*HEADER    HORMONE                                 29-SEP-08   2K91              
*TITLE     ENHANCING THE ACTIVITY OF INSULIN BY STEREOSPECIFIC                   
*TITLE    2 UNFOLDING                                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 90-110;                                       
*COMPND   5 SYNONYM: INSULIN B CHAIN, INSULIN A CHAIN;                           
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: INSULIN;                                                   
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 FRAGMENT: UNP RESIDUES 25-54;                                        
*COMPND  11 SYNONYM: INSULIN B CHAIN, INSULIN A CHAIN;                           
*COMPND  12 ENGINEERED: YES;                                                     
*COMPND  13 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   4 EXPRESSION_SYSTEM_VECTOR: PBR322;                                    
*SOURCE   5 MOL_ID: 2;                                                           
*SOURCE   6 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PBR322                                     
*KEYWDS    HORMONE, INSULIN, MUTANT, CARBOHYDRATE METABOLISM, CLEAVAGE           
*KEYWDS   2 ON PAIR OF BASIC RESIDUES, DIABETES MELLITUS, DISEASE                
*KEYWDS   3 MUTATION, GLUCOSE METABOLISM, PHARMACEUTICAL, SECRETED               
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    Q.X.HUA, B.XU, K.HUANG, S.Q.HU, S.NAKARAWA, W.H.JIA,                  
*AUTHOR   2 N.F.P.PHILIPS, L.WITTAKER, J.WITTAKER, P.G.KATSOYANNIS,              
*AUTHOR   3 M.A.WEISS                                                            
*REVDAT   1   18-NOV-08 2K91    0                                                


assign ( resid 2 and name HN ) ( resid 1 and name HA# ) 3.700 1.900 0.00 
assign ( resid 3 and name HA ) ( resid 2 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 3 and name HA ) ( resid 7 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 3 and name HA ) ( resid 32 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 4 and name HN ) ( resid 3 and name HA ) 3.400 1.600 0.00 
assign ( resid 4 and name HN ) ( resid 3 and name HG1# ) 5.000 3.200 0.00 
assign ( resid 4 and name HN ) ( resid 3 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 5 and name HA ) ( resid 7 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 5 and name HA ) ( resid 7 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 5 and name HA ) ( resid 8 and name HB ) 5.000 3.200 0.00 
assign ( resid 5 and name HA ) ( resid 8 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 5 and name HG# ) ( resid 3 and name HG2# ) 7.000 4.300 0.00 
assign ( resid 6 and name HA ) ( resid 10 and name HA ) 5.000 3.200 0.00 
assign ( resid 6 and name HA ) ( resid 11 and name HB# ) 4.400 2.600 0.00 
assign ( resid 6 and name HA ) ( resid 27 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 6 and name HA ) ( resid 27 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 6 and name HB1 ) ( resid 27 and name HD1# ) 4.700 2.700 0.00 
assign ( resid 6 and name HB1 ) ( resid 27 and name HD2# ) 4.700 2.700 0.00 
assign ( resid 6 and name HB2 ) ( resid 27 and name HD1# ) 4.700 2.700 0.00 
assign ( resid 6 and name HB2 ) ( resid 27 and name HD2# ) 4.700 2.700 0.00 
assign ( resid 7 and name HA ) ( resid 3 and name HG1# ) 6.000 4.200 0.00 
assign ( resid 7 and name HA ) ( resid 3 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 7 and name HA ) ( resid 26 and name HA ) 5.000 3.200 0.00 
assign ( resid 7 and name HA ) ( resid 26 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 7 and name HA ) ( resid 26 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 7 and name HA ) ( resid 27 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 7 and name HA ) ( resid 27 and name HD2# ) 4.400 2.600 0.00 
assign ( resid 7 and name HA ) ( resid 32 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 7 and name HA ) ( resid 32 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 7 and name HB1 ) ( resid 3 and name HG1# ) 6.300 4.300 0.00 
assign ( resid 7 and name HB1 ) ( resid 3 and name HG2# ) 5.400 3.400 0.00 
assign ( resid 7 and name HB2 ) ( resid 3 and name HG1# ) 5.400 3.400 0.00 
assign ( resid 7 and name HB2 ) ( resid 3 and name HG2# ) 5.400 3.400 0.00 
assign ( resid 7 and name HB1 ) ( resid 27 and name HD1# ) 7.800 5.500 0.00 
assign ( resid 7 and name HB1 ) ( resid 27 and name HD2# ) 7.000 5.000 0.00 
assign ( resid 7 and name HB2 ) ( resid 27 and name HD1# ) 7.000 5.000 0.00 
assign ( resid 7 and name HB2 ) ( resid 27 and name HD2# ) 7.000 5.000 0.00 
assign ( resid 7 and name HN ) ( resid 8 and name HN ) 2.700 0.900 0.00 
assign ( resid 8 and name HN ) ( resid 7 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 8 and name HN ) ( resid 7 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 8 and name HN ) ( resid 9 and name HN ) 2.700 0.900 0.00 
assign ( resid 9 and name HB1 ) ( resid 10 and name HG1# ) 5.000 3.000 0.00 
assign ( resid 9 and name HB2 ) ( resid 10 and name HG1# ) 4.700 2.700 0.00 
assign ( resid 9 and name HN ) ( resid 8 and name HA ) 3.700 1.900 0.00 
assign ( resid 10 and name HN ) ( resid 9 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 10 and name HN ) ( resid 9 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 11 and name HN ) ( resid 10 and name HA ) 2.700 0.900 0.00 
assign ( resid 12 and name HA ) ( resid 13 and name HB# ) 6.000 4.200 0.00 
assign ( resid 12 and name HN ) ( resid 15 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 12 and name HN ) ( resid 15 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 12 and name HN ) ( resid 15 and name HN ) 5.000 3.200 0.00 
assign ( resid 13 and name HA ) ( resid 16 and name HB# ) 4.400 2.600 0.00 
assign ( resid 13 and name HA ) ( resid 16 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 13 and name HA ) ( resid 16 and name HD2# ) 3.700 1.900 0.00 
assign ( resid 13 and name HA ) ( resid 16 and name HG ) 5.000 3.200 0.00 
assign ( resid 13 and name HB# ) ( resid 39 and name HG1# ) 5.400 3.400 0.00 
assign ( resid 13 and name HB# ) ( resid 39 and name HG2# ) 7.000 5.000 0.00 
assign ( resid 13 and name HN ) ( resid 12 and name HA ) 2.700 0.900 0.00 
assign ( resid 13 and name HN ) ( resid 12 and name HB1 ) 4.300 2.500 0.00 
assign ( resid 13 and name HN ) ( resid 12 and name HB2 ) 4.300 2.500 0.00 
assign ( resid 13 and name HN ) ( resid 12 and name HN ) 5.000 3.200 0.00 
assign ( resid 13 and name HN ) ( resid 14 and name HN ) 2.700 0.900 0.00 
assign ( resid 14 and name HA ) ( resid 13 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 14 and name HA ) ( resid 13 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 14 and name HA ) ( resid 15 and name HB1 ) 5.500 3.700 0.00 
assign ( resid 14 and name HA ) ( resid 16 and name HB# ) 6.000 4.200 0.00 
assign ( resid 14 and name HA ) ( resid 17 and name HG# ) 6.000 4.200 0.00 
assign ( resid 14 and name HA ) ( resid 39 and name HG1# ) 6.000 4.200 0.00 
assign ( resid 14 and name HA ) ( resid 39 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 14 and name HD# ) ( resid 15 and name HA ) 5.400 3.400 0.00 
assign ( resid 14 and name HE# ) ( resid 12 and name HA ) 4.700 2.700 0.00 
assign ( resid 14 and name HE# ) ( resid 13 and name HD1# ) 8.000 5.000 0.00 
assign ( resid 14 and name HE# ) ( resid 13 and name HD2# ) 8.000 5.000 0.00 
assign ( resid 14 and name HE# ) ( resid 15 and name HA ) 7.000 5.000 0.00 
assign ( resid 14 and name HE# ) ( resid 15 and name HB1 ) 8.000 5.000 0.00 
assign ( resid 14 and name HE# ) ( resid 15 and name HB2 ) 8.000 5.000 0.00 
assign ( resid 14 and name HN ) ( resid 13 and name HA ) 3.400 1.600 0.00 
assign ( resid 14 and name HN ) ( resid 13 and name HB# ) 4.400 2.600 0.00 
assign ( resid 14 and name HN ) ( resid 13 and name HG ) 4.300 2.500 0.00 
assign ( resid 14 and name HN ) ( resid 15 and name HB1 ) 5.000 3.200 0.00 
assign ( resid 14 and name HN ) ( resid 15 and name HG# ) 5.300 3.500 0.00 
assign ( resid 15 and name HA ) ( resid 12 and name HB2 ) 5.500 3.700 0.00 
assign ( resid 15 and name HA ) ( resid 14 and name HB2 ) 5.000 3.200 0.00 
assign ( resid 15 and name HA ) ( resid 18 and name HB# ) 6.000 4.200 0.00 
assign ( resid 15 and name HN ) ( resid 14 and name HA ) 3.400 1.600 0.00 
assign ( resid 15 and name HN ) ( resid 14 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 15 and name HN ) ( resid 14 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 15 and name HN ) ( resid 16 and name HN ) 2.700 0.900 0.00 
assign ( resid 15 and name HN ) ( resid 18 and name HN ) 5.500 3.700 0.00 
assign ( resid 16 and name HA ) ( resid 2 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 16 and name HA ) ( resid 19 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 16 and name HA ) ( resid 19 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 16 and name HB# ) ( resid 39 and name HG1# ) 7.000 5.000 0.00 
assign ( resid 16 and name HB# ) ( resid 39 and name HG2# ) 7.000 5.000 0.00 
assign ( resid 16 and name HN ) ( resid 15 and name HA ) 3.400 1.600 0.00 
assign ( resid 16 and name HN ) ( resid 15 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 16 and name HN ) ( resid 15 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 16 and name HN ) ( resid 15 and name HG# ) 6.000 4.200 0.00 
assign ( resid 17 and name HB# ) ( resid 39 and name HG1# ) 7.000 5.000 0.00 
assign ( resid 17 and name HB# ) ( resid 39 and name HG2# ) 7.000 5.000 0.00 
assign ( resid 17 and name HN ) ( resid 18 and name HN ) 2.700 0.900 0.00 
assign ( resid 18 and name HB# ) ( resid 16 and name HD1# ) 7.000 5.000 0.00 
assign ( resid 18 and name HN ) ( resid 15 and name HA ) 4.300 2.500 0.00 
assign ( resid 18 and name HN ) ( resid 16 and name HA ) 3.400 1.600 0.00 
assign ( resid 18 and name HN ) ( resid 17 and name HB# ) 3.700 1.900 0.00 
assign ( resid 18 and name HN ) ( resid 17 and name HG# ) 3.700 1.900 0.00 
assign ( resid 18 and name HN ) ( resid 19 and name HN ) 2.700 0.900 0.00 
assign ( resid 19 and name HA ) ( resid 36 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 19 and name HB1 ) ( resid 2 and name HD1# ) 7.000 5.000 0.00 
assign ( resid 19 and name HB1 ) ( resid 2 and name HG1# ) 4.700 2.700 0.00 
assign ( resid 19 and name HB1 ) ( resid 36 and name HD1# ) 5.400 3.400 0.00 
assign ( resid 19 and name HB1 ) ( resid 36 and name HD2# ) 5.400 3.400 0.00 
assign ( resid 19 and name HB2 ) ( resid 2 and name HD1# ) 7.000 5.000 0.00 
assign ( resid 19 and name HB2 ) ( resid 2 and name HG1# ) 4.700 2.700 0.00 
assign ( resid 19 and name HB2 ) ( resid 36 and name HD1# ) 5.400 3.400 0.00 
assign ( resid 19 and name HB2 ) ( resid 36 and name HD2# ) 5.400 3.400 0.00 
assign ( resid 19 and name HD# ) ( resid 2 and name HD1# ) 8.000 5.000 0.00 
assign ( resid 19 and name HD# ) ( resid 2 and name HG2# ) 8.000 5.000 0.00 
assign ( resid 19 and name HD# ) ( resid 16 and name HA ) 4.700 2.700 0.00 
assign ( resid 19 and name HD# ) ( resid 16 and name HB# ) 8.000 5.000 0.00 
assign ( resid 19 and name HD# ) ( resid 16 and name HD1# ) 6.400 3.400 0.00 
assign ( resid 19 and name HD# ) ( resid 16 and name HD2# ) 6.400 3.400 0.00 
assign ( resid 19 and name HD# ) ( resid 36 and name HD1# ) 5.700 2.700 0.00 
assign ( resid 19 and name HD# ) ( resid 36 and name HD2# ) 5.700 2.700 0.00 
assign ( resid 19 and name HE# ) ( resid 2 and name HA ) 7.000 5.000 0.00 
assign ( resid 19 and name HE# ) ( resid 2 and name HB ) 7.000 5.000 0.00 
assign ( resid 19 and name HE# ) ( resid 2 and name HD1# ) 6.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 2 and name HG1# ) 6.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 2 and name HG2# ) 6.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 15 and name HA ) 6.300 4.300 0.00 
assign ( resid 19 and name HE# ) ( resid 15 and name HB1 ) 8.000 5.000 0.00 
assign ( resid 19 and name HE# ) ( resid 15 and name HB2 ) 8.000 5.000 0.00 
assign ( resid 19 and name HE# ) ( resid 16 and name HA ) 5.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 16 and name HD1# ) 6.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 16 and name HD2# ) 6.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 18 and name HB# ) 8.000 5.000 0.00 
assign ( resid 19 and name HE# ) ( resid 36 and name HD1# ) 5.700 2.700 0.00 
assign ( resid 19 and name HE# ) ( resid 36 and name HD2# ) 7.300 4.300 0.00 
assign ( resid 19 and name HN ) ( resid 16 and name HA ) 3.700 1.900 0.00 
assign ( resid 19 and name HN ) ( resid 18 and name HA ) 3.400 1.600 0.00 
assign ( resid 19 and name HN ) ( resid 18 and name HB# ) 4.400 2.600 0.00 
assign ( resid 19 and name HN ) ( resid 20 and name HN ) 3.400 1.600 0.00 
assign ( resid 20 and name HA ) ( resid 36 and name HD1# ) 6.500 4.700 0.00 
assign ( resid 20 and name HA ) ( resid 36 and name HD2# ) 6.500 4.700 0.00 
assign ( resid 20 and name HA ) ( resid 45 and name HA ) 3.700 1.900 0.00 
assign ( resid 20 and name HN ) ( resid 19 and name HA ) 3.400 1.600 0.00 
assign ( resid 20 and name HN ) ( resid 21 and name HN ) 4.500 2.700 0.00 
assign ( resid 21 and name HN ) ( resid 20 and name HA ) 3.400 1.600 0.00 
assign ( resid 21 and name HN ) ( resid 20 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 21 and name HN ) ( resid 20 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 22 and name HA ) ( resid 13 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 22 and name HA ) ( resid 23 and name HG1# ) 6.000 4.200 0.00 
assign ( resid 22 and name HA ) ( resid 23 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 22 and name HD# ) ( resid 13 and name HB# ) 8.000 5.000 0.00 
assign ( resid 22 and name HD# ) ( resid 13 and name HD1# ) 8.000 5.000 0.00 
assign ( resid 22 and name HD# ) ( resid 13 and name HD2# ) 8.000 5.000 0.00 
assign ( resid 22 and name HD# ) ( resid 27 and name HD1# ) 8.000 5.000 0.00 
assign ( resid 22 and name HD# ) ( resid 27 and name HD2# ) 8.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 13 and name HD1# ) 8.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 13 and name HD2# ) 8.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 13 and name HG ) 5.400 3.400 0.00 
