO  23   9.345   6.317  -1.333
  158    HG2  PRO  23           1HG      PRO  23  11.141   7.781   0.649
  159    HG3  PRO  23           2HG      PRO  23  10.895   8.098  -1.099
  160    HD2  PRO  23           1HD      PRO  23   9.582   9.571   0.805
  161    HD3  PRO  23           2HD      PRO  23   8.786   9.173  -0.754
  162    H    ARG  24           H        ARG  24   9.396   7.646   2.826
  163    HA   ARG  24           HA       ARG  24  10.423   5.324   4.322
  164    HB2  ARG  24           1HB      ARG  24  11.440   7.078   5.839
  165    HB3  ARG  24           2HB      ARG  24  11.844   7.413   4.146
  166    HG2  ARG  24           1HG      ARG  24  10.014   9.151   4.014
  167    HG3  ARG  24           2HG      ARG  24   9.516   8.797   5.668
  168    HD2  ARG  24           1HD      ARG  24  11.793   9.595   6.503
  169    HD3  ARG  24           2HD      ARG  24  12.212  10.018   4.831
  170    HE   ARG  24           HE       ARG  24  10.845  11.907   4.991
  171   HH11  ARG  24          1HH2      ARG  24   9.958   9.720   7.607
  172   HH12  ARG  24          2HH2      ARG  24   8.933  10.875   8.390
  173   HH21  ARG  24          1HH1      ARG  24   9.459  13.370   6.041
  174   HH22  ARG  24          2HH1      ARG  24   8.655  12.925   7.509
  175    H    ALA  25           H        ALA  25   7.433   6.826   4.059
  176    HA   ALA  25           HA       ALA  25   6.572   6.789   6.841
  177    HB1  ALA  25           1HB      ALA  25   5.320   8.140   5.127
  178    HB2  ALA  25           2HB      ALA  25   4.237   6.943   5.827
  179    HB3  ALA  25           3HB      ALA  25   4.939   6.683   4.228
  180    H    THR  26           H        THR  26   5.143   5.246   7.749
  181    HA   THR  26           HA       THR  26   5.709   2.452   6.914
  182    HB   THR  26           HB       THR  26   4.519   3.544   9.560
  183    HG1  THR  26           1HG      THR  26   6.462   4.283   9.697
  184   HG21  THR  26          3HG2      THR  26   4.051   1.125   9.455
  185   HG22  THR  26          1HG2      THR  26   5.494   1.295  10.455
  186   HG23  THR  26          2HG2      THR  26   5.645   0.767   8.784
  187    H    PHE  27           H        PHE  27   3.906   0.946   7.199
  188    HA   PHE  27           HA       PHE  27   1.613   1.582   5.648
  189    HB2  PHE  27           1HB      PHE  27   2.446  -0.753   5.797
  190    HB3  PHE  27           2HB      PHE  27   2.235  -0.758   7.543
  191    HD1  PHE  27           1HD      PHE  27   0.216  -0.150   4.365
  192    HD2  PHE  27           2HD      PHE  27   0.096  -1.638   8.445
  193    HE1  PHE  27           1HE      PHE  27  -2.151  -0.765   4.066
  194    HE2  PHE  27           2HE      PHE  27  -2.288  -2.273   8.120
  195    HZ   PHE  27           HZ       PHE  27  -3.405  -1.854   5.936
  196    H    SER  28           H        SER  28   2.061   1.277   9.182
  197    HA   SER  28           HA       SER  28  -0.638   1.589  10.023
  198    HB2  SER  28           1HB      SER  28   1.959   2.361  11.461
  199    HB3  SER  28           2HB      SER  28   0.379   2.230  12.251
  200    HG   SER  28           HG       SER  28   1.641   0.141  10.792
  201    H    GLU  29           H        GLU  29   1.871   4.009   9.346