assign ( resid 22 and name HE# ) ( resid 24 and name HA ) 7.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 27 and name HD1# ) 6.400 3.400 0.00 
assign ( resid 22 and name HE# ) ( resid 27 and name HD2# ) 6.400 3.400 0.00 
assign ( resid 22 and name HD# ) ( resid 39 and name HG1# ) 8.000 5.000 0.00 
assign ( resid 22 and name HD# ) ( resid 39 and name HG2# ) 8.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 39 and name HG1# ) 8.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 39 and name HG2# ) 8.000 5.000 0.00 
assign ( resid 23 and name HN ) ( resid 22 and name HA ) 2.700 0.900 0.00 
assign ( resid 23 and name HN ) ( resid 22 and name HB# ) 4.400 2.600 0.00 
assign ( resid 24 and name HA ) ( resid 10 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 24 and name HA ) ( resid 10 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 24 and name HB# ) ( resid 10 and name HG1# ) 5.400 3.400 0.00 
assign ( resid 24 and name HB# ) ( resid 10 and name HG2# ) 4.700 2.700 0.00 
assign ( resid 24 and name HN ) ( resid 23 and name HA ) 2.700 0.900 0.00 
assign ( resid 24 and name HN ) ( resid 23 and name HB ) 3.400 1.600 0.00 
assign ( resid 24 and name HN ) ( resid 23 and name HG1# ) 4.400 2.600 0.00 
assign ( resid 24 and name HN ) ( resid 23 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 25 and name HA ) ( resid 10 and name HD1# ) 4.400 2.600 0.00 
assign ( resid 25 and name HA ) ( resid 10 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 25 and name HB1 ) ( resid 27 and name HD1# ) 7.000 5.000 0.00 
assign ( resid 25 and name HB2 ) ( resid 27 and name HD1# ) 7.000 5.000 0.00 
assign ( resid 25 and name HN ) ( resid 10 and name HA ) 5.000 3.200 0.00 
assign ( resid 25 and name HN ) ( resid 10 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 25 and name HN ) ( resid 10 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 25 and name HN ) ( resid 24 and name HA ) 2.700 0.900 0.00 
assign ( resid 25 and name HN ) ( resid 24 and name HB# ) 4.400 2.600 0.00 
assign ( resid 25 and name HN ) ( resid 26 and name HN ) 4.300 2.500 0.00 
assign ( resid 26 and name HA ) ( resid 10 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 26 and name HA ) ( resid 10 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 26 and name HA ) ( resid 27 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 26 and name HA ) ( resid 27 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 26 and name HD2 ) ( resid 10 and name HD1# ) 4.400 2.600 0.00 
assign ( resid 26 and name HE1 ) ( resid 9 and name HA ) 2.700 0.900 0.00 
assign ( resid 26 and name HN ) ( resid 10 and name HD1# ) 3.700 1.900 0.00 
assign ( resid 26 and name HN ) ( resid 10 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 26 and name HN ) ( resid 25 and name HA ) 2.700 0.900 0.00 
assign ( resid 26 and name HN ) ( resid 25 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 26 and name HN ) ( resid 25 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 27 and name HA ) ( resid 31 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 27 and name HA ) ( resid 31 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 27 and name HN ) ( resid 26 and name HA ) 3.400 1.600 0.00 
assign ( resid 27 and name HN ) ( resid 26 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 27 and name HN ) ( resid 26 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 7 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 7 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 27 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 27 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 32 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 32 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 28 and name HA ) ( resid 32 and name HD1# ) 3.700 1.900 0.00 
assign ( resid 28 and name HA ) ( resid 32 and name HD2# ) 4.400 2.600 0.00 
assign ( resid 28 and name HN ) ( resid 27 and name HA ) 3.400 1.600 0.00 
assign ( resid 28 and name HN ) ( resid 27 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 28 and name HN ) ( resid 27 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 28 and name HN ) ( resid 27 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 28 and name HN ) ( resid 27 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 28 and name HN ) ( resid 27 and name HG ) 5.000 3.200 0.00 
assign ( resid 28 and name HN ) ( resid 31 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 28 and name HN ) ( resid 31 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 28 and name HN ) ( resid 32 and name HA ) 5.500 3.700 0.00 
assign ( resid 29 and name HN ) ( resid 28 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 29 and name HN ) ( resid 28 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 30 and name HN ) ( resid 29 and name HA# ) 3.700 1.900 0.00 
assign ( resid 30 and name HN ) ( resid 31 and name HN ) 2.700 0.900 0.00 
assign ( resid 31 and name HA ) ( resid 34 and name HB# ) 6.000 4.200 0.00 
assign ( resid 31 and name HN ) ( resid 29 and name HA# ) 4.400 2.600 0.00 
assign ( resid 31 and name HN ) ( resid 30 and name HA ) 3.400 1.600 0.00 
assign ( resid 31 and name HN ) ( resid 30 and name HB# ) 4.400 2.600 0.00 
assign ( resid 31 and name HN ) ( resid 32 and name HN ) 2.700 0.900 0.00 
assign ( resid 32 and name HA ) ( resid 27 and name HG ) 5.000 3.200 0.00 
assign ( resid 32 and name HA ) ( resid 35 and name HB# ) 3.700 1.900 0.00 
assign ( resid 32 and name HB1 ) ( resid 36 and name HD1# ) 4.700 2.700 0.00 
assign ( resid 32 and name HB2 ) ( resid 36 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 32 and name HN ) ( resid 31 and name HA ) 3.400 1.600 0.00 
assign ( resid 32 and name HN ) ( resid 31 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 32 and name HN ) ( resid 31 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 32 and name HN ) ( resid 33 and name HN ) 3.400 1.600 0.00 
assign ( resid 32 and name HN ) ( resid 34 and name HB# ) 6.000 4.200 0.00 
assign ( resid 33 and name HA ) ( resid 36 and name HB# ) 4.400 2.600 0.00 
assign ( resid 33 and name HA ) ( resid 36 and name HD1# ) 4.400 2.600 0.00 
assign ( resid 33 and name HA ) ( resid 36 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 33 and name HA ) ( resid 36 and name HG ) 5.000 3.200 0.00 
assign ( resid 33 and name HN ) ( resid 30 and name HA ) 3.400 1.600 0.00 
assign ( resid 33 and name HN ) ( resid 31 and name HA ) 4.300 2.500 0.00 
assign ( resid 33 and name HN ) ( resid 32 and name HA ) 3.400 1.600 0.00 
assign ( resid 33 and name HN ) ( resid 34 and name HN ) 2.700 0.900 0.00 
assign ( resid 34 and name HA ) ( resid 37 and name HB# ) 3.700 1.900 0.00 
assign ( resid 34 and name HN ) ( resid 31 and name HA ) 2.900 1.100 0.00 
assign ( resid 34 and name HN ) ( resid 33 and name HA ) 4.300 2.500 0.00 
assign ( resid 34 and name HN ) ( resid 33 and name HB ) 3.400 1.600 0.00 
assign ( resid 34 and name HN ) ( resid 35 and name HB# ) 5.300 3.500 0.00 
assign ( resid 35 and name HA ) ( resid 39 and name HG1# ) 4.400 2.600 0.00 
assign ( resid 35 and name HN ) ( resid 33 and name HB ) 5.000 3.200 0.00 
assign ( resid 35 and name HN ) ( resid 34 and name HA ) 3.400 1.600 0.00 
assign ( resid 35 and name HN ) ( resid 34 and name HB# ) 4.400 2.600 0.00 
assign ( resid 35 and name HN ) ( resid 34 and name HG# ) 3.700 1.900 0.00 
assign ( resid 35 and name HN ) ( resid 36 and name HA ) 5.500 3.700 0.00 
assign ( resid 35 and name HN ) ( resid 36 and name HN ) 2.700 0.900 0.00 
assign ( resid 35 and name HN ) ( resid 37 and name HB# ) 5.300 3.500 0.00 
assign ( resid 36 and name HA ) ( resid 39 and name HB ) 4.300 2.500 0.00 
assign ( resid 36 and name HA ) ( resid 39 and name HG1# ) 3.700 1.900 0.00 
assign ( resid 36 and name HA ) ( resid 39 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 36 and name HB# ) ( resid 33 and name HG1# ) 4.700 2.700 0.00 
assign ( resid 36 and name HB# ) ( resid 39 and name HG1# ) 6.300 4.300 0.00 
assign ( resid 36 and name HB# ) ( resid 39 and name HG2# ) 5.400 3.400 0.00 
assign ( resid 36 and name HB# ) ( resid 33 and name HB ) 6.000 4.200 0.00 
assign ( resid 36 and name HG ) ( resid 39 and name HG1# ) 6.000 4.200 0.00 
assign ( resid 36 and name HG ) ( resid 39 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 36 and name HN ) ( resid 33 and name HA ) 3.400 1.600 0.00 
assign ( resid 36 and name HN ) ( resid 35 and name HA ) 3.400 1.600 0.00 
assign ( resid 36 and name HN ) ( resid 35 and name HB# ) 3.700 1.900 0.00 
assign ( resid 36 and name HN ) ( resid 37 and name HN ) 3.400 1.600 0.00 
assign ( resid 37 and name HA ) ( resid 33 and name HG1# ) 6.000 4.200 0.00 
assign ( resid 37 and name HB# ) ( resid 38 and name HB1 ) 7.000 5.000 0.00 
assign ( resid 37 and name HB# ) ( resid 38 and name HB2 ) 7.000 5.000 0.00 
assign ( resid 37 and name HB# ) ( resid 38 and name HD1# ) 6.300 4.300 0.00 
assign ( resid 37 and name HB# ) ( resid 38 and name HD2# ) 6.300 4.300 0.00 
assign ( resid 37 and name HD# ) ( resid 33 and name HG2# ) 6.400 3.400 0.00 
assign ( resid 37 and name HD# ) ( resid 34 and name HA ) 5.400 3.400 0.00 
assign ( resid 37 and name HD# ) ( resid 38 and name HA ) 5.400 3.400 0.00 
assign ( resid 37 and name HD# ) ( resid 38 and name HB1 ) 6.400 3.400 0.00 
assign ( resid 37 and name HD# ) ( resid 38 and name HB2 ) 6.400 3.400 0.00 
assign ( resid 37 and name HD# ) ( resid 38 and name HD1# ) 5.700 2.700 0.00 
assign ( resid 37 and name HD# ) ( resid 38 and name HD2# ) 5.700 2.700 0.00 
assign ( resid 37 and name HD# ) ( resid 38 and name HG ) 7.000 5.000 0.00 
assign ( resid 37 and name HE# ) ( resid 38 and name HD1# ) 7.300 4.300 0.00 
assign ( resid 37 and name HE# ) ( resid 38 and name HD2# ) 5.700 2.700 0.00 
assign ( resid 37 and name HN ) ( resid 34 and name HA ) 4.300 2.500 0.00 
assign ( resid 37 and name HN ) ( resid 36 and name HA ) 3.400 1.600 0.00 
assign ( resid 37 and name HN ) ( resid 36 and name HB# ) 3.700 1.900 0.00 
assign ( resid 37 and name HN ) ( resid 38 and name HN ) 3.400 1.600 0.00 
assign ( resid 37 and name HD# ) ( resid 41 and name HA# ) 6.000 4.200 0.00 
assign ( resid 38 and name HN ) ( resid 35 and name HB# ) 6.000 4.200 0.00 
assign ( resid 38 and name HN ) ( resid 37 and name HA ) 4.300 2.500 0.00 
assign ( resid 38 and name HN ) ( resid 37 and name HB# ) 3.700 1.900 0.00 
assign ( resid 38 and name HN ) ( resid 39 and name HN ) 2.700 0.900 0.00 
assign ( resid 39 and name HN ) ( resid 38 and name HA ) 3.700 1.900 0.00 
assign ( resid 39 and name HN ) ( resid 38 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 39 and name HN ) ( resid 38 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 40 and name HA ) ( resid 39 and name HG2# ) 5.300 3.500 0.00 
assign ( resid 40 and name HN ) ( resid 36 and name HA ) 3.700 1.900 0.00 
assign ( resid 40 and name HN ) ( resid 37 and name HA ) 5.000 3.200 0.00 
assign ( resid 40 and name HN ) ( resid 39 and name HA ) 3.400 1.600 0.00 
assign ( resid 40 and name HN ) ( resid 39 and name HB ) 3.700 1.900 0.00 
assign ( resid 40 and name HN ) ( resid 39 and name HG1# ) 5.000 3.000 0.00 
assign ( resid 40 and name HN ) ( resid 39 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 40 and name HN ) ( resid 39 and name HN ) 2.700 0.900 0.00 
assign ( resid 40 and name HN ) ( resid 41 and name HN ) 3.400 1.600 0.00 
assign ( resid 40 and name HB# ) ( resid 43 and name HB# ) 5.000 3.000 0.00 
assign ( resid 41 and name HN ) ( resid 37 and name HA ) 5.000 3.200 0.00 
assign ( resid 41 and name HN ) ( resid 40 and name HA ) 3.700 1.900 0.00 
assign ( resid 41 and name HA# ) ( resid 43 and name HN ) 4.400 2.600 0.00 
assign ( resid 43 and name HN ) ( resid 42 and name HN ) 3.400 1.600 0.00 
assign ( resid 43 and name HN ) ( resid 42 and name HA ) 3.400 1.600 0.00 
assign ( resid 43 and name HN ) ( resid 42 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 43 and name HN ) ( resid 42 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 43 and name HN ) ( resid 42 and name HG# ) 6.000 4.200 0.00 
assign ( resid 44 and name HN ) ( resid 42 and name HA ) 3.400 1.600 0.00 
assign ( resid 44 and name HN ) ( resid 43 and name HA ) 3.400 1.600 0.00 
assign ( resid 44 and name HN ) ( resid 43 and name HN ) 2.700 0.900 0.00 
assign ( resid 45 and name HN ) ( resid 44 and name HA# ) 3.700 1.900 0.00 
assign ( resid 46 and name HD# ) ( resid 45 and name HB# ) 8.000 5.000 0.00 
assign ( resid 47 and name HD# ) ( resid 45 and name HB# ) 8.500 5.000 0.00 
assign ( resid 46 and name HN ) ( resid 45 and name HB# ) 4.300 2.500 0.00 
assign ( resid 47 and name HD# ) ( resid 2 and name HG2# ) 6.400 3.400 0.00 
assign ( resid 47 and name HD# ) ( resid 3 and name HG1# ) 8.000 5.000 0.00 
assign ( resid 47 and name HD# ) ( resid 36 and name HD1# ) 7.300 4.300 0.00 
assign ( resid 47 and name HD# ) ( resid 36 and name HD2# ) 8.000 5.000 0.00 
assign ( resid 47 and name HD# ) ( resid 48 and name HG2# ) 6.400 3.400 0.00 
assign ( resid 47 and name HE# ) ( resid 2 and name HG2# ) 8.000 5.000 0.00 
assign ( resid 47 and name HE# ) ( resid 33 and name HG1# ) 8.000 5.000 0.00 
assign ( resid 47 and name HE# ) ( resid 36 and name HD1# ) 7.300 4.300 0.00 
assign ( resid 47 and name HN ) ( resid 46 and name HA ) 2.700 0.900 0.00 
assign ( resid 48 and name HA ) ( resid 47 and name HB1 ) 6.000 4.200 0.00 
assign ( resid 48 and name HA ) ( resid 47 and name HB2 ) 6.000 4.200 0.00 
assign ( resid 48 and name HN ) ( resid 47 and name HA ) 3.400 1.600 0.00 
assign ( resid 48 and name HN ) ( resid 47 and name HB1 ) 4.400 2.600 0.00 
assign ( resid 48 and name HN ) ( resid 47 and name HB2 ) 4.400 2.600 0.00 
assign ( resid 48 and name HN ) ( resid 47 and name HN ) 3.400 1.600 0.00 
assign ( resid 49 and name HA ) ( resid 50 and name HD# ) 3.700 1.900 0.00 
assign ( resid 49 and name HN ) ( resid 48 and name HA ) 2.700 0.900 0.00 
assign ( resid 49 and name HN ) ( resid 48 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 50 and name HD# ) ( resid 48 and name HG1 ) 4.400 2.600 0.00 
assign ( resid 50 and name HD# ) ( resid 49 and name HB# ) 7.000 5.000 0.00 
assign ( resid 50 and name HD# ) ( resid 49 and name HG# ) 7.000 5.000 0.00 
assign ( resid 50 and name HD# ) ( resid 51 and name HG2# ) 5.400 3.400 0.00 
assign ( resid 51 and name HN ) ( resid 50 and name HA ) 2.700 0.900 0.00 
assign ( resid 3 and name HA ) ( resid 3 and name HG1# ) 3.700 1.900 0.00 
assign ( resid 3 and name HA ) ( resid 3 and name HG2# ) 4.300 2.500 0.00 
assign ( resid 3 and name HN ) ( resid 3 and name HG1# ) 3.700 1.900 0.00 
assign ( resid 3 and name HN ) ( resid 3 and name HG2# ) 4.300 2.500 0.00 
assign ( resid 6 and name HA ) ( resid 6 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 6 and name HA ) ( resid 6 and name HB2 ) 3.400 1.600 0.00 
assign ( resid 6 and name HN ) ( resid 6 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 6 and name HN ) ( resid 6 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 7 and name HA ) ( resid 7 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 7 and name HA ) ( resid 7 and name HB2 ) 3.400 1.600 0.00 
assign ( resid 7 and name HN ) ( resid 7 and name HB1 ) 3.400 1.600 0.00 
assign ( resid 7 and name HN ) ( resid 7 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 19 and name HA ) ( resid 19 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 19 and name HA ) ( resid 19 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 19 and name HN ) ( resid 19 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 19 and name HN ) ( resid 19 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 20 and name HA ) ( resid 20 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 20 and name HA ) ( resid 20 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 20 and name HN ) ( resid 20 and name HB1 ) 4.300 2.500 0.00 
assign ( resid 20 and name HN ) ( resid 20 and name HB2 ) 3.400 1.600 0.00 
assign ( resid 21 and name HA ) ( resid 21 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 21 and name HA ) ( resid 21 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 21 and name HN ) ( resid 21 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 21 and name HN ) ( resid 21 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 26 and name HA ) ( resid 26 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 26 and name HA ) ( resid 26 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 26 and name HN ) ( resid 26 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 26 and name HN ) ( resid 26 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 28 and name HA ) ( resid 28 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 28 and name HA ) ( resid 28 and name HB2 ) 3.400 1.600 0.00 
assign ( resid 28 and name HN ) ( resid 28 and name HB1 ) 4.300 2.500 0.00 
assign ( resid 28 and name HN ) ( resid 28 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 31 and name HA ) ( resid 31 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 31 and name HA ) ( resid 31 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 31 and name HN ) ( resid 31 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 31 and name HN ) ( resid 31 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 32 and name HA ) ( resid 32 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 32 and name HA ) ( resid 32 and name HB2 ) 3.000 1.200 0.00 
assign ( resid 32 and name HN ) ( resid 32 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 32 and name HN ) ( resid 32 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 33 and name HA ) ( resid 33 and name HG1# ) 3.700 1.900 0.00 
assign ( resid 33 and name HA ) ( resid 33 and name HG2# ) 4.300 2.500 0.00 
assign ( resid 33 and name HN ) ( resid 33 and name HG1# ) 4.300 2.500 0.00 
assign ( resid 33 and name HN ) ( resid 33 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 39 and name HA ) ( resid 39 and name HG1# ) 3.700 1.900 0.00 
assign ( resid 39 and name HA ) ( resid 39 and name HG2# ) 4.300 2.500 0.00 
assign ( resid 39 and name HN ) ( resid 39 and name HG1# ) 3.700 1.900 0.00 
assign ( resid 39 and name HN ) ( resid 39 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 42 and name HA ) ( resid 42 and name HB1 ) 3.000 1.200 0.00 
assign ( resid 42 and name HA ) ( resid 42 and name HB2 ) 3.400 1.600 0.00 
assign ( resid 42 and name HN ) ( resid 42 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 42 and name HN ) ( resid 42 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 4 and name HA ) ( resid 4 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 4 and name HA ) ( resid 4 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 4 and name HN ) ( resid 4 and name HB1 ) 3.400 1.600 0.00 
assign ( resid 4 and name HN ) ( resid 4 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 9 and name HA ) ( resid 9 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 9 and name HA ) ( resid 9 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 9 and name HN ) ( resid 9 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 9 and name HN ) ( resid 9 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 12 and name HA ) ( resid 12 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 12 and name HA ) ( resid 12 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 12 and name HN ) ( resid 12 and name HB1 ) 3.400 1.600 0.00 
assign ( resid 12 and name HN ) ( resid 12 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 14 and name HA ) ( resid 14 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 14 and name HA ) ( resid 14 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 14 and name HN ) ( resid 14 and name HB1 ) 3.400 1.600 0.00 
assign ( resid 14 and name HN ) ( resid 14 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 15 and name HA ) ( resid 15 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 15 and name HA ) ( resid 15 and name HB2 ) 2.500 0.700 0.00 
assign ( resid 15 and name HN ) ( resid 15 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 15 and name HN ) ( resid 15 and name HB2 ) 3.400 1.600 0.00 
assign ( resid 25 and name HA ) ( resid 25 and name HB1 ) 2.700 0.900 0.00 
assign ( resid 25 and name HA ) ( resid 25 and name HB2 ) 2.900 1.100 0.00 
assign ( resid 25 and name HN ) ( resid 25 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 25 and name HN ) ( resid 25 and name HB2 ) 3.900 2.100 0.00 
assign ( resid 27 and name HA ) ( resid 27 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 27 and name HA ) ( resid 27 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 27 and name HN ) ( resid 27 and name HB1 ) 3.400 1.600 0.00 
assign ( resid 27 and name HN ) ( resid 27 and name HB2 ) 3.900 2.100 0.00 
assign ( resid 38 and name HA ) ( resid 38 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 38 and name HA ) ( resid 38 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 38 and name HN ) ( resid 38 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 38 and name HN ) ( resid 38 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 46 and name HA ) ( resid 46 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 46 and name HA ) ( resid 46 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 46 and name HN ) ( resid 46 and name HB1 ) 3.400 1.600 0.00 
assign ( resid 46 and name HN ) ( resid 46 and name HB2 ) 4.000 2.200 0.00 
assign ( resid 47 and name HA ) ( resid 47 and name HB1 ) 2.500 0.700 0.00 
assign ( resid 47 and name HA ) ( resid 47 and name HB2 ) 2.700 0.900 0.00 
assign ( resid 47 and name HN ) ( resid 47 and name HB1 ) 3.700 1.900 0.00 
assign ( resid 47 and name HN ) ( resid 47 and name HB2 ) 3.700 1.900 0.00 
assign ( resid 14 and name HE# ) ( resid 14 and name HB1 ) 5.400 3.400 0.00 
assign ( resid 14 and name HE# ) ( resid 14 and name HB2 ) 5.400 3.400 0.00 
assign ( resid 14 and name HD# ) ( resid 14 and name HA ) 4.700 2.700 0.00 
assign ( resid 14 and name HD# ) ( resid 14 and name HB1 ) 4.700 2.700 0.00 
assign ( resid 14 and name HD# ) ( resid 14 and name HB2 ) 4.700 2.700 0.00 
assign ( resid 19 and name HE# ) ( resid 19 and name HA ) 5.400 3.400 0.00 
assign ( resid 19 and name HE# ) ( resid 19 and name HB1 ) 7.000 5.000 0.00 
assign ( resid 19 and name HE# ) ( resid 19 and name HB2 ) 7.000 5.000 0.00 
assign ( resid 19 and name HD# ) ( resid 19 and name HA ) 4.700 2.700 0.00 
assign ( resid 19 and name HD# ) ( resid 19 and name HB1 ) 4.700 2.700 0.00 
assign ( resid 19 and name HD# ) ( resid 19 and name HB2 ) 4.700 2.700 0.00 
assign ( resid 47 and name HE# ) ( resid 47 and name HB1 ) 7.000 5.000 0.00 
assign ( resid 47 and name HE# ) ( resid 47 and name HB2 ) 7.000 5.000 0.00 
assign ( resid 47 and name HD# ) ( resid 47 and name HA ) 4.700 2.700 0.00 
assign ( resid 47 and name HD# ) ( resid 47 and name HB1 ) 4.700 2.700 0.00 
assign ( resid 47 and name HD# ) ( resid 47 and name HB2 ) 4.700 2.700 0.00 
assign ( resid 22 and name HD# ) ( resid 22 and name HA ) 4.700 2.700 0.00 
assign ( resid 22 and name HD# ) ( resid 22 and name HB# ) 4.700 2.700 0.00 
assign ( resid 22 and name HE# ) ( resid 22 and name HA ) 7.000 5.000 0.00 
assign ( resid 22 and name HE# ) ( resid 22 and name HB# ) 7.000 5.000 0.00 
assign ( resid 37 and name HE# ) ( resid 37 and name HA ) 7.000 5.000 0.00 
assign ( resid 37 and name HE# ) ( resid 37 and name HB# ) 5.400 3.400 0.00 
assign ( resid 37 and name HD# ) ( resid 37 and name HA ) 4.700 2.700 0.00 
assign ( resid 37 and name HD# ) ( resid 37 and name HB# ) 4.700 2.700 0.00 
assign ( resid 46 and name HD# ) ( resid 46 and name HA ) 7.000 5.000 0.00 
assign ( resid 46 and name HD# ) ( resid 46 and name HB1 ) 4.700 2.700 0.00 
assign ( resid 46 and name HD# ) ( resid 46 and name HB2 ) 4.700 2.700 0.00 
assign ( resid 46 and name HE# ) ( resid 46 and name HB1 ) 7.000 5.000 0.00 
assign ( resid 46 and name HE# ) ( resid 46 and name HB2 ) 7.000 5.000 0.00 
assign ( resid 26 and name HD2 ) ( resid 26 and name HA ) 7.000 5.000 0.00 
assign ( resid 26 and name HD2 ) ( resid 26 and name HB1 ) 5.400 3.400 0.00 
assign ( resid 26 and name HD2 ) ( resid 26 and name HB2 ) 5.400 3.400 0.00 
assign ( resid 2 and name HA ) ( resid 2 and name HB ) 3.400 1.600 0.00 
assign ( resid 2 and name HA ) ( resid 2 and name HD1# ) 4.400 2.600 0.00 
assign ( resid 2 and name HA ) ( resid 2 and name HG1# ) 6.000 4.200 0.00 
assign ( resid 2 and name HA ) ( resid 2 and name HG2# ) 5.300 3.500 0.00 
assign ( resid 2 and name HN ) ( resid 2 and name HA ) 3.400 1.600 0.00 
assign ( resid 2 and name HN ) ( resid 2 and name HB ) 3.400 1.600 0.00 
assign ( resid 2 and name HN ) ( resid 2 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 3 and name HA ) ( resid 3 and name HB ) 2.700 0.900 0.00 
assign ( resid 3 and name HN ) ( resid 3 and name HA ) 3.400 1.600 0.00 
assign ( resid 3 and name HN ) ( resid 3 and name HB ) 3.700 1.900 0.00 
assign ( resid 4 and name HA ) ( resid 4 and name HG# ) 5.300 3.500 0.00 
assign ( resid 4 and name HN ) ( resid 4 and name HA ) 3.400 1.600 0.00 
assign ( resid 4 and name HN ) ( resid 4 and name HG# ) 6.000 4.200 0.00 
assign ( resid 5 and name HA ) ( resid 5 and name HB# ) 4.400 2.600 0.00 
assign ( resid 5 and name HA ) ( resid 5 and name HG# ) 4.400 2.600 0.00 
assign ( resid 5 and name HN ) ( resid 5 and name HA ) 3.400 1.600 0.00 
assign ( resid 5 and name HN ) ( resid 5 and name HB# ) 4.400 2.600 0.00 
assign ( resid 5 and name HN ) ( resid 5 and name HG# ) 4.400 2.600 0.00 
assign ( resid 6 and name HN ) ( resid 6 and name HA ) 5.000 3.200 0.00 
assign ( resid 7 and name HN ) ( resid 7 and name HA ) 5.000 3.200 0.00 
assign ( resid 8 and name HA ) ( resid 8 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 8 and name HB ) ( resid 8 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 8 and name HN ) ( resid 8 and name HA ) 3.400 1.600 0.00 
assign ( resid 8 and name HN ) ( resid 8 and name HB ) 4.300 2.500 0.00 
assign ( resid 8 and name HN ) ( resid 8 and name HG2# ) 5.300 3.500 0.00 
assign ( resid 9 and name HN ) ( resid 9 and name HA ) 3.400 1.600 0.00 
assign ( resid 10 and name HA ) ( resid 10 and name HB ) 3.400 1.600 0.00 
assign ( resid 10 and name HA ) ( resid 10 and name HD1# ) 3.700 1.900 0.00 
assign ( resid 10 and name HA ) ( resid 10 and name HG1# ) 4.400 2.600 0.00 
assign ( resid 10 and name HA ) ( resid 10 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 10 and name HN ) ( resid 10 and name HA ) 3.400 1.600 0.00 
assign ( resid 10 and name HN ) ( resid 10 and name HB ) 3.400 1.600 0.00 
assign ( resid 10 and name HN ) ( resid 10 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 10 and name HN ) ( resid 10 and name HG2# ) 5.300 3.500 0.00 
assign ( resid 12 and name HN ) ( resid 12 and name HA ) 3.400 1.600 0.00 
assign ( resid 13 and name HA ) ( resid 13 and name HB# ) 3.700 1.900 0.00 
assign ( resid 13 and name HA ) ( resid 13 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 13 and name HA ) ( resid 13 and name HD2# ) 5.300 3.500 0.00 
assign ( resid 13 and name HA ) ( resid 13 and name HG ) 4.300 2.500 0.00 
assign ( resid 13 and name HN ) ( resid 13 and name HA ) 3.400 1.600 0.00 
assign ( resid 13 and name HN ) ( resid 13 and name HB# ) 5.300 3.500 0.00 
assign ( resid 13 and name HN ) ( resid 13 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 13 and name HN ) ( resid 13 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 14 and name HN ) ( resid 14 and name HA ) 3.400 1.600 0.00 
assign ( resid 15 and name HA ) ( resid 15 and name HG# ) 5.300 3.500 0.00 
assign ( resid 15 and name HN ) ( resid 15 and name HA ) 3.400 1.600 0.00 
assign ( resid 15 and name HN ) ( resid 15 and name HG# ) 4.400 2.600 0.00 
assign ( resid 16 and name HA ) ( resid 16 and name HB# ) 3.700 1.900 0.00 
assign ( resid 16 and name HA ) ( resid 16 and name HD1# ) 3.700 1.900 0.00 
assign ( resid 16 and name HA ) ( resid 16 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 16 and name HA ) ( resid 16 and name HG ) 3.700 1.900 0.00 
assign ( resid 16 and name HN ) ( resid 16 and name HA ) 3.400 1.600 0.00 
assign ( resid 16 and name HN ) ( resid 16 and name HB# ) 4.400 2.600 0.00 
assign ( resid 16 and name HN ) ( resid 16 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 16 and name HN ) ( resid 16 and name HD2# ) 5.300 3.500 0.00 
assign ( resid 16 and name HN ) ( resid 16 and name HG ) 3.700 1.900 0.00 