  202    HA   GLU  29           HA       GLU  29   0.308   6.297  10.141
  203    HB2  GLU  29           1HB      GLU  29   2.841   6.324  10.057
  204    HB3  GLU  29           2HB      GLU  29   2.798   6.072   8.303
  205    HG2  GLU  29           1HG      GLU  29   1.620   8.257   8.009
  206    HG3  GLU  29           2HG      GLU  29   1.583   8.536   9.744
  207    H    PHE  30           H        PHE  30   1.056   4.746   6.959
  208    HA   PHE  30           HA       PHE  30  -0.396   6.584   5.273
  209    HB2  PHE  30           1HB      PHE  30   1.403   5.001   4.451
  210    HB3  PHE  30           2HB      PHE  30   0.351   3.629   4.802
  211    HD1  PHE  30           1HD      PHE  30   0.621   6.768   2.703
  212    HD2  PHE  30           2HD      PHE  30  -1.525   3.008   3.217
  213    HE1  PHE  30           1HE      PHE  30  -0.622   7.172   0.587
  214    HE2  PHE  30           2HE      PHE  30  -2.743   3.429   1.082
  215    HZ   PHE  30           HZ       PHE  30  -2.303   5.514  -0.230
  216    H    ALA  31           H        ALA  31  -1.284   3.440   6.737
  217    HA   ALA  31           HA       ALA  31  -3.916   3.190   5.625
  218    HB1  ALA  31           1HB      ALA  31  -2.694   1.241   6.588
  219    HB2  ALA  31           2HB      ALA  31  -4.180   1.466   7.493
  220    HB3  ALA  31           3HB      ALA  31  -2.652   1.993   8.176
  221    H    ALA  32           H        ALA  32  -2.683   4.630   8.662
  222    HA   ALA  32           HA       ALA  32  -5.162   5.214   9.992
  223    HB1  ALA  32           1HB      ALA  32  -3.820   7.002  11.202
  224    HB2  ALA  32           2HB      ALA  32  -2.500   6.764  10.053
  225    HB3  ALA  32           3HB      ALA  32  -2.950   5.465  11.151
  226    H    LYS  33           H        LYS  33  -3.379   6.966   7.454
  227    HA   LYS  33           HA       LYS  33  -5.106   9.310   7.485
  228    HB2  LYS  33           1HB      LYS  33  -2.684   9.327   6.611
  229    HB3  LYS  33           2HB      LYS  33  -3.194   8.324   5.240
  230    HG2  LYS  33           1HG      LYS  33  -4.787  10.146   4.470
  231    HG3  LYS  33           2HG      LYS  33  -4.333  11.141   5.870
  232    HD2  LYS  33           1HD      LYS  33  -1.939  11.268   4.973
  233    HD3  LYS  33           2HD      LYS  33  -2.427  10.293   3.567
  234    HE2  LYS  33           1HE      LYS  33  -2.449  12.760   2.985
  235    HE3  LYS  33           2HE      LYS  33  -4.099  12.109   2.909
  236    HZ1  LYS  33           3HZ      LYS  33  -3.509  14.273   4.284
  237    HZ2  LYS  33           1HZ      LYS  33  -3.154  13.131   5.486
  238    HZ3  LYS  33           2HZ      LYS  33  -4.708  13.184   4.799
  239    H    HIS  34           H        HIS  34  -4.940   6.361   5.381
  240    HA   HIS  34           HA       HIS  34  -7.375   7.181   3.884
  241    HB2  HIS  34           1HB      HIS  34  -5.347   4.893   3.494
  242    HB3  HIS  34           2HB      HIS  34  -6.768   5.109   2.454
  243    HD2  HIS  34           2HD      HIS  34  -6.594   7.361   0.691
  244    HE1  HIS  34           1HE      HIS  34  -2.658   8.469   1.699
  245    HE2  HIS  34           2HE      HIS  34  -4.565   8.878   0.076
  246    H    ALA  35           H        ALA  35  -6.804   5.668   6.769
  247    HA   ALA  35           HA       ALA  35  -8.146   3.234   6.855
  248    HB1  ALA  35           1HB      ALA  35  -7.093   3.922   8.941
  249    HB2  ALA  35           2HB      ALA  35  -8.801   3.980   9.326
  250    HB3  ALA  35           3HB      ALA  35  -7.933   5.471   8.947
  251    H    LYS  36           H        LYS  36  -9.566   6.508   6.847
  252    HA   LYS  36           HA       LYS  36 -12.263   5.630   7.289
  253    HB2  LYS  36           1HB      LYS  36 -11.091   8.301   6.311
  254    HB3  LYS  36           2HB      LYS  36 -12.793   8.102   6.771
  255    HG2  LYS  36           1HG      LYS  36 -12.101   7.509   9.124
  256    HG3  LYS  36           2HG      LYS  36 -10.387   7.685   8.695
  257    HD2  LYS  36           1HD      LYS  36 -12.442  10.015   8.497
  258    HD3  LYS  36           2HD      LYS  36 -11.403   9.748   9.897
  259    HE2  LYS  36           1HE      LYS  36  -9.351  10.042   8.405
  260    HE3  LYS  36           2HE      LYS  36 -10.428  10.438   7.057
  261    HZ1  LYS  36           3HZ      LYS  36 -10.721  11.877   9.610
  262    HZ2  LYS  36           1HZ      LYS  36 -11.110  12.384   8.036
  263    HZ3  LYS  36           2HZ      LYS  36  -9.485  12.322   8.532
  264    H    ASP  37           H        ASP  37 -10.195   5.669   4.532
  265    HA   ASP  37           HA       ASP  37 -12.109   6.265   2.458
  266    HB2  ASP  37           1HB      ASP  37  -9.503   6.253   2.206
  267    HB3  ASP  37           2HB      ASP  37  -9.585   4.500   2.140
  268    H    SER  38           H        SER  38 -13.602   4.879   1.506
  269    HA   SER  38           HA       SER  38 -14.508   2.499   2.821
  270    HB2  SER  38           1HB      SER  38 -16.061   2.375   0.818
  271    HB3  SER  38           2HB      SER  38 -15.987   4.011   1.495
  272    HG   SER  38           HG       SER  38 -14.723   2.977  -0.820
  273    H    ARG  39           H        ARG  39 -12.229   3.069   0.256
  274    HA   ARG  39           HA       ARG  39 -12.044   0.442  -0.956
  275    HB2  ARG  39           1HB      ARG  39 -10.167   2.890  -0.998
  276    HB3  ARG  39           2HB      ARG  39  -9.822   1.404  -1.916
  277    HG2  ARG  39           1HG      ARG  39 -11.990   1.667  -3.201
  278    HG3  ARG  39           2HG      ARG  39 -12.382   3.128  -2.263
  279    HD2  ARG  39           1HD      ARG  39  -9.878   2.868  -4.064
  280    HD3  ARG  39           2HD      ARG  39 -11.406   3.636  -4.569
  281    HE   ARG  39           HE       ARG  39 -10.610   4.819  -2.119
  282   HH11  ARG  39          1HH2      ARG  39  -9.508   4.611  -5.409
  283   HH12  ARG  39          2HH2      ARG  39  -8.760   6.172  -5.397
  284   HH21  ARG  39          1HH1      ARG  39  -9.644   6.862  -2.104
  285   HH22  ARG  39          2HH1      ARG  39  -8.837   7.452  -3.519
  286    H    PHE  40           H        PHE  40 -10.662   1.949   1.850
  287    HA   PHE  40           HA       PHE  40  -8.446   0.121   2.176
  288    HB2  PHE  40           1HB      PHE  40  -8.539   2.427   3.255
  289    HB3  PHE  40           2HB      PHE  40  -9.866   1.891   4.278
  290    HD1  PHE  40           2HD      PHE  40  -6.273   1.162   3.382
  291    HD2  PHE  40           1HD      PHE  40  -9.401   0.579   6.364