assign ( resid 17 and name HA ) ( resid 17 and name HB# ) 4.400 2.600 0.00 
assign ( resid 17 and name HA ) ( resid 17 and name HG# ) 4.400 2.600 0.00 
assign ( resid 17 and name HN ) ( resid 17 and name HA ) 3.400 1.600 0.00 
assign ( resid 17 and name HN ) ( resid 17 and name HB# ) 4.400 2.600 0.00 
assign ( resid 17 and name HN ) ( resid 17 and name HG# ) 5.300 3.500 0.00 
assign ( resid 18 and name HA ) ( resid 18 and name HB# ) 3.700 1.900 0.00 
assign ( resid 18 and name HN ) ( resid 18 and name HA ) 3.400 1.600 0.00 
assign ( resid 18 and name HN ) ( resid 18 and name HB# ) 3.700 1.900 0.00 
assign ( resid 19 and name HN ) ( resid 19 and name HA ) 3.400 1.600 0.00 
assign ( resid 20 and name HN ) ( resid 20 and name HA ) 2.900 1.100 0.00 
assign ( resid 21 and name HN ) ( resid 21 and name HA ) 3.400 1.600 0.00 
assign ( resid 22 and name HA ) ( resid 22 and name HB# ) 3.700 1.900 0.00 
assign ( resid 23 and name HA ) ( resid 23 and name HB ) 2.700 0.900 0.00 
assign ( resid 23 and name HA ) ( resid 23 and name HG1# ) 5.300 3.500 0.00 
assign ( resid 23 and name HA ) ( resid 23 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 23 and name HN ) ( resid 23 and name HA ) 3.400 1.600 0.00 
assign ( resid 23 and name HN ) ( resid 23 and name HB ) 4.300 2.500 0.00 
assign ( resid 23 and name HN ) ( resid 23 and name HG1# ) 5.300 3.500 0.00 
assign ( resid 23 and name HN ) ( resid 23 and name HG2# ) 5.300 3.500 0.00 
assign ( resid 24 and name HA ) ( resid 24 and name HB# ) 4.400 2.600 0.00 
assign ( resid 24 and name HN ) ( resid 24 and name HA ) 3.400 1.600 0.00 
assign ( resid 24 and name HN ) ( resid 24 and name HB# ) 5.300 3.500 0.00 
assign ( resid 25 and name HA ) ( resid 25 and name HG# ) 5.300 3.500 0.00 
assign ( resid 25 and name HN ) ( resid 25 and name HA ) 3.400 1.600 0.00 
assign ( resid 25 and name HN ) ( resid 25 and name HG# ) 4.400 2.600 0.00 
assign ( resid 26 and name HN ) ( resid 26 and name HA ) 3.400 1.600 0.00 
assign ( resid 27 and name HA ) ( resid 27 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 27 and name HA ) ( resid 27 and name HD2# ) 5.300 3.500 0.00 
assign ( resid 27 and name HA ) ( resid 27 and name HG ) 4.300 2.500 0.00 
assign ( resid 27 and name HN ) ( resid 27 and name HA ) 3.400 1.600 0.00 
assign ( resid 27 and name HN ) ( resid 27 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 27 and name HN ) ( resid 27 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 27 and name HN ) ( resid 27 and name HG ) 5.000 3.200 0.00 
assign ( resid 28 and name HN ) ( resid 28 and name HA ) 5.000 3.200 0.00 
assign ( resid 29 and name HN ) ( resid 29 and name HA# ) 3.700 1.900 0.00 
assign ( resid 30 and name HN ) ( resid 30 and name HA ) 3.400 1.600 0.00 
assign ( resid 30 and name HN ) ( resid 30 and name HB# ) 3.700 1.900 0.00 
assign ( resid 31 and name HN ) ( resid 31 and name HA ) 3.400 1.600 0.00 
assign ( resid 32 and name HA ) ( resid 32 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 32 and name HA ) ( resid 32 and name HD2# ) 5.300 3.500 0.00 
assign ( resid 32 and name HA ) ( resid 32 and name HG ) 3.400 1.600 0.00 
assign ( resid 32 and name HN ) ( resid 32 and name HA ) 3.400 1.600 0.00 
assign ( resid 32 and name HN ) ( resid 32 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 32 and name HN ) ( resid 32 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 33 and name HA ) ( resid 33 and name HB ) 2.700 0.900 0.00 
assign ( resid 33 and name HN ) ( resid 33 and name HA ) 3.400 1.600 0.00 
assign ( resid 33 and name HN ) ( resid 33 and name HB ) 3.700 1.900 0.00 
assign ( resid 34 and name HA ) ( resid 34 and name HB# ) 3.700 1.900 0.00 
assign ( resid 34 and name HA ) ( resid 34 and name HG# ) 4.400 2.600 0.00 
assign ( resid 34 and name HN ) ( resid 34 and name HA ) 2.700 0.900 0.00 
assign ( resid 34 and name HN ) ( resid 34 and name HB# ) 4.400 2.600 0.00 
assign ( resid 34 and name HN ) ( resid 34 and name HG# ) 4.400 2.600 0.00 
assign ( resid 35 and name HA ) ( resid 35 and name HB# ) 3.700 1.900 0.00 
assign ( resid 35 and name HN ) ( resid 35 and name HA ) 3.400 1.600 0.00 
assign ( resid 35 and name HN ) ( resid 35 and name HB# ) 3.700 1.900 0.00 
assign ( resid 36 and name HA ) ( resid 36 and name HB# ) 3.700 1.900 0.00 
assign ( resid 36 and name HA ) ( resid 36 and name HD1# ) 5.300 3.500 0.00 
assign ( resid 36 and name HA ) ( resid 36 and name HD2# ) 5.300 3.500 0.00 
assign ( resid 36 and name HA ) ( resid 36 and name HG ) 2.700 0.900 0.00 
assign ( resid 36 and name HN ) ( resid 36 and name HA ) 2.900 1.100 0.00 
assign ( resid 36 and name HN ) ( resid 36 and name HB# ) 4.400 2.600 0.00 
assign ( resid 36 and name HN ) ( resid 36 and name HD1# ) 4.400 2.600 0.00 
assign ( resid 36 and name HN ) ( resid 36 and name HD2# ) 6.000 4.200 0.00 
assign ( resid 36 and name HN ) ( resid 36 and name HG ) 3.400 1.600 0.00 
assign ( resid 37 and name HA ) ( resid 37 and name HB# ) 3.700 1.900 0.00 
assign ( resid 37 and name HN ) ( resid 37 and name HA ) 3.400 1.600 0.00 
assign ( resid 37 and name HN ) ( resid 37 and name HB# ) 3.700 1.900 0.00 
assign ( resid 38 and name HA ) ( resid 38 and name HG ) 3.400 1.600 0.00 
assign ( resid 38 and name HN ) ( resid 38 and name HA ) 3.400 1.600 0.00 
assign ( resid 38 and name HN ) ( resid 38 and name HD1# ) 6.000 4.200 0.00 
assign ( resid 38 and name HN ) ( resid 38 and name HD2# ) 5.300 3.500 0.00 
assign ( resid 38 and name HN ) ( resid 38 and name HG ) 3.400 1.600 0.00 
assign ( resid 39 and name HA ) ( resid 39 and name HB ) 2.700 0.900 0.00 
assign ( resid 39 and name HN ) ( resid 39 and name HA ) 3.400 1.600 0.00 
assign ( resid 39 and name HN ) ( resid 39 and name HB ) 3.700 1.900 0.00 
assign ( resid 40 and name HN ) ( resid 40 and name HA ) 3.400 1.600 0.00 
assign ( resid 41 and name HN ) ( resid 41 and name HA# ) 3.700 1.900 0.00 
assign ( resid 42 and name HN ) ( resid 42 and name HA ) 3.400 1.600 0.00 
assign ( resid 42 and name HN ) ( resid 42 and name HG# ) 5.300 3.500 0.00 
assign ( resid 43 and name HA ) ( resid 43 and name HB# ) 3.700 1.900 0.00 
assign ( resid 43 and name HA ) ( resid 43 and name HD# ) 5.300 3.500 0.00 
assign ( resid 43 and name HA ) ( resid 43 and name HG# ) 3.700 1.900 0.00 
assign ( resid 43 and name HN ) ( resid 43 and name HA ) 3.400 1.600 0.00 
assign ( resid 43 and name HN ) ( resid 43 and name HB# ) 4.400 2.600 0.00 
assign ( resid 43 and name HN ) ( resid 43 and name HG# ) 5.300 3.500 0.00 
assign ( resid 44 and name HN ) ( resid 44 and name HA# ) 3.700 1.900 0.00 
assign ( resid 45 and name HA ) ( resid 45 and name HB# ) 3.700 1.900 0.00 
assign ( resid 45 and name HN ) ( resid 45 and name HA ) 3.400 1.600 0.00 
assign ( resid 45 and name HN ) ( resid 45 and name HB# ) 4.400 2.600 0.00 
assign ( resid 46 and name HN ) ( resid 46 and name HA ) 2.900 1.100 0.00 
assign ( resid 47 and name HN ) ( resid 47 and name HA ) 3.400 1.600 0.00 
assign ( resid 48 and name HA ) ( resid 48 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 48 and name HB ) ( resid 48 and name HG2# ) 3.700 1.900 0.00 
assign ( resid 48 and name HN ) ( resid 48 and name HA ) 3.400 1.600 0.00 
assign ( resid 48 and name HN ) ( resid 48 and name HB ) 4.300 2.500 0.00 
assign ( resid 48 and name HN ) ( resid 48 and name HG2# ) 5.300 3.500 0.00 
assign ( resid 49 and name HA ) ( resid 49 and name HB# ) 4.400 2.600 0.00 
assign ( resid 49 and name HA ) ( resid 49 and name HD# ) 5.300 3.500 0.00 
assign ( resid 49 and name HA ) ( resid 49 and name HG# ) 4.400 2.600 0.00 
assign ( resid 49 and name HN ) ( resid 49 and name HA ) 3.400 1.600 0.00 
assign ( resid 49 and name HN ) ( resid 49 and name HB# ) 4.400 2.600 0.00 
assign ( resid 49 and name HN ) ( resid 49 and name HD# ) 5.300 3.500 0.00 
assign ( resid 49 and name HN ) ( resid 49 and name HG# ) 6.000 4.200 0.00 
assign ( resid 50 and name HA ) ( resid 50 and name HB# ) 4.400 2.600 0.00 
assign ( resid 50 and name HA ) ( resid 50 and name HD# ) 5.300 3.500 0.00 
assign ( resid 50 and name HA ) ( resid 50 and name HG# ) 5.300 3.500 0.00 
assign ( resid 51 and name HA ) ( resid 51 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 51 and name HB ) ( resid 51 and name HG2# ) 6.000 4.200 0.00 
assign ( resid 51 and name HN ) ( resid 51 and name HA ) 5.000 3.200 0.00 
assign ( resid 51 and name HN ) ( resid 51 and name HB ) 5.000 3.200 0.00 
assign ( resid 51 and name HN ) ( resid 51 and name HG2# ) 4.400 2.600 0.00 
assign ( resid 15 and name HN ) ( resid 12 and name O ) 2.5 0.7 0.2
assign ( resid 15 and name N  ) ( resid 12 and name O ) 2.5 0.7 0.8
assign ( resid 16 and name HN ) ( resid 12 and name O ) 2.5 0.7 0.2
assign ( resid 16 and name N  ) ( resid 12 and name O ) 2.5 0.7 0.8
assign ( resid 17 and name HN ) ( resid 13 and name O ) 2.5 0.7 0.2
assign ( resid 17 and name N  ) ( resid 13 and name O ) 2.5 0.7 0.8
assign ( resid 17 and name HN ) ( resid 14 and name O ) 2.5 0.7 0.2
assign ( resid 17 and name N  ) ( resid 14 and name O ) 2.5 0.7 0.8
assign ( resid 18 and name HN ) ( resid 15 and name O ) 2.5 0.7 0.2
assign ( resid 18 and name N  ) ( resid 15 and name O ) 2.5 0.7 0.8
assign ( resid 19 and name HN ) ( resid 16 and name O ) 2.5 0.7 0.2
assign ( resid 19 and name N  ) ( resid 16 and name O ) 2.5 0.7 0.8
assign ( resid 31 and name HN ) ( resid 28 and name O ) 2.5 0.7 0.2
assign ( resid 31 and name N  ) ( resid 28 and name O ) 2.5 0.7 0.8
assign ( resid 32 and name HN ) ( resid 29 and name O ) 2.5 0.7 0.2
assign ( resid 32 and name N  ) ( resid 29 and name O ) 2.5 0.7 0.8
assign ( resid 33 and name HN ) ( resid 29 and name O ) 2.5 0.7 0.2
assign ( resid 33 and name N  ) ( resid 29 and name O ) 2.5 0.7 1.0
assign ( resid 33 and name HN ) ( resid 30 and name O ) 2.5 0.7 0.2
assign ( resid 33 and name N  ) ( resid 30 and name O ) 2.5 0.7 1.0
assign ( resid 34 and name HN ) ( resid 30 and name O ) 2.5 0.7 0.2
assign ( resid 34 and name N  ) ( resid 30 and name O ) 2.5 0.7 0.8
assign ( resid 35 and name HN ) ( resid 31 and name O ) 2.5 0.7 0.2
assign ( resid 35 and name N  ) ( resid 31 and name O ) 2.5 0.7 0.8
assign ( resid 36 and name HN ) ( resid 32 and name O ) 2.5 0.7 0.2
assign ( resid 36 and name N  ) ( resid 32 and name O ) 2.5 0.7 0.8
assign ( resid 37 and name HN ) ( resid 33 and name O ) 2.5 0.7 0.2
assign ( resid 37 and name N  ) ( resid 33 and name O ) 2.5 0.7 0.8
assign ( resid 38 and name HN ) ( resid 34 and name O ) 2.5 0.7 0.2
assign ( resid 38 and name N  ) ( resid 34 and name O ) 2.5 0.7 1.1
assign ( resid 39 and name HN ) ( resid 35 and name O ) 2.5 0.7 0.2
assign ( resid 39 and name N  ) ( resid 35 and name O ) 2.5 0.7 0.8
assign ( resid 40 and name HN ) ( resid 36 and name O ) 2.5 0.7 0.2
assign ( resid 40 and name N  ) ( resid 36 and name O ) 2.5 0.7 0.8
assign ( resid 1 and name C ) 
       ( resid 2 and name N ) 
       ( resid 2 and name CA )
       ( resid 2 and name C ) 1.0 -65 40.0 2
assign ( resid 2 and name C ) 
       ( resid 3 and name N ) 
       ( resid 3 and name CA )
       ( resid 3 and name C ) 1.0 -65 40.0 2
assign ( resid 3 and name C ) 
       ( resid 4 and name N ) 
       ( resid 4 and name CA )
       ( resid 4 and name C ) 1.0 -65 40.0 2
assign ( resid 4 and name C ) 
       ( resid 5 and name N ) 
       ( resid 5 and name CA )
       ( resid 5 and name C ) 1.0 -65 40.0 2
assign ( resid 5 and name C ) 
       ( resid 6 and name N ) 
       ( resid 6 and name CA )
       ( resid 6 and name C ) 1.0 -65 40.0 2
assign ( resid 12 and name C ) 
       ( resid 13 and name N ) 
       ( resid 13 and name CA )
       ( resid 13 and name C ) 1.0 -65 40.0 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 40.0 2
assign ( resid 14 and name C ) 
       ( resid 15 and name N ) 
       ( resid 15 and name CA )
       ( resid 15 and name C ) 1.0 -65 40.0 2
assign ( resid 15 and name C ) 
       ( resid 16 and name N ) 
       ( resid 16 and name CA )
       ( resid 16 and name C ) 1.0 -65 40.0 2
assign ( resid 16 and name C ) 
       ( resid 17 and name N ) 
       ( resid 17 and name CA )
       ( resid 17 and name C ) 1.0 -65 40.0 2
assign ( resid 17 and name C ) 
       ( resid 18 and name N ) 
       ( resid 18 and name CA )
       ( resid 18 and name C ) 1.0 -65 40.0 2
assign ( resid 18 and name C ) 
       ( resid 19 and name N ) 
       ( resid 19 and name CA )
       ( resid 19 and name C ) 1.0 -65 40.0 2
assign ( resid 30 and name C ) 
       ( resid 31 and name N ) 
       ( resid 31 and name CA )
       ( resid 31 and name C ) 1.0 -65 40.0 2
assign ( resid 31 and name C ) 
       ( resid 32 and name N ) 
       ( resid 32 and name CA )
       ( resid 32 and name C ) 1.0 -65 40.0 2
assign ( resid 32 and name C ) 
       ( resid 33 and name N ) 
       ( resid 33 and name CA )
       ( resid 33 and name C ) 1.0 -65 40.0 2
assign ( resid 33 and name C ) 
       ( resid 34 and name N ) 
       ( resid 34 and name CA )
       ( resid 34 and name C ) 1.0 -65 40.0 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 40.0 2
assign ( resid 35 and name C ) 
       ( resid 36 and name N ) 
       ( resid 36 and name CA )
       ( resid 36 and name C ) 1.0 -65 40.0 2
assign ( resid 36 and name C ) 
       ( resid 37 and name N ) 
       ( resid 37 and name CA )
       ( resid 37 and name C ) 1.0 -65 40.0 2
assign ( resid 37 and name C ) 
       ( resid 38 and name N ) 
       ( resid 38 and name CA )
       ( resid 38 and name C ) 1.0 -65 40.0 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 40.0 2
assign ( resid 39 and name C ) 
       ( resid 40 and name N ) 
       ( resid 40 and name CA )
       ( resid 40 and name C ) 1.0 -65 40.0 2
assign ( resid 9 and name C ) 
       ( resid 10 and name N ) 
       ( resid 10 and name CA )
       ( resid 10 and name C ) 1.0 -120 40.0 2
assign ( resid 11 and name C ) 
       ( resid 12 and name N ) 
       ( resid 12 and name CA )
       ( resid 12 and name C ) 1.0 -120 40.0 2
assign ( resid 22 and name C ) 
       ( resid 23 and name N ) 
       ( resid 23 and name CA )
       ( resid 23 and name C ) 1.0 -120 40.0 2
assign ( resid 24 and name C ) 
       ( resid 25 and name N ) 
       ( resid 25 and name CA )