  292    HE1  PHE  40           2HE      PHE  40  -4.650   0.087   4.902
  293    HE2  PHE  40           1HE      PHE  40  -7.749  -0.508   7.868
  294    HZ   PHE  40           HZ       PHE  40  -5.383  -0.769   7.142
  295    H    LYS  41           H        LYS  41 -11.720   0.426   3.582
  296    HA   LYS  41           HA       LYS  41 -11.655  -1.961   5.218
  297    HB2  LYS  41           1HB      LYS  41 -14.223  -0.481   4.299
  298    HB3  LYS  41           2HB      LYS  41 -13.995  -1.443   5.783
  299    HG2  LYS  41           1HG      LYS  41 -12.239   0.345   6.510
  300    HG3  LYS  41           2HG      LYS  41 -12.740   1.305   5.129
  301    HD2  LYS  41           1HD      LYS  41 -15.117   1.427   6.021
  302    HD3  LYS  41           2HD      LYS  41 -14.656   0.429   7.420
  303    HE2  LYS  41           1HE      LYS  41 -14.678   2.871   8.049
  304    HE3  LYS  41           2HE      LYS  41 -13.022   2.238   8.149
  305    HZ1  LYS  41           3HZ      LYS  41 -12.399   3.330   6.280
  306    HZ2  LYS  41           1HZ      LYS  41 -13.564   4.411   6.856
  307    HZ3  LYS  41           2HZ      LYS  41 -13.957   3.342   5.605
  308    H    ALA  42           H        ALA  42 -12.179  -1.464   1.868
  309    HA   ALA  42           HA       ALA  42 -14.067  -3.559   1.228
  310    HB1  ALA  42           1HB      ALA  42 -13.429  -1.628  -0.321
  311    HB2  ALA  42           2HB      ALA  42 -13.222  -3.200  -1.100
  312    HB3  ALA  42           3HB      ALA  42 -11.820  -2.327  -0.484
  313    H    ILE  43           H        ILE  43 -10.542  -3.447   1.713
  314    HA   ILE  43           HA       ILE  43 -10.202  -6.294   0.943
  315    HB   ILE  43           HB       ILE  43  -8.114  -4.450   2.256
  316   HG12  ILE  43          1HG1      ILE  43  -8.870  -3.169   0.270
  317   HG13  ILE  43          2HG1      ILE  43  -7.290  -3.840  -0.102
  318   HG21  ILE  43          1HG2      ILE  43  -6.455  -5.975   1.053
  319   HG22  ILE  43          2HG2      ILE  43  -7.792  -6.943   0.465
  320   HG23  ILE  43          3HG2      ILE  43  -7.469  -6.859   2.191
  321   HD11  ILE  43          3HD1      ILE  43  -8.531  -4.204  -2.061
  322   HD12  ILE  43          1HD1      ILE  43 -10.001  -4.626  -1.197
  323   HD13  ILE  43          2HD1      ILE  43  -8.663  -5.776  -1.285
  324    H    GLU  44           H        GLU  44 -10.605  -7.835   2.341
  325    HA   GLU  44           HA       GLU  44 -11.231  -7.439   5.152
  326    HB2  GLU  44           1HB      GLU  44 -11.069  -9.926   3.311
  327    HB3  GLU  44           2HB      GLU  44 -11.641  -9.998   4.993
  328    HG2  GLU  44           1HG      GLU  44 -13.529  -8.387   4.404
  329    HG3  GLU  44           2HG      GLU  44 -12.952  -8.310   2.739
  330    H    LYS  45           H        LYS  45  -8.689  -9.180   3.253
  331    HA   LYS  45           HA       LYS  45  -7.227 -10.169   5.524
  332    HB2  LYS  45           1HB      LYS  45  -6.403  -9.851   2.547
  333    HB3  LYS  45           2HB      LYS  45  -5.431 -10.727   3.763
  334    HG2  LYS  45           1HG      LYS  45  -7.377 -12.331   4.151
  335    HG3  LYS  45           2HG      LYS  45  -8.327 -11.465   2.917
  336    HD2  LYS  45           1HD      LYS  45  -6.613 -12.094   1.145