       ( resid 25 and name C ) 1.0 -120 40.0 2
assign ( resid 26 and name C ) 
       ( resid 27 and name N ) 
       ( resid 27 and name CA )
       ( resid 27 and name C ) 1.0 -120 40.0 2
assign ( resid 47 and name C ) 
       ( resid 48 and name N ) 
       ( resid 48 and name CA )
       ( resid 48 and name C ) 1.0 -120 40.0 2
assign ( resid 3 and name N ) 
       ( resid 3 and name CA ) 
       ( resid 3 and name CB )
       ( resid 3 and name CG1 ) 1.0 -60 40.0 2
assign ( resid 6 and name N ) 
       ( resid 6 and name CA ) 
       ( resid 6 and name CB )
       ( resid 6 and name SG ) 1.0 -60 40.0 2
assign ( resid 7 and name N ) 
       ( resid 7 and name CA ) 
       ( resid 7 and name CB )
       ( resid 7 and name SG ) 1.0 -60 40.0 2
assign ( resid 19 and name N ) 
       ( resid 19 and name CA ) 
       ( resid 19 and name CB )
       ( resid 19 and name CG ) 1.0 -60 40.0 2
assign ( resid 20 and name N ) 
       ( resid 20 and name CA ) 
       ( resid 20 and name CB )
       ( resid 20 and name SG ) 1.0 -60 40.0 2
assign ( resid 21 and name N ) 
       ( resid 21 and name CA ) 
       ( resid 21 and name CB )
       ( resid 21 and name CG ) 1.0 -60 40.0 2
assign ( resid 26 and name N ) 
       ( resid 26 and name CA ) 
       ( resid 26 and name CB )
       ( resid 26 and name CG ) 1.0 -60 40.0 2
assign ( resid 28 and name N ) 
       ( resid 28 and name CA ) 
       ( resid 28 and name CB )
       ( resid 28 and name SG ) 1.0 -60 40.0 2
assign ( resid 31 and name N ) 
       ( resid 31 and name CA ) 
       ( resid 31 and name CB )
       ( resid 31 and name CG ) 1.0 -60 40.0 2
assign ( resid 32 and name N ) 
       ( resid 32 and name CA ) 
       ( resid 32 and name CB )
       ( resid 32 and name CG ) 1.0 -60 40.0 2
assign ( resid 33 and name N ) 
       ( resid 33 and name CA ) 
       ( resid 33 and name CB )
       ( resid 33 and name CG1 ) 1.0 -60 40.0 2
assign ( resid 39 and name N ) 
       ( resid 39 and name CA ) 
       ( resid 39 and name CB )
       ( resid 39 and name CG1 ) 1.0 -60 40.0 2
assign ( resid 40 and name N ) 
       ( resid 40 and name CA ) 
       ( resid 40 and name CB )
       ( resid 40 and name SG ) 1.0 -60 40.0 2
assign ( resid 42 and name N ) 
       ( resid 42 and name CA ) 
       ( resid 42 and name CB )
       ( resid 42 and name CG ) 1.0 180 40.0 2
assign ( resid 4 and name N ) 
       ( resid 4 and name CA ) 
       ( resid 4 and name CB )
       ( resid 4 and name CG ) 1.0 60 40.0 2
assign ( resid 9 and name N ) 
       ( resid 9 and name CA ) 
       ( resid 9 and name CB )
       ( resid 9 and name OG ) 1.0 60 40.0 2
assign ( resid 12 and name N ) 
       ( resid 12 and name CA ) 
       ( resid 12 and name CB )
       ( resid 12 and name OG ) 1.0 60 40.0 2
assign ( resid 14 and name N ) 
       ( resid 14 and name CA ) 
       ( resid 14 and name CB )
       ( resid 14 and name CG ) 1.0 60 40.0 2
assign ( resid 15 and name N ) 
       ( resid 15 and name CA ) 
       ( resid 15 and name CB )
       ( resid 15 and name CG ) 1.0 60 40.0 2
assign ( resid 25 and name N ) 
       ( resid 25 and name CA ) 
       ( resid 25 and name CB )
       ( resid 25 and name CG ) 1.0 60 40.0 2
assign ( resid 27 and name N ) 
       ( resid 27 and name CA ) 
       ( resid 27 and name CB )
       ( resid 27 and name CG ) 1.0 60 40.0 2
assign ( resid 38 and name N ) 
       ( resid 38 and name CA ) 
       ( resid 38 and name CB )
       ( resid 38 and name CG ) 1.0 60 40.0 2
assign ( resid 46 and name N ) 
       ( resid 46 and name CA ) 
       ( resid 46 and name CB )
       ( resid 46 and name CG ) 1.0 60 40.0 2
assign ( resid 47 and name N ) 
       ( resid 47 and name CA ) 
       ( resid 47 and name CB )
       ( resid 47 and name CG ) 1.0 60 40.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1 -11.101   3.737   5.290
    2    H2   GLY   1           HT2      GLY   1  -9.942   2.680   4.639
    3    H3   GLY   1           HT3      GLY   1 -10.478   4.015   3.736
    4    HA2  GLY   1           HA1      GLY   1  -8.778   5.152   4.635
    5    HA3  GLY   1           HA2      GLY   1  -9.583   5.055   6.232
    6    H    ILE   2           H        ILE   2  -7.946   3.184   3.513
    7    HA   ILE   2           HA       ILE   2  -5.558   2.726   5.231
    8    HB   ILE   2           HB       ILE   2  -6.543   0.711   4.299
    9   HG12  ILE   2          HG12      ILE   2  -3.978   1.102   4.325
   10   HG13  ILE   2          HG11      ILE   2  -4.595  -0.251   3.381
   11   HG21  ILE   2          HG21      ILE   2  -6.661   2.393   1.869
   12   HG22  ILE   2          HG22      ILE   2  -7.741   1.104   2.404
   13   HG23  ILE   2          HG23      ILE   2  -6.224   0.706   1.598
   14   HD11  ILE   2          HD11      ILE   2  -2.999   1.916   2.470
   15   HD12  ILE   2          HD12      ILE   2  -4.587   2.109   1.730
   16   HD13  ILE   2          HD13      ILE   2  -3.689   0.608   1.511
   17    H    VAL   3           H        VAL   3  -6.634   4.348   2.341
   18    HA   VAL   3           HA       VAL   3  -3.813   5.039   1.655
   19    HB   VAL   3           HB       VAL   3  -4.730   5.793  -0.499
   20   HG11  VAL   3          HG11      VAL   3  -5.911   3.092   0.176
   21   HG12  VAL   3          HG12      VAL   3  -4.178   3.350  -0.033
   22   HG13  VAL   3          HG13      VAL   3  -5.280   3.639  -1.377
   23   HG21  VAL   3          HG21      VAL   3  -7.193   5.712   1.030
   24   HG22  VAL   3          HG22      VAL   3  -7.351   4.770  -0.452
   25   HG23  VAL   3          HG23      VAL   3  -6.882   6.468  -0.533
   26    H    GLU   4           H        GLU   4  -6.571   6.263   3.206
   27    HA   GLU   4           HA       GLU   4  -6.903   8.898   2.622
   28    HB2  GLU   4           HB2      GLU   4  -6.927   9.321   5.165
   29    HB3  GLU   4           HB1      GLU   4  -8.029   8.091   4.544
   30    HG2  GLU   4           HG2      GLU   4  -6.756   6.331   5.383
   31    HG3  GLU   4           HG1      GLU   4  -5.268   7.278   5.394
   32    H    GLN   5           H        GLN   5  -3.956   7.501   3.941
   33    HA   GLN   5           HA       GLN   5  -2.757  10.227   3.999
   34    HB2  GLN   5           HB2      GLN   5  -0.833   8.667   5.104
   35    HB3  GLN   5           HB1      GLN   5  -2.117   9.423   6.043
   36    HG2  GLN   5           HG2      GLN   5  -3.390   7.430   6.128
   37    HG3  GLN   5           HG1      GLN   5  -2.491   6.697   4.800
   38   HE21  GLN   5          HE21      GLN   5  -2.497   5.023   6.851
   39   HE22  GLN   5          HE22      GLN   5  -1.081   5.093   7.783
   40    H    CYS   6           H        CYS   6  -1.739   6.898   3.113
   41    HA   CYS   6           HA       CYS   6   0.510   7.608   1.596
   42    HB2  CYS   6           HB2      CYS   6  -1.399   5.385   0.850
   43    HB3  CYS   6           HB1      CYS   6   0.340   5.450   0.563
   44    H    CYS   7           H        CYS   7  -2.867   7.971   0.809
   45    HA   CYS   7           HA       CYS   7  -2.282   8.442  -2.039
   46    HB2  CYS   7           HB2      CYS   7  -4.673   7.961  -0.428
   47    HB3  CYS   7           HB1      CYS   7  -4.888   9.221  -1.636
   48    H    THR   8           H        THR   8  -2.165  10.290   0.787
   49    HA   THR   8           HA       THR   8  -2.631  12.784  -0.803
   50    HB   THR   8           HB       THR   8  -4.265  12.693   0.958
   51    HG1  THR   8           HG1      THR   8  -3.819  14.612   1.748
   52   HG21  THR   8          HG21      THR   8  -3.039  10.958   2.296
   53   HG22  THR   8          HG22      THR   8  -3.700  12.269   3.274
   54   HG23  THR   8          HG23      THR   8  -1.978  12.235   2.890
   55    H    SER   9           H        SER   9  -0.670  11.391   1.845
   56    HA   SER   9           HA       SER   9   1.416  13.426   1.186
   57    HB2  SER   9           HB2      SER   9   2.334  12.613   3.490
   58    HB3  SER   9           HB1      SER   9   0.936  13.684   3.467
   59    HG   SER   9           HG       SER   9  -0.161  12.142   4.358
   60    H    ILE  10           H        ILE  10   2.497  10.769   3.067
   61    HA   ILE  10           HA       ILE  10   3.374   9.239   0.689
   62    HB   ILE  10           HB       ILE  10   5.408  10.077   2.755
   63   HG12  ILE  10          HG12      ILE  10   4.324  12.088   1.625
   64   HG13  ILE  10          HG11      ILE  10   6.063  11.935   1.377
   65   HG21  ILE  10          HG21      ILE  10   5.362   8.694   0.116
   66   HG22  ILE  10          HG22      ILE  10   6.386   8.400   1.521
   67   HG23  ILE  10          HG23      ILE  10   6.737   9.749   0.440
   68   HD11  ILE  10          HD11      ILE  10   5.812  11.670  -0.852
   69   HD12  ILE  10          HD12      ILE  10   4.137  12.176  -0.626
   70   HD13  ILE  10          HD13      ILE  10   4.547  10.461  -0.632
   71    H    CYS  11           H        CYS  11   4.770   7.270   1.607
   72    HA   CYS  11           HA       CYS  11   3.990   6.435   4.309
   73    HB2  CYS  11           HB2      CYS  11   2.741   5.268   1.829
   74    HB3  CYS  11           HB1      CYS  11   2.957   4.277   3.271
   75    H    SER  12           H        SER  12   5.264   4.689   5.038
   76    HA   SER  12           HA       SER  12   7.697   4.196   3.491
   77    HB2  SER  12           HB2      SER  12   7.808   2.467   5.604
   78    HB3  SER  12           HB1      SER  12   8.364   4.136   5.662
   79    HG   SER  12           HG       SER  12   6.656   4.664   6.806
   80    H    LEU  13           H        LEU  13   8.213   2.290   2.416
   81    HA   LEU  13           HA       LEU  13   6.161   0.654   1.380
   82    HB2  LEU  13           HB2      LEU  13   8.379   0.817   0.343
   83    HB3  LEU  13           HB1      LEU  13   9.107   0.034   1.745
   84    HG   LEU  13           HG       LEU  13   6.904  -1.319   0.203
   85   HD11  LEU  13          HD11      LEU  13   8.330  -1.173  -1.592
   86   HD12  LEU  13          HD12      LEU  13   9.121  -2.517  -0.769
   87   HD13  LEU  13          HD13      LEU  13   9.742  -0.878  -0.576
   88   HD21  LEU  13          HD21      LEU  13   7.279  -2.703   1.975
   89   HD22  LEU  13          HD22      LEU  13   8.844  -1.972   2.332
   90   HD23  LEU  13          HD23      LEU  13   8.711  -3.197   1.070
   91    H    TYR  14           H        TYR  14   8.396   0.020   4.040
   92    HA   TYR  14           HA       TYR  14   7.390  -2.567   4.676
   93    HB2  TYR  14           HB2      TYR  14   8.132  -1.672   7.146
   94    HB3  TYR  14           HB1      TYR  14   9.242  -2.358   5.968
   95    HD1  TYR  14           HD2      TYR  14  10.661  -0.895   4.566
   96    HD2  TYR  14           HD1      TYR  14   8.119   0.698   7.644
   97    HE1  TYR  14           HE2      TYR  14  11.914   1.244   4.492
   98    HE2  TYR  14           HE1      TYR  14   9.377   2.835   7.574
   99    HH   TYR  14           HH       TYR  14  12.305   3.185   5.654
  100    H    GLN  15           H        GLN  15   6.132   0.595   5.313
  101    HA   GLN  15           HA       GLN  15   4.250  -0.271   7.341
  102    HB2  GLN  15           HB2      GLN  15   3.667   1.945   7.459
  103    HB3  GLN  15           HB1      GLN  15   5.213   2.139   6.651
  104    HG2  GLN  15           HG2      GLN  15   3.993   3.333   5.141
  105    HG3  GLN  15           HG1      GLN  15   3.573   1.746   4.507
  106   HE21  GLN  15          HE21      GLN  15   2.433   3.349   7.522
  107   HE22  GLN  15          HE22      GLN  15   0.789   3.299   7.100
  108    H    LEU  16           H        LEU  16   4.373  -0.168   3.879
  109    HA   LEU  16           HA       LEU  16   1.559  -0.389   3.351
  110    HB2  LEU  16           HB2      LEU  16   4.088  -0.927   1.840
  111    HB3  LEU  16           HB1      LEU  16   2.586  -1.602   1.213
  112    HG   LEU  16           HG       LEU  16   3.273   0.745   0.393
  113   HD11  LEU  16          HD11      LEU  16   0.690   1.418   1.136
  114   HD12  LEU  16          HD12      LEU  16   0.691  -0.342   1.222
  115   HD13  LEU  16          HD13      LEU  16   1.136   0.467  -0.280
  116   HD21  LEU  16          HD21      LEU  16   2.444   2.573   1.909
  117   HD22  LEU  16          HD22      LEU  16   3.879   1.747   2.513
  118   HD23  LEU  16          HD23      LEU  16   2.297   1.373   3.193
  119    H    GLU  17           H        GLU  17   4.047  -2.665   4.281
  120    HA   GLU  17           HA       GLU  17   2.839  -5.105   3.543
  121    HB2  GLU  17           HB2      GLU  17   4.937  -5.443   4.466
  122    HB3  GLU  17           HB1      GLU  17   4.699  -4.223   5.713
  123    HG2  GLU  17           HG2      GLU  17   3.651  -5.692   7.146
  124    HG3  GLU  17           HG1      GLU  17   2.981  -6.661   5.834
  125    H    ASN  18           H        ASN  18   1.865  -2.749   5.873
  126    HA   ASN  18           HA       ASN  18   0.326  -4.381   7.638
  127    HB2  ASN  18           HB2      ASN  18   0.614  -1.537   7.052
  128    HB3  ASN  18           HB1      ASN  18  -1.047  -1.964   7.463
  129   HD21  ASN  18          HD21      ASN  18   0.325  -0.394   9.305
  130   HD22  ASN  18          HD22      ASN  18   0.735  -1.315  10.671
  131    H    TYR  19           H        TYR  19  -0.206  -3.484   4.365
  132    HA   TYR  19           HA       TYR  19  -3.090  -4.203   4.578
  133    HB2  TYR  19           HB2      TYR  19  -1.800  -3.155   2.074
  134    HB3  TYR  19           HB1      TYR  19  -3.462  -2.967   2.632
  135    HD1  TYR  19           HD2      TYR  19  -3.062  -2.125   5.436
  136    HD2  TYR  19           HD1      TYR  19  -0.990  -0.940   1.863
  137    HE1  TYR  19           HE2      TYR  19  -2.468   0.035   6.499
  138    HE2  TYR  19           HE1      TYR  19  -0.394   1.223   2.926
  139    HH   TYR  19           HH       TYR  19  -0.545   1.786   6.157
  140    H    CYS  20           H        CYS  20  -1.457  -6.376   4.864
  141    HA   CYS  20           HA       CYS  20  -1.732  -7.729   2.228
  142    HB2  CYS  20           HB2      CYS  20   0.420  -8.383   4.241
  143    HB3  CYS  20           HB1      CYS  20   0.304  -8.931   2.569