  337    HD3  LYS  45           2HD      LYS  45  -5.636 -12.936   2.374
  338    HE2  LYS  45           1HE      LYS  45  -7.049 -14.583   1.084
  339    HE3  LYS  45           2HE      LYS  45  -7.567 -14.545   2.778
  340    HZ1  LYS  45           3HZ      LYS  45  -8.819 -12.708   0.856
  341    HZ2  LYS  45           1HZ      LYS  45  -9.463 -13.407   2.260
  342    HZ3  LYS  45           2HZ      LYS  45  -9.286 -14.341   0.853
  343    H    MET  46           H        MET  46  -5.875  -9.133   6.757
  344    HA   MET  46           HA       MET  46  -5.075  -6.415   6.228
  345    HB2  MET  46           1HB      MET  46  -5.824  -7.149   8.521
  346    HB3  MET  46           2HB      MET  46  -4.424  -8.233   8.610
  347    HG2  MET  46           1HG      MET  46  -2.851  -6.275   8.462
  348    HG3  MET  46           2HG      MET  46  -4.214  -5.169   8.241
  349    HE1  MET  46           3HE      MET  46  -3.363  -3.616  10.103
  350    HE2  MET  46           1HE      MET  46  -1.948  -4.665  10.311
  351    HE3  MET  46           2HE      MET  46  -2.878  -4.142  11.709
  352    H    LYS  47           H        LYS  47  -3.607  -9.592   6.327
  353    HA   LYS  47           HA       LYS  47  -0.854  -8.937   6.244
  354    HB2  LYS  47           1HB      LYS  47  -2.358 -11.404   5.135
  355    HB3  LYS  47           2HB      LYS  47  -0.596 -11.308   5.317
  356    HG2  LYS  47           1HG      LYS  47  -0.895 -10.967   7.846
  357    HG3  LYS  47           2HG      LYS  47  -2.648 -11.095   7.623
  358    HD2  LYS  47           1HD      LYS  47  -1.910 -13.310   8.379
  359    HD3  LYS  47           2HD      LYS  47  -2.271 -13.498   6.663
  360    HE2  LYS  47           1HE      LYS  47   0.198 -13.362   6.133
  361    HE3  LYS  47           2HE      LYS  47   0.561 -13.111   7.848
  362    HZ1  LYS  47           3HZ      LYS  47  -0.557 -15.512   6.521
  363    HZ2  LYS  47           1HZ      LYS  47  -0.694 -15.279   8.196
  364    HZ3  LYS  47           2HZ      LYS  47   0.841 -15.381   7.474
  365    H    ASP  48           H        ASP  48  -3.269  -9.281   3.626
  366    HA   ASP  48           HA       ASP  48  -1.425  -9.264   1.438
  367    HB2  ASP  48           1HB      ASP  48  -3.820 -10.055   1.208
  368    HB3  ASP  48           2HB      ASP  48  -4.404  -8.425   1.559
  369    H    ARG  49           H        ARG  49  -3.131  -6.697   3.227
  370    HA   ARG  49           HA       ARG  49  -2.388  -4.488   1.521
  371    HB2  ARG  49           1HB      ARG  49  -3.177  -4.588   4.502
  372    HB3  ARG  49           2HB      ARG  49  -2.890  -3.091   3.627
  373    HG2  ARG  49           1HG      ARG  49  -4.731  -3.654   1.987
  374    HG3  ARG  49           2HG      ARG  49  -5.011  -5.172   2.871
  375    HD2  ARG  49           1HD      ARG  49  -5.284  -2.416   4.198
  376    HD3  ARG  49           2HD      ARG  49  -6.635  -3.265   3.482
  377    HE   ARG  49           HE       ARG  49  -5.250  -4.960   5.313
  378   HH11  ARG  49          1HH2      ARG  49  -7.513  -2.354   5.165
  379   HH12  ARG  49          2HH2      ARG  49  -8.188  -2.663   6.727
  380   HH21  ARG  49          1HH1      ARG  49  -6.158  -5.375   7.380