  144    H    ASN  21           H        ASN  21  -1.936  -7.937   5.712
  145    HA   ASN  21           HA       ASN  21  -3.373 -10.542   5.394
  146    HB2  ASN  21           HB2      ASN  21  -1.342  -9.624   7.369
  147    HB3  ASN  21           HB1      ASN  21  -2.673 -10.597   7.997
  148   HD21  ASN  21          HD21      ASN  21   0.151 -11.462   7.744
  149   HD22  ASN  21          HD22      ASN  21   0.148 -12.798   6.697
  150    H1   PHE   1           HT1      PHE   1  11.478   1.767  -3.694
  151    H2   PHE   1           HT2      PHE   1  10.410   1.470  -4.982
  152    H3   PHE   1           HT3      PHE   1  10.372   0.485  -3.598
  153    HA   PHE   1           HA       PHE   1   8.762   2.617  -4.055
  154    HB2  PHE   1           HB2      PHE   1   8.879   0.596  -2.291
  155    HB3  PHE   1           HB1      PHE   1   9.406   1.905  -1.233
  156    HD1  PHE   1           HD1      PHE   1   6.953   1.789  -4.071
  157    HD2  PHE   1           HD2      PHE   1   7.609   2.574   0.104
  158    HE1  PHE   1           HE1      PHE   1   4.604   2.557  -3.845
  159    HE2  PHE   1           HE2      PHE   1   5.259   3.342   0.329
  160    HZ   PHE   1           HZ       PHE   1   3.757   3.334  -1.646
  161    H    VAL   2           H        VAL   2   8.736   4.786  -3.512
  162    HA   VAL   2           HA       VAL   2  11.080   5.833  -1.984
  163    HB   VAL   2           HB       VAL   2  10.714   7.899  -3.600
  164   HG11  VAL   2          HG11      VAL   2  12.795   7.223  -4.121
  165   HG12  VAL   2          HG12      VAL   2  12.107   6.064  -5.259
  166   HG13  VAL   2          HG13      VAL   2  12.420   5.584  -3.591
  167   HG21  VAL   2          HG21      VAL   2   9.840   5.572  -5.338
  168   HG22  VAL   2          HG22      VAL   2   9.987   7.262  -5.819
  169   HG23  VAL   2          HG23      VAL   2   8.729   6.775  -4.683
  170    H    ASN   3           H        ASN   3  10.457   8.412  -1.678
  171    HA   ASN   3           HA       ASN   3   7.925   8.296  -0.146
  172    HB2  ASN   3           HB2      ASN   3  10.276  10.187  -0.196
  173    HB3  ASN   3           HB1      ASN   3   8.769  10.627   0.607
  174   HD21  ASN   3          HD21      ASN   3  11.342   8.127   0.598
  175   HD22  ASN   3          HD22      ASN   3  11.097   7.648   2.209
  176    H    GLN   4           H        GLN   4   6.352   8.494  -1.806
  177    HA   GLN   4           HA       GLN   4   6.021  11.230  -2.828
  178    HB2  GLN   4           HB2      GLN   4   5.663  10.395  -5.165
  179    HB3  GLN   4           HB1      GLN   4   7.331  10.229  -4.619
  180    HG2  GLN   4           HG2      GLN   4   7.232   7.946  -4.578
  181    HG3  GLN   4           HG1      GLN   4   5.551   7.927  -4.045
  182   HE21  GLN   4          HE21      GLN   4   7.646   7.940  -6.871
  183   HE22  GLN   4          HE22      GLN   4   6.409   7.756  -8.019
  184    H    HIS   5           H        HIS   5   3.867  11.127  -4.268
  185    HA   HIS   5           HA       HIS   5   1.859   9.841  -2.525
  186    HB2  HIS   5           HB2      HIS   5   1.373  11.627  -4.917
  187    HB3  HIS   5           HB1      HIS   5   0.252  11.263  -3.607
  188    HD2  HIS   5           HD2      HIS   5   3.678  13.221  -4.044
  189    HE1  HIS   5           HE1      HIS   5   1.663  14.654  -0.614
  190    HE2  HIS   5           HE2      HIS   5   3.699  14.972  -2.119
  191    H    LEU   6           H        LEU   6   0.462   8.213  -3.232
  192    HA   LEU   6           HA       LEU   6   0.525   7.400  -6.055
  193    HB2  LEU   6           HB2      LEU   6   1.112   5.055  -5.513
  194    HB3  LEU   6           HB1      LEU   6   2.423   6.166  -5.156
  195    HG   LEU   6           HG       LEU   6   2.223   4.549  -3.352
  196   HD11  LEU   6          HD11      LEU   6   2.435   7.196  -2.957
  197   HD12  LEU   6          HD12      LEU   6   2.450   6.033  -1.634
  198   HD13  LEU   6          HD13      LEU   6   0.963   6.892  -2.032
  199   HD21  LEU   6          HD21      LEU   6  -0.463   4.539  -3.891
  200   HD22  LEU   6          HD22      LEU   6  -0.404   5.456  -2.385
  201   HD23  LEU   6          HD23      LEU   6   0.274   3.833  -2.455
  202    H    CYS   7           H        CYS   7  -1.259   6.055  -6.630
  203    HA   CYS   7           HA       CYS   7  -3.175   5.254  -4.547
  204    HB2  CYS   7           HB2      CYS   7  -3.845   7.389  -6.594
  205    HB3  CYS   7           HB1      CYS   7  -5.044   6.547  -5.614
  206    H    GLY   8           H        GLY   8  -5.199   4.307  -5.718
  207    HA2  GLY   8           HA2      GLY   8  -6.011   2.642  -7.146
  208    HA3  GLY   8           HA1      GLY   8  -5.217   3.556  -8.424
  209    H    SER   9           H        SER   9  -4.207   2.022  -9.612
  210    HA   SER   9           HA       SER   9  -3.166  -0.438  -8.706
  211    HB2  SER   9           HB2      SER   9  -1.926   1.064 -11.001
  212    HB3  SER   9           HB1      SER   9  -2.202  -0.667 -10.838
  213    HG   SER   9           HG       SER   9  -4.526   0.018 -10.749
  214    H    ASP  10           H        ASP  10  -1.930   2.721  -8.239
  215    HA   ASP  10           HA       ASP  10   0.855   1.892  -8.003
  216    HB2  ASP  10           HB2      ASP  10  -0.435   4.393  -6.885
  217    HB3  ASP  10           HB1      ASP  10   1.279   4.140  -7.209
  218    H    LEU  11           H        LEU  11  -1.889   2.244  -5.858
  219    HA   LEU  11           HA       LEU  11  -0.423   1.987  -3.398
  220    HB2  LEU  11           HB2      LEU  11  -3.249   1.043  -3.962
  221    HB3  LEU  11           HB1      LEU  11  -2.560   1.415  -2.382
  222    HG   LEU  11           HG       LEU  11  -2.490   3.531  -4.491
  223   HD11  LEU  11          HD11      LEU  11  -4.783   2.829  -4.668
  224   HD12  LEU  11          HD12      LEU  11  -4.768   4.271  -3.654
  225   HD13  LEU  11          HD13      LEU  11  -4.932   2.677  -2.919
  226   HD21  LEU  11          HD21      LEU  11  -3.250   3.919  -1.624
  227   HD22  LEU  11          HD22      LEU  11  -2.282   4.952  -2.672
  228   HD23  LEU  11          HD23      LEU  11  -1.580   3.489  -1.983
  229    H    VAL  12           H        VAL  12  -1.564  -0.257  -5.809
  230    HA   VAL  12           HA       VAL  12  -0.842  -2.561  -4.114
  231    HB   VAL  12           HB       VAL  12  -1.338  -3.870  -6.260
  232   HG11  VAL  12          HG11      VAL  12  -3.040  -4.098  -4.745
  233   HG12  VAL  12          HG12      VAL  12  -3.907  -3.147  -5.950
  234   HG13  VAL  12          HG13      VAL  12  -3.223  -2.358  -4.529
  235   HG21  VAL  12          HG21      VAL  12  -2.505  -1.188  -7.057
  236   HG22  VAL  12          HG22      VAL  12  -2.710  -2.706  -7.928
  237   HG23  VAL  12          HG23      VAL  12  -1.116  -1.967  -7.813
  238    H    GLU  13           H        GLU  13   0.327  -0.962  -7.108
  239    HA   GLU  13           HA       GLU  13   2.449  -2.631  -7.757
  240    HB2  GLU  13           HB2      GLU  13   2.163  -0.673  -9.096
  241    HB3  GLU  13           HB1      GLU  13   2.292   0.390  -7.695
  242    HG2  GLU  13           HG2      GLU  13   4.523   0.515  -7.948
  243    HG3  GLU  13           HG1      GLU  13   4.657  -1.242  -7.866
  244    H    ALA  14           H        ALA  14   2.104  -0.380  -5.141
  245    HA   ALA  14           HA       ALA  14   4.759  -0.650  -4.040
  246    HB1  ALA  14           HB1      ALA  14   3.840   0.542  -2.137
  247    HB2  ALA  14           HB2      ALA  14   2.196   0.152  -2.642
  248    HB3  ALA  14           HB3      ALA  14   3.175   1.259  -3.604
  249    H    LEU  15           H        LEU  15   1.605  -2.038  -3.219
  250    HA   LEU  15           HA       LEU  15   2.725  -3.799  -1.190
  251    HB2  LEU  15           HB2      LEU  15   0.047  -3.302  -2.395
  252    HB3  LEU  15           HB1      LEU  15   0.312  -4.887  -1.670
  253    HG   LEU  15           HG       LEU  15   1.342  -2.719  -0.003
  254   HD11  LEU  15          HD11      LEU  15  -1.548  -2.702   0.280
  255   HD12  LEU  15          HD12      LEU  15  -1.068  -2.143  -1.322
  256   HD13  LEU  15          HD13      LEU  15  -0.438  -1.341   0.117
  257   HD21  LEU  15          HD21      LEU  15   1.078  -4.955   0.861
  258   HD22  LEU  15          HD22      LEU  15  -0.609  -5.012   0.349
  259   HD23  LEU  15          HD23      LEU  15  -0.122  -3.945   1.666
  260    H    TYR  16           H        TYR  16   1.039  -4.452  -4.203
  261    HA   TYR  16           HA       TYR  16   1.266  -7.016  -4.795
  262    HB2  TYR  16           HB2      TYR  16   0.598  -5.858  -6.656
  263    HB3  TYR  16           HB1      TYR  16   1.805  -4.599  -6.436
  264    HD1  TYR  16           HD1      TYR  16   1.670  -8.275  -7.177
  265    HD2  TYR  16           HD2      TYR  16   3.525  -4.486  -7.988
  266    HE1  TYR  16           HE1      TYR  16   3.101  -9.348  -8.900
  267    HE2  TYR  16           HE2      TYR  16   4.958  -5.557  -9.712
  268    HH   TYR  16           HH       TYR  16   5.183  -7.441 -11.003
  269    H    LEU  17           H        LEU  17   4.214  -4.935  -4.821
  270    HA   LEU  17           HA       LEU  17   5.761  -7.434  -5.287
  271    HB2  LEU  17           HB2      LEU  17   7.673  -5.488  -5.175
  272    HB3  LEU  17           HB1      LEU  17   6.877  -6.033  -6.646
  273    HG   LEU  17           HG       LEU  17   5.121  -4.267  -6.243
  274   HD11  LEU  17          HD11      LEU  17   5.896  -2.408  -4.699
  275   HD12  LEU  17          HD12      LEU  17   7.130  -3.518  -4.108
  276   HD13  LEU  17          HD13      LEU  17   5.427  -3.900  -3.888
  277   HD21  LEU  17          HD21      LEU  17   7.332  -4.085  -7.661
  278   HD22  LEU  17          HD22      LEU  17   7.819  -2.953  -6.399
  279   HD23  LEU  17          HD23      LEU  17   6.371  -2.637  -7.356
  280    H    VAL  18           H        VAL  18   5.041  -5.236  -2.665
  281    HA   VAL  18           HA       VAL  18   7.375  -6.088  -1.118
  282    HB   VAL  18           HB       VAL  18   6.487  -4.819   0.703
  283   HG11  VAL  18          HG11      VAL  18   6.288  -3.687  -2.032
  284   HG12  VAL  18          HG12      VAL  18   7.296  -3.189  -0.676
  285   HG13  VAL  18          HG13      VAL  18   5.597  -2.723  -0.726
  286   HG21  VAL  18          HG21      VAL  18   4.130  -3.776   0.347
  287   HG22  VAL  18          HG22      VAL  18   4.238  -5.447   0.898
  288   HG23  VAL  18          HG23      VAL  18   3.901  -5.097  -0.793
  289    H    CYS  19           H        CYS  19   3.937  -6.860  -1.161
  290    HA   CYS  19           HA       CYS  19   4.481  -9.132   0.691
  291    HB2  CYS  19           HB2      CYS  19   1.935  -7.674  -0.052
  292    HB3  CYS  19           HB1      CYS  19   1.932  -9.195   0.841
  293    H    GLY  20           H        GLY  20   5.076  -9.033  -2.242
  294    HA2  GLY  20           HA2      GLY  20   3.246 -10.394  -3.853
  295    HA3  GLY  20           HA1      GLY  20   4.992 -10.613  -3.983
  296    H    GLU  21           H        GLU  21   2.655 -12.561  -4.114
  297    HA   GLU  21           HA       GLU  21   2.188 -14.743  -3.388
  298    HB2  GLU  21           HB2      GLU  21   4.708 -14.778  -4.038
  299    HB3  GLU  21           HB1      GLU  21   4.993 -14.821  -2.299
  300    HG2  GLU  21           HG2      GLU  21   4.317 -16.975  -2.128
  301    HG3  GLU  21           HG1      GLU  21   2.926 -16.709  -3.180
  302    H    ARG  22           H        ARG  22   2.108 -12.349  -1.428
  303    HA   ARG  22           HA       ARG  22   2.152 -13.982   1.078
  304    HB2  ARG  22           HB2      ARG  22   3.438 -11.567   0.560
  305    HB3  ARG  22           HB1      ARG  22   1.993 -11.087   1.452
  306    HG2  ARG  22           HG2      ARG  22   3.285 -11.589   3.270
  307    HG3  ARG  22           HG1      ARG  22   2.758 -13.236   2.919
  308    HD2  ARG  22           HD2      ARG  22   4.782 -13.816   1.919
  309    HD3  ARG  22           HD1      ARG  22   5.183 -12.144   1.526
  310    HE   ARG  22           HE       ARG  22   5.474 -11.883   4.088
  311   HH11  ARG  22          HH21      ARG  22   7.224 -13.818   2.117
  312   HH12  ARG  22          HH22      ARG  22   7.772 -14.927   3.331
  313   HH21  ARG  22          HH11      ARG  22   5.608 -13.744   5.768
  314   HH22  ARG  22          HH12      ARG  22   6.858 -14.885   5.397
  315    H    GLY  23           H        GLY  23   0.013 -13.476  -1.079
  316    HA2  GLY  23           HA2      GLY  23  -2.313 -13.169  -1.107
  317    HA3  GLY  23           HA1      GLY  23  -2.257 -13.500   0.624
  318    H    ALA  24           H        ALA  24  -2.688 -11.070  -1.750
  319    HA   ALA  24           HA       ALA  24  -2.629  -8.979   0.389
  320    HB1  ALA  24           HB1      ALA  24  -2.347  -7.359  -1.542
  321    HB2  ALA  24           HB2      ALA  24  -2.100  -8.759  -2.585
  322    HB3  ALA  24           HB3      ALA  24  -0.973  -8.431  -1.268
  323    H    PHE  25           H        PHE  25  -3.993  -8.432  -2.782
  324    HA   PHE  25           HA       PHE  25  -6.155  -7.615  -3.280
  325    HB2  PHE  25           HB2      PHE  25  -7.865  -9.518  -2.528
  326    HB3  PHE  25           HB1      PHE  25  -6.729  -9.776  -3.850
  327    HD1  PHE  25           HD1      PHE  25  -7.511 -10.544  -0.332
  328    HD2  PHE  25           HD2      PHE  25  -4.755 -11.187  -3.566
  329    HE1  PHE  25           HE1      PHE  25  -6.490 -12.431   0.914
  330    HE2  PHE  25           HE2      PHE  25  -3.734 -13.075  -2.321
  331    HZ   PHE  25           HZ       PHE  25  -4.600 -13.697  -0.081
  332    H    TYR  26           H        TYR  26  -5.915  -5.889  -1.567
  333    HA   TYR  26           HA       TYR  26  -7.634  -6.422   0.809
  334    HB2  TYR  26           HB2      TYR  26  -6.585  -4.465   1.808
  335    HB3  TYR  26           HB1      TYR  26  -5.326  -5.542   1.207
  336    HD1  TYR  26           HD2      TYR  26  -4.180  -5.040  -0.963
  337    HD2  TYR  26           HD1      TYR  26  -6.921  -2.283   0.868