  381   HH22  ARG  49          2HH1      ARG  49  -7.430  -4.369   7.972
  382    H    GLU  50           H        GLU  50  -0.908  -5.903   4.463
  383    HA   GLU  50           HA       GLU  50   1.261  -4.035   4.713
  384    HB2  GLU  50           1HB      GLU  50   0.488  -5.635   6.561
  385    HB3  GLU  50           2HB      GLU  50   1.165  -6.995   5.646
  386    HG2  GLU  50           1HG      GLU  50   3.485  -5.934   5.813
  387    HG3  GLU  50           2HG      GLU  50   2.808  -4.582   6.720
  388    H    ALA  51           H        ALA  51   0.943  -7.225   3.047
  389    HA   ALA  51           HA       ALA  51   3.607  -7.587   2.129
  390    HB1  ALA  51           1HB      ALA  51   1.834  -9.370   2.032
  391    HB2  ALA  51           2HB      ALA  51   2.554  -9.132   0.433
  392    HB3  ALA  51           3HB      ALA  51   0.964  -8.453   0.802
  393    H    LEU  52           H        LEU  52   0.808  -6.002   0.517
  394    HA   LEU  52           HA       LEU  52   2.058  -5.219  -1.911
  395    HB2  LEU  52           1HB      LEU  52  -0.388  -4.188  -0.390
  396    HB3  LEU  52           2HB      LEU  52   0.038  -3.551  -1.978
  397    HG   LEU  52           HG       LEU  52  -0.447  -6.572  -1.525
  398   HD11  LEU  52          1HD1      LEU  52  -2.569  -5.462  -0.924
  399   HD12  LEU  52          2HD1      LEU  52  -2.767  -6.211  -2.504
  400   HD13  LEU  52          3HD1      LEU  52  -2.521  -4.466  -2.385
  401   HD21  LEU  52          3HD2      LEU  52  -0.796  -6.610  -4.029
  402   HD22  LEU  52          1HD2      LEU  52   0.805  -6.022  -3.638
  403   HD23  LEU  52          2HD2      LEU  52  -0.447  -4.885  -4.117
  404    H    PHE  53           H        PHE  53   1.589  -3.531   1.172
  405    HA   PHE  53           HA       PHE  53   2.596  -0.977   0.452
  406    HB2  PHE  53           1HB      PHE  53   1.320  -1.564   2.587
  407    HB3  PHE  53           2HB      PHE  53   2.763  -2.363   3.206
  408    HD1  PHE  53           2HD      PHE  53   1.309   0.961   2.222
  409    HD2  PHE  53           1HD      PHE  53   4.805  -1.005   3.918
  410    HE1  PHE  53           2HE      PHE  53   2.248   3.157   2.864
  411    HE2  PHE  53           1HE      PHE  53   5.727   1.221   4.550
  412    HZ   PHE  53           HZ       PHE  53   4.439   3.292   4.020
  413    H    ASN  54           H        ASN  54   4.242  -3.828   1.865
  414    HA   ASN  54           HA       ASN  54   6.884  -2.739   2.092
  415    HB2  ASN  54           1HB      ASN  54   5.927  -5.651   1.720
  416    HB3  ASN  54           2HB      ASN  54   7.598  -5.227   2.121
  417   HD21  ASN  54          1HD2      ASN  54   5.454  -6.719   3.749
  418   HD22  ASN  54          2HD2      ASN  54   5.407  -5.892   5.233
  419    H    GLU  55           H        GLU  55   5.254  -4.523  -0.558
  420    HA   GLU  55           HA       GLU  55   7.495  -4.660  -2.381
  421    HB2  GLU  55           1HB      GLU  55   4.453  -4.910  -2.839
  422    HB3  GLU  55           2HB      GLU  55   5.641  -5.174  -4.135
  423    HG2  GLU  55           1HG      GLU  55   6.654  -7.081  -2.845
  424    HG3  GLU  55           2HG      GLU  55   5.564  -6.801  -1.506
  425    H    PHE  56           H        PHE  56   4.756  -2.369  -1.938