  338    HE1  TYR  26           HE2      TYR  26  -3.311  -3.218  -2.405
  339    HE2  TYR  26           HE1      TYR  26  -6.051  -0.461  -0.573
  340    HH   TYR  26           HH       TYR  26  -4.211   0.115  -1.896
  341    H    THR  27           H        THR  27  -7.614  -4.870  -2.227
  342    HA   THR  27           HA       THR  27 -10.202  -3.586  -1.573
  343    HB   THR  27           HB       THR  27  -9.307  -1.545  -2.956
  344    HG1  THR  27           HG1      THR  27  -7.320  -2.356  -3.498
  345   HG21  THR  27          HG21      THR  27  -9.685  -0.698  -0.905
  346   HG22  THR  27          HG22      THR  27  -8.000  -1.058  -0.525
  347   HG23  THR  27          HG23      THR  27  -9.263  -2.228  -0.137
  348    H    LYS  28           H        LYS  28 -11.533  -3.304  -3.435
  349    HA   LYS  28           HA       LYS  28 -10.425  -4.302  -6.013
  350    HB2  LYS  28           HB2      LYS  28 -12.356  -5.663  -4.310
  351    HB3  LYS  28           HB1      LYS  28 -13.030  -5.318  -5.903
  352    HG2  LYS  28           HG2      LYS  28 -11.857  -7.039  -6.747
  353    HG3  LYS  28           HG1      LYS  28 -10.364  -6.205  -6.313
  354    HD2  LYS  28           HD2      LYS  28 -10.446  -7.187  -4.063
  355    HD3  LYS  28           HD1      LYS  28 -11.964  -7.995  -4.460
  356    HE2  LYS  28           HE2      LYS  28  -9.403  -8.423  -6.018
  357    HE3  LYS  28           HE1      LYS  28  -9.900  -9.452  -4.675
  358    HZ1  LYS  28           HZ1      LYS  28 -10.622  -9.801  -7.254
  359    HZ2  LYS  28           HZ2      LYS  28 -11.974  -8.992  -6.617
  360    HZ3  LYS  28           HZ3      LYS  28 -11.443 -10.448  -5.918
  361    HA   PRO  29           HA       PRO  29 -12.905  -0.535  -6.680
  362    HB2  PRO  29           HB2      PRO  29 -11.167   0.503  -8.540
  363    HB3  PRO  29           HB1      PRO  29 -10.993   0.747  -6.794
  364    HG2  PRO  29           HG2      PRO  29  -9.426  -1.028  -8.607
  365    HG3  PRO  29           HG1      PRO  29  -8.941  -0.279  -7.077
  366    HD2  PRO  29           HD2      PRO  29  -9.720  -2.979  -7.428
  367    HD3  PRO  29           HD1      PRO  29  -9.555  -2.133  -5.874
  368    H    THR  30           H        THR  30 -14.046  -2.663  -7.727
  369    HA   THR  30           HA       THR  30 -13.879  -2.407 -10.701
  370    HB   THR  30           HB       THR  30 -14.890  -4.642 -10.793
  371    HG1  THR  30           HG1      THR  30 -15.182  -4.121  -8.075
  372   HG21  THR  30          HG21      THR  30 -12.785  -5.020  -8.723
  373   HG22  THR  30          HG22      THR  30 -12.335  -4.111 -10.166
  374   HG23  THR  30          HG23      THR  30 -12.943  -5.760 -10.317
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1 -10.051   2.793   4.751
    2    H2   GLY   1           HT2      GLY   1 -11.121   4.090   4.513
    3    H3   GLY   1           HT3      GLY   1 -10.295   3.930   5.989
    4    HA2  GLY   1           HA1      GLY   1  -8.958   4.495   3.453
    5    HA3  GLY   1           HA2      GLY   1  -9.323   5.755   4.670
    6    H    ILE   2           H        ILE   2  -8.176   2.411   3.641
    7    HA   ILE   2           HA       ILE   2  -5.743   2.343   5.129
    8    HB   ILE   2           HB       ILE   2  -6.632   0.302   4.210
    9   HG12  ILE   2          HG12      ILE   2  -4.065   0.760   4.254
   10   HG13  ILE   2          HG11      ILE   2  -4.651  -0.651   3.380
   11   HG21  ILE   2          HG21      ILE   2  -7.842   0.844   2.305
   12   HG22  ILE   2          HG22      ILE   2  -6.411   0.104   1.586
   13   HG23  ILE   2          HG23      ILE   2  -6.558   1.860   1.651
   14   HD11  ILE   2          HD11      ILE   2  -3.817   0.130   1.440
   15   HD12  ILE   2          HD12      ILE   2  -3.054   1.429   2.355
   16   HD13  ILE   2          HD13      ILE   2  -4.647   1.671   1.644
   17    H    VAL   3           H        VAL   3  -6.604   3.959   2.176
   18    HA   VAL   3           HA       VAL   3  -3.733   4.552   1.630
   19    HB   VAL   3           HB       VAL   3  -4.503   5.330  -0.564
   20   HG11  VAL   3          HG11      VAL   3  -5.882   2.706   0.020
   21   HG12  VAL   3          HG12      VAL   3  -4.125   2.851  -0.044
   22   HG13  VAL   3          HG13      VAL   3  -5.093   3.211  -1.474
   23   HG21  VAL   3          HG21      VAL   3  -6.825   5.956   0.615
   24   HG22  VAL   3          HG22      VAL   3  -7.279   4.374  -0.021
   25   HG23  VAL   3          HG23      VAL   3  -6.722   5.640  -1.117
   26    H    GLU   4           H        GLU   4  -6.284   5.833   3.312
   27    HA   GLU   4           HA       GLU   4  -6.679   8.465   2.709
   28    HB2  GLU   4           HB2      GLU   4  -6.896   8.939   5.061
   29    HB3  GLU   4           HB1      GLU   4  -7.426   7.276   4.813
   30    HG2  GLU   4           HG2      GLU   4  -5.262   6.428   5.552
   31    HG3  GLU   4           HG1      GLU   4  -4.636   8.072   5.690
   32    H    GLN   5           H        GLN   5  -3.612   7.071   3.703
   33    HA   GLN   5           HA       GLN   5  -2.418   9.802   3.692
   34    HB2  GLN   5           HB2      GLN   5  -0.380   8.173   4.500
   35    HB3  GLN   5           HB1      GLN   5  -1.500   8.969   5.603
   36    HG2  GLN   5           HG2      GLN   5  -2.973   6.953   5.500
   37    HG3  GLN   5           HG1      GLN   5  -1.757   6.154   4.503
   38   HE21  GLN   5          HE21      GLN   5  -1.914   4.646   6.571
   39   HE22  GLN   5          HE22      GLN   5  -0.825   5.002   7.822
   40    H    CYS   6           H        CYS   6  -1.127   6.582   2.809
   41    HA   CYS   6           HA       CYS   6   0.793   7.294   0.999
   42    HB2  CYS   6           HB2      CYS   6  -1.222   5.072   0.570
   43    HB3  CYS   6           HB1      CYS   6   0.355   5.193  -0.211
   44    H    CYS   7           H        CYS   7  -2.697   7.384   0.374
   45    HA   CYS   7           HA       CYS   7  -2.376   7.988  -2.444
   46    HB2  CYS   7           HB2      CYS   7  -4.597   7.729  -0.545
   47    HB3  CYS   7           HB1      CYS   7  -4.853   8.955  -1.779
   48    H    THR   8           H        THR   8  -3.348  10.002   0.364
   49    HA   THR   8           HA       THR   8  -3.032  12.443  -1.225
   50    HB   THR   8           HB       THR   8  -4.770  12.227   0.554
   51    HG1  THR   8           HG1      THR   8  -3.538  14.252  -0.083
   52   HG21  THR   8          HG21      THR   8  -2.498  12.483   2.525
   53   HG22  THR   8          HG22      THR   8  -3.168  10.915   2.075
   54   HG23  THR   8          HG23      THR   8  -4.193  12.121   2.854
   55    H    SER   9           H        SER   9  -1.354  10.985   1.581
   56    HA   SER   9           HA       SER   9   0.922  12.838   1.021
   57    HB2  SER   9           HB2      SER   9   1.452  11.753   3.479
   58    HB3  SER   9           HB1      SER   9   0.644  13.293   3.221
   59    HG   SER   9           HG       SER   9  -0.566  11.900   4.577
   60    H    ILE  10           H        ILE  10   2.913  11.478   2.378
   61    HA   ILE  10           HA       ILE  10   3.285   9.118   0.603
   62    HB   ILE  10           HB       ILE  10   5.482  10.256   2.292
   63   HG12  ILE  10          HG12      ILE  10   4.179  12.180   1.210
   64   HG13  ILE  10          HG11      ILE  10   5.886  12.074   0.787
   65   HG21  ILE  10          HG21      ILE  10   6.302   8.515   1.017
   66   HG22  ILE  10          HG22      ILE  10   6.545   9.840  -0.120
   67   HG23  ILE  10          HG23      ILE  10   5.144   8.782  -0.286
   68   HD11  ILE  10          HD11      ILE  10   3.829  10.681  -0.910
   69   HD12  ILE  10          HD12      ILE  10   5.439  11.241  -1.356
   70   HD13  ILE  10          HD13      ILE  10   4.136  12.405  -1.125
   71    H    CYS  11           H        CYS  11   4.657   7.318   1.689
   72    HA   CYS  11           HA       CYS  11   4.347   7.045   4.585
   73    HB2  CYS  11           HB2      CYS  11   3.006   4.890   4.316
   74    HB3  CYS  11           HB1      CYS  11   2.116   6.385   4.035
   75    H    SER  12           H        SER  12   4.828   4.444   4.989
   76    HA   SER  12           HA       SER  12   7.358   3.974   3.477
   77    HB2  SER  12           HB2      SER  12   7.431   2.259   5.598
   78    HB3  SER  12           HB1      SER  12   8.124   3.877   5.608
   79    HG   SER  12           HG       SER  12   6.482   4.584   6.777
   80    H    LEU  13           H        LEU  13   7.339   2.301   2.040
   81    HA   LEU  13           HA       LEU  13   5.083   0.676   1.595
   82    HB2  LEU  13           HB2      LEU  13   6.440  -0.682   0.129
   83    HB3  LEU  13           HB1      LEU  13   6.906   0.997  -0.071
   84    HG   LEU  13           HG       LEU  13   8.905  -0.351  -0.024
   85   HD11  LEU  13          HD11      LEU  13  10.130   0.663   1.800
   86   HD12  LEU  13          HD12      LEU  13   8.636   0.985   2.674
   87   HD13  LEU  13          HD13      LEU  13   8.973   1.832   1.168
   88   HD21  LEU  13          HD21      LEU  13   7.500  -2.034   1.640
   89   HD22  LEU  13          HD22      LEU  13   8.665  -1.304   2.745
   90   HD23  LEU  13          HD23      LEU  13   9.227  -2.153   1.304
   91    H    TYR  14           H        TYR  14   7.568   0.355   3.980
   92    HA   TYR  14           HA       TYR  14   7.096  -2.467   4.464
   93    HB2  TYR  14           HB2      TYR  14   8.356  -2.146   6.552
   94    HB3  TYR  14           HB1      TYR  14   9.208  -1.422   5.193
   95    HD1  TYR  14           HD1      TYR  14   6.611  -0.462   7.752
   96    HD2  TYR  14           HD2      TYR  14  10.069   0.709   5.481
   97    HE1  TYR  14           HE1      TYR  14   6.653   1.715   8.936
   98    HE2  TYR  14           HE2      TYR  14  10.111   2.887   6.668
   99    HH   TYR  14           HH       TYR  14   8.024   4.314   7.965
  100    H    GLN  15           H        GLN  15   5.669   0.523   5.467
  101    HA   GLN  15           HA       GLN  15   4.085  -0.660   7.596
  102    HB2  GLN  15           HB2      GLN  15   3.266   1.507   7.909
  103    HB3  GLN  15           HB1      GLN  15   4.852   1.823   7.226
  104    HG2  GLN  15           HG2      GLN  15   3.769   3.082   5.695
  105    HG3  GLN  15           HG1      GLN  15   3.260   1.554   4.985
  106   HE21  GLN  15          HE21      GLN  15   1.451   0.754   7.128
  107   HE22  GLN  15          HE22      GLN  15   0.124   1.810   7.088
  108    H    LEU  16           H        LEU  16   3.926  -0.332   4.171
  109    HA   LEU  16           HA       LEU  16   1.064  -0.625   3.860
  110    HB2  LEU  16           HB2      LEU  16   3.466  -0.879   2.075
  111    HB3  LEU  16           HB1      LEU  16   1.922  -1.522   1.520
  112    HG   LEU  16           HG       LEU  16   2.508   0.927   0.918
  113   HD11  LEU  16          HD11      LEU  16  -0.002  -0.283   1.872
  114   HD12  LEU  16          HD12      LEU  16   0.332   0.579   0.370
  115   HD13  LEU  16          HD13      LEU  16  -0.011   1.480   1.847
  116   HD21  LEU  16          HD21      LEU  16   1.808   2.549   2.682
  117   HD22  LEU  16          HD22      LEU  16   3.260   1.651   3.119
  118   HD23  LEU  16          HD23      LEU  16   1.705   1.213   3.827
  119    H    GLU  17           H        GLU  17   3.727  -2.785   4.433
  120    HA   GLU  17           HA       GLU  17   2.691  -5.232   3.486
  121    HB2  GLU  17           HB2      GLU  17   4.141  -6.293   5.065
  122    HB3  GLU  17           HB1      GLU  17   4.947  -4.796   4.599
  123    HG2  GLU  17           HG2      GLU  17   3.754  -3.751   6.642
  124    HG3  GLU  17           HG1      GLU  17   3.478  -5.416   7.157
  125    H    ASN  18           H        ASN  18   1.721  -3.222   6.110
  126    HA   ASN  18           HA       ASN  18   0.305  -5.111   7.718
  127    HB2  ASN  18           HB2      ASN  18   0.835  -2.456   7.931
  128    HB3  ASN  18           HB1      ASN  18  -0.864  -2.400   7.462
  129   HD21  ASN  18          HD21      ASN  18   1.307  -4.057   9.818
  130   HD22  ASN  18          HD22      ASN  18   0.136  -4.167  11.043
  131    H    TYR  19           H        TYR  19  -0.348  -3.978   4.573
  132    HA   TYR  19           HA       TYR  19  -3.236  -4.653   4.814
  133    HB2  TYR  19           HB2      TYR  19  -1.934  -3.508   2.354
  134    HB3  TYR  19           HB1      TYR  19  -3.610  -3.371   2.882
  135    HD1  TYR  19           HD2      TYR  19  -2.759  -2.846   5.873
  136    HD2  TYR  19           HD1      TYR  19  -1.684  -1.070   2.111
  137    HE1  TYR  19           HE2      TYR  19  -2.215  -0.721   7.032
  138    HE2  TYR  19           HE1      TYR  19  -1.141   1.055   3.269
  139    HH   TYR  19           HH       TYR  19  -0.727   1.977   5.319
  140    H    CYS  20           H        CYS  20  -1.076  -6.670   4.785
  141    HA   CYS  20           HA       CYS  20  -1.725  -8.019   2.207
  142    HB2  CYS  20           HB2      CYS  20   0.759  -7.847   3.827
  143    HB3  CYS  20           HB1      CYS  20   0.407  -9.416   3.104
  144    H    ASN  21           H        ASN  21  -1.455 -10.559   2.580
  145    HA   ASN  21           HA       ASN  21  -3.363 -11.221   4.727
  146    HB2  ASN  21           HB2      ASN  21  -2.349 -12.539   2.262
  147    HB3  ASN  21           HB1      ASN  21  -2.814 -13.609   3.587
  148   HD21  ASN  21          HD21      ASN  21  -4.647 -14.234   2.045
  149   HD22  ASN  21          HD22      ASN  21  -6.036 -13.260   2.022
  150    H1   PHE   1           HT1      PHE   1  11.258   1.394  -1.176
  151    H2   PHE   1           HT2      PHE   1  12.053   2.133  -2.483
  152    H3   PHE   1           HT3      PHE   1  11.203   0.680  -2.713
  153    HA   PHE   1           HA       PHE   1   9.482   1.905  -3.356
  154    HB2  PHE   1           HB2      PHE   1   9.196   1.427  -0.744
  155    HB3  PHE   1           HB1      PHE   1   9.276   3.187  -0.664
  156    HD1  PHE   1           HD1      PHE   1   7.863   0.967  -3.324
  157    HD2  PHE   1           HD2      PHE   1   7.065   3.907  -0.293