  426    HA   PHE  56           HA       PHE  56   5.129  -0.806  -4.256
  427    HB2  PHE  56           1HB      PHE  56   3.063  -0.635  -2.857
  428    HB3  PHE  56           2HB      PHE  56   3.999  -0.043  -1.488
  429    HD1  PHE  56           1HD      PHE  56   3.058   0.806  -5.056
  430    HD2  PHE  56           2HD      PHE  56   4.555   2.402  -1.287
  431    HE1  PHE  56           1HE      PHE  56   2.966   3.115  -5.977
  432    HE2  PHE  56           2HE      PHE  56   4.447   4.707  -2.234
  433    HZ   PHE  56           HZ       PHE  56   3.657   5.066  -4.579
  434    H    VAL  57           H        VAL  57   6.382  -0.306  -0.882
  435    HA   VAL  57           HA       VAL  57   7.913   2.076  -1.394
  436    HB   VAL  57           HB       VAL  57   8.187  -0.114   0.791
  437   HG11  VAL  57          1HG1      VAL  57   9.493   1.759   2.109
  438   HG12  VAL  57          2HG1      VAL  57   9.672   2.602   0.570
  439   HG13  VAL  57          3HG1      VAL  57  10.390   1.004   0.788
  440   HG21  VAL  57          3HG2      VAL  57   6.002   1.201   0.827
  441   HG22  VAL  57          1HG2      VAL  57   6.903   2.713   0.934
  442   HG23  VAL  57          2HG2      VAL  57   6.971   1.546   2.252
  443    H    ALA  58           H        ALA  58   8.827  -1.420  -1.336
  444    HA   ALA  58           HA       ALA  58  11.605  -1.060  -1.880
  445    HB1  ALA  58           1HB      ALA  58   9.795  -3.495  -2.459
  446    HB2  ALA  58           2HB      ALA  58  10.633  -3.193  -0.938
  447    HB3  ALA  58           3HB      ALA  58  11.567  -3.539  -2.402
  448    H    ALA  59           H        ALA  59   8.764  -1.559  -4.039
  449    HA   ALA  59           HA       ALA  59  10.234  -1.739  -6.530
  450    HB1  ALA  59           1HB      ALA  59   7.939  -2.732  -6.261
  451    HB2  ALA  59           2HB      ALA  59   7.913  -1.529  -7.555
  452    HB3  ALA  59           3HB      ALA  59   7.259  -1.128  -5.957
  453    H    ALA  60           H        ALA  60   8.480   0.902  -4.803
  454    HA   ALA  60           HA       ALA  60   8.656   2.921  -6.833
  455    HB1  ALA  60           1HB      ALA  60   8.385   3.212  -3.764
  456    HB2  ALA  60           2HB      ALA  60   7.048   3.112  -4.912
  457    HB3  ALA  60           3HB      ALA  60   8.102   4.528  -4.924
  458    H    ARG  61           H        ARG  61  10.760   2.103  -4.038
  459    HA   ARG  61           HA       ARG  61  12.543   4.327  -4.407
  460    HB2  ARG  61           1HB      ARG  61  12.326   3.112  -2.180
  461    HB3  ARG  61           2HB      ARG  61  13.034   1.651  -2.894
  462    HG2  ARG  61           1HG      ARG  61  15.224   2.881  -3.300
  463    HG3  ARG  61           2HG      ARG  61  14.518   4.377  -2.647
  464    HD2  ARG  61           1HD      ARG  61  15.922   3.270  -0.907
  465    HD3  ARG  61           2HD      ARG  61  14.217   3.196  -0.400
  466    HE   ARG  61           HE       ARG  61  14.908   0.844  -1.912
  467   HH11  ARG  61          1HH2      ARG  61  15.400   2.330   1.191
  468   HH12  ARG  61          2HH2      ARG  61  15.662   0.837   2.023
  469   HH21  ARG  61          1HH1      ARG  61  15.255  -1.127  -0.812
  470   HH22  ARG  61          2HH1      ARG  61  15.580  -1.125   0.890