  158    HE1  PHE   1           HE1      PHE   1   5.507   1.109  -4.083
  159    HE2  PHE   1           HE2      PHE   1   4.709   4.048  -1.050
  160    HZ   PHE   1           HZ       PHE   1   3.929   2.651  -2.947
  161    H    VAL   2           H        VAL   2   8.455   4.339  -3.009
  162    HA   VAL   2           HA       VAL   2  10.751   6.227  -3.337
  163    HB   VAL   2           HB       VAL   2   9.197   7.428  -4.983
  164   HG11  VAL   2          HG11      VAL   2   9.881   5.988  -6.834
  165   HG12  VAL   2          HG12      VAL   2  10.132   4.639  -5.725
  166   HG13  VAL   2          HG13      VAL   2  11.179   6.056  -5.640
  167   HG21  VAL   2          HG21      VAL   2   7.851   4.709  -4.966
  168   HG22  VAL   2          HG22      VAL   2   7.432   6.085  -5.987
  169   HG23  VAL   2          HG23      VAL   2   7.161   6.164  -4.247
  170    H    ASN   3           H        ASN   3   9.849   8.597  -3.171
  171    HA   ASN   3           HA       ASN   3   8.002   8.660  -0.820
  172    HB2  ASN   3           HB2      ASN   3  10.198  10.575  -1.663
  173    HB3  ASN   3           HB1      ASN   3   9.091  10.867  -0.321
  174   HD21  ASN   3          HD21      ASN   3  11.744   8.769  -1.431
  175   HD22  ASN   3          HD22      ASN   3  12.096   8.121   0.097
  176    H    GLN   4           H        GLN   4   6.238   8.607  -2.505
  177    HA   GLN   4           HA       GLN   4   5.504  11.372  -3.219
  178    HB2  GLN   4           HB2      GLN   4   4.816  10.391  -5.559
  179    HB3  GLN   4           HB1      GLN   4   6.483  10.903  -5.290
  180    HG2  GLN   4           HG2      GLN   4   7.080   8.561  -4.698
  181    HG3  GLN   4           HG1      GLN   4   5.426   8.070  -5.067
  182   HE21  GLN   4          HE21      GLN   4   4.796   9.294  -7.410
  183   HE22  GLN   4          HE22      GLN   4   5.907   8.914  -8.636
  184    H    HIS   5           H        HIS   5   3.229  10.968  -4.593
  185    HA   HIS   5           HA       HIS   5   1.588   9.388  -2.680
  186    HB2  HIS   5           HB2      HIS   5   0.442  11.205  -4.783
  187    HB3  HIS   5           HB1      HIS   5  -0.197  10.807  -3.187
  188    HD2  HIS   5           HD2      HIS   5   2.581  13.126  -4.757
  189    HE1  HIS   5           HE1      HIS   5   1.937  14.273  -0.740
  190    HE2  HIS   5           HE2      HIS   5   3.145  14.866  -2.908
  191    H    LEU   6           H        LEU   6   0.165   7.771  -3.430
  192    HA   LEU   6           HA       LEU   6   0.041   7.220  -6.313
  193    HB2  LEU   6           HB2      LEU   6   0.794   4.865  -6.015
  194    HB3  LEU   6           HB1      LEU   6   2.067   6.034  -5.710
  195    HG   LEU   6           HG       LEU   6   2.131   4.269  -4.024
  196   HD11  LEU   6          HD11      LEU   6   2.529   5.655  -2.261
  197   HD12  LEU   6          HD12      LEU   6   0.963   6.454  -2.397
  198   HD13  LEU   6          HD13      LEU   6   2.282   6.905  -3.479
  199   HD21  LEU   6          HD21      LEU   6  -0.570   4.139  -4.268
  200   HD22  LEU   6          HD22      LEU   6  -0.427   5.042  -2.760
  201   HD23  LEU   6          HD23      LEU   6   0.324   3.456  -2.911
  202    H    CYS   7           H        CYS   7  -1.667   5.695  -6.847
  203    HA   CYS   7           HA       CYS   7  -3.389   4.748  -4.650
  204    HB2  CYS   7           HB2      CYS   7  -4.380   6.748  -6.704
  205    HB3  CYS   7           HB1      CYS   7  -5.392   5.906  -5.531
  206    H    GLY   8           H        GLY   8  -5.384   3.624  -5.665
  207    HA2  GLY   8           HA2      GLY   8  -6.157   1.878  -7.016
  208    HA3  GLY   8           HA1      GLY   8  -5.545   2.843  -8.356
  209    H    SER   9           H        SER   9  -4.499   1.382  -9.612
  210    HA   SER   9           HA       SER   9  -3.182  -0.965  -8.779
  211    HB2  SER   9           HB2      SER   9  -3.621  -0.789 -11.093
  212    HB3  SER   9           HB1      SER   9  -2.872   0.801 -11.202
  213    HG   SER   9           HG       SER   9  -1.540  -0.905 -12.016
  214    H    ASP  10           H        ASP  10  -2.197   2.302  -8.433
  215    HA   ASP  10           HA       ASP  10   0.656   1.746  -8.360
  216    HB2  ASP  10           HB2      ASP  10  -0.720   4.102  -7.063
  217    HB3  ASP  10           HB1      ASP  10   0.929   4.018  -7.684
  218    H    LEU  11           H        LEU  11  -1.949   1.885  -6.009
  219    HA   LEU  11           HA       LEU  11  -0.291   1.742  -3.673
  220    HB2  LEU  11           HB2      LEU  11  -3.050   0.536  -4.004
  221    HB3  LEU  11           HB1      LEU  11  -2.274   1.003  -2.492
  222    HG   LEU  11           HG       LEU  11  -2.568   3.081  -4.621
  223   HD11  LEU  11          HD11      LEU  11  -4.833   3.626  -3.590
  224   HD12  LEU  11          HD12      LEU  11  -4.797   2.015  -2.872
  225   HD13  LEU  11          HD13      LEU  11  -4.797   2.198  -4.626
  226   HD21  LEU  11          HD21      LEU  11  -1.476   3.145  -2.182
  227   HD22  LEU  11          HD22      LEU  11  -3.146   3.453  -1.713
  228   HD23  LEU  11          HD23      LEU  11  -2.335   4.537  -2.840
  229    H    VAL  12           H        VAL  12  -1.448  -0.634  -5.972
  230    HA   VAL  12           HA       VAL  12  -0.439  -2.852  -4.343
  231    HB   VAL  12           HB       VAL  12  -0.745  -4.193  -6.484
  232   HG11  VAL  12          HG11      VAL  12  -2.440  -4.575  -4.995
  233   HG12  VAL  12          HG12      VAL  12  -3.372  -3.782  -6.265
  234   HG13  VAL  12          HG13      VAL  12  -2.846  -2.865  -4.854
  235   HG21  VAL  12          HG21      VAL  12  -2.085  -1.619  -7.350
  236   HG22  VAL  12          HG22      VAL  12  -2.219  -3.165  -8.184
  237   HG23  VAL  12          HG23      VAL  12  -0.658  -2.354  -8.080
  238    H    GLU  13           H        GLU  13   0.617  -1.068  -7.265
  239    HA   GLU  13           HA       GLU  13   2.891  -2.497  -7.952
  240    HB2  GLU  13           HB2      GLU  13   2.513  -0.525  -9.208
  241    HB3  GLU  13           HB1      GLU  13   2.406   0.477  -7.760
  242    HG2  GLU  13           HG2      GLU  13   4.631   0.839  -7.742
  243    HG3  GLU  13           HG1      GLU  13   4.977  -0.880  -7.936
  244    H    ALA  14           H        ALA  14   2.256  -0.578  -5.158
  245    HA   ALA  14           HA       ALA  14   4.947  -0.695  -4.048
  246    HB1  ALA  14           HB1      ALA  14   2.385  -0.091  -2.569
  247    HB2  ALA  14           HB2      ALA  14   3.149   1.098  -3.624
  248    HB3  ALA  14           HB3      ALA  14   4.009   0.493  -2.207
  249    H    LEU  15           H        LEU  15   1.828  -1.985  -2.970
  250    HA   LEU  15           HA       LEU  15   2.979  -3.887  -1.137
  251    HB2  LEU  15           HB2      LEU  15   0.281  -3.239  -2.202
  252    HB3  LEU  15           HB1      LEU  15   0.497  -4.870  -1.571
  253    HG   LEU  15           HG       LEU  15   1.680  -2.825   0.161
  254   HD11  LEU  15          HD11      LEU  15  -0.479  -1.948   0.982
  255   HD12  LEU  15          HD12      LEU  15  -1.322  -2.822  -0.297
  256   HD13  LEU  15          HD13      LEU  15  -0.221  -1.505  -0.706
  257   HD21  LEU  15          HD21      LEU  15   1.176  -4.416   1.690
  258   HD22  LEU  15          HD22      LEU  15   0.658  -5.419   0.336
  259   HD23  LEU  15          HD23      LEU  15  -0.520  -4.437   1.204
  260    H    TYR  16           H        TYR  16   2.950  -3.880  -4.453
  261    HA   TYR  16           HA       TYR  16   2.413  -6.717  -4.898
  262    HB2  TYR  16           HB2      TYR  16   1.728  -5.588  -6.774
  263    HB3  TYR  16           HB1      TYR  16   2.905  -4.300  -6.555
  264    HD1  TYR  16           HD1      TYR  16   2.714  -7.928  -7.462
  265    HD2  TYR  16           HD2      TYR  16   4.758  -4.180  -7.937
  266    HE1  TYR  16           HE1      TYR  16   4.187  -8.950  -9.183
  267    HE2  TYR  16           HE2      TYR  16   6.233  -5.198  -9.657
  268    HH   TYR  16           HH       TYR  16   6.748  -7.039 -10.780
  269    H    LEU  17           H        LEU  17   5.263  -4.562  -4.990
  270    HA   LEU  17           HA       LEU  17   6.964  -6.956  -5.383
  271    HB2  LEU  17           HB2      LEU  17   8.729  -4.870  -5.169
  272    HB3  LEU  17           HB1      LEU  17   8.058  -5.479  -6.673
  273    HG   LEU  17           HG       LEU  17   6.153  -3.844  -6.389
  274   HD11  LEU  17          HD11      LEU  17   7.342  -3.549  -3.844
  275   HD12  LEU  17          HD12      LEU  17   5.980  -2.638  -4.498
  276   HD13  LEU  17          HD13      LEU  17   7.624  -2.030  -4.693
  277   HD21  LEU  17          HD21      LEU  17   8.793  -2.396  -6.435
  278   HD22  LEU  17          HD22      LEU  17   7.354  -2.105  -7.414
  279   HD23  LEU  17          HD23      LEU  17   8.362  -3.518  -7.726
  280    H    VAL  18           H        VAL  18   5.751  -5.119  -2.830
  281    HA   VAL  18           HA       VAL  18   8.049  -5.622  -1.054
  282    HB   VAL  18           HB       VAL  18   6.839  -4.456   0.633
  283   HG11  VAL  18          HG11      VAL  18   6.666  -3.384  -2.126
  284   HG12  VAL  18          HG12      VAL  18   7.428  -2.689  -0.695
  285   HG13  VAL  18          HG13      VAL  18   5.682  -2.564  -0.915
  286   HG21  VAL  18          HG21      VAL  18   4.399  -3.884   0.276
  287   HG22  VAL  18          HG22      VAL  18   4.725  -5.598   0.536
  288   HG23  VAL  18          HG23      VAL  18   4.416  -4.996  -1.091
  289    H    CYS  19           H        CYS  19   4.743  -6.751  -1.508
  290    HA   CYS  19           HA       CYS  19   5.129  -8.876   0.508
  291    HB2  CYS  19           HB2      CYS  19   2.825  -7.671  -0.915
  292    HB3  CYS  19           HB1      CYS  19   2.692  -9.396  -0.581
  293    H    GLY  20           H        GLY  20   3.911  -8.848  -2.867
  294    HA2  GLY  20           HA2      GLY  20   4.259 -10.384  -4.606
  295    HA3  GLY  20           HA1      GLY  20   5.803 -10.754  -3.836
  296    H    GLU  21           H        GLU  21   2.683 -11.935  -4.499
  297    HA   GLU  21           HA       GLU  21   1.615 -13.944  -3.929
  298    HB2  GLU  21           HB2      GLU  21   3.965 -14.739  -4.610
  299    HB3  GLU  21           HB1      GLU  21   4.290 -14.861  -2.881
  300    HG2  GLU  21           HG2      GLU  21   1.776 -16.082  -3.289
  301    HG3  GLU  21           HG1      GLU  21   2.827 -16.684  -4.572
  302    H    ARG  22           H        ARG  22   2.325 -11.741  -1.818
  303    HA   ARG  22           HA       ARG  22   2.091 -13.377   0.646
  304    HB2  ARG  22           HB2      ARG  22   3.466 -11.055   0.125
  305    HB3  ARG  22           HB1      ARG  22   2.004 -10.440   0.895
  306    HG2  ARG  22           HG2      ARG  22   3.015 -10.943   2.856
  307    HG3  ARG  22           HG1      ARG  22   2.657 -12.625   2.467
  308    HD2  ARG  22           HD2      ARG  22   5.162 -11.230   1.501
  309    HD3  ARG  22           HD1      ARG  22   5.096 -12.120   3.022
  310    HE   ARG  22           HE       ARG  22   4.704 -13.351   0.328
  311   HH11  ARG  22          HH21      ARG  22   7.211 -13.867   1.874
  312   HH12  ARG  22          HH22      ARG  22   6.853 -15.368   2.663
  313   HH21  ARG  22          HH11      ARG  22   3.434 -15.136   2.132
  314   HH22  ARG  22          HH12      ARG  22   4.716 -16.086   2.807
  315    H    GLY  23           H        GLY  23  -0.056 -12.739  -1.533
  316    HA2  GLY  23           HA2      GLY  23  -2.385 -12.464  -1.508
  317    HA3  GLY  23           HA1      GLY  23  -2.306 -12.737   0.233
  318    H    ALA  24           H        ALA  24  -4.127 -10.941  -0.314
  319    HA   ALA  24           HA       ALA  24  -3.515  -8.611   1.044
  320    HB1  ALA  24           HB1      ALA  24  -3.354  -7.047  -1.091
  321    HB2  ALA  24           HB2      ALA  24  -2.667  -8.494  -1.828
  322    HB3  ALA  24           HB3      ALA  24  -1.904  -7.780  -0.408
  323    H    PHE  25           H        PHE  25  -5.468  -7.664   1.434
  324    HA   PHE  25           HA       PHE  25  -7.514  -7.621  -0.696
  325    HB2  PHE  25           HB2      PHE  25  -9.227  -8.581   0.807
  326    HB3  PHE  25           HB1      PHE  25  -7.925  -9.733   0.510
  327    HD1  PHE  25           HD2      PHE  25  -5.898  -9.596   2.219
  328    HD2  PHE  25           HD1      PHE  25  -9.876  -8.176   3.012
  329    HE1  PHE  25           HE2      PHE  25  -5.460  -9.734   4.657
  330    HE2  PHE  25           HE1      PHE  25  -9.439  -8.315   5.452
  331    HZ   PHE  25           HZ       PHE  25  -7.231  -9.094   6.273
  332    H    TYR  26           H        TYR  26  -7.947  -5.463  -0.750
  333    HA   TYR  26           HA       TYR  26  -8.323  -4.068   1.871
  334    HB2  TYR  26           HB2      TYR  26  -7.741  -1.978   0.483
  335    HB3  TYR  26           HB1      TYR  26  -6.417  -3.078   0.865
  336    HD1  TYR  26           HD1      TYR  26  -8.665  -1.855  -1.784
  337    HD2  TYR  26           HD2      TYR  26  -5.415  -4.505  -0.842
  338    HE1  TYR  26           HE1      TYR  26  -8.223  -2.174  -4.205
  339    HE2  TYR  26           HE2      TYR  26  -4.974  -4.824  -3.264
  340    HH   TYR  26           HH       TYR  26  -6.456  -2.853  -5.677
  341    H    THR  27           H        THR  27  -9.919  -5.247  -0.793
  342    HA   THR  27           HA       THR  27 -11.788  -3.035  -1.193
  343    HB   THR  27           HB       THR  27 -12.976  -4.577  -2.661
  344    HG1  THR  27           HG1      THR  27 -12.962  -6.499  -1.721
  345   HG21  THR  27          HG21      THR  27 -11.175  -5.118  -4.216
  346   HG22  THR  27          HG22      THR  27  -9.984  -4.980  -2.923
  347   HG23  THR  27          HG23      THR  27 -10.859  -3.551  -3.474
  348    H    LYS  28           H        LYS  28 -14.035  -3.085  -0.555
  349    HA   LYS  28           HA       LYS  28 -14.596  -4.944   1.721
  350    HB2  LYS  28           HB2      LYS  28 -15.684  -2.133   1.522
  351    HB3  LYS  28           HB1      LYS  28 -15.633  -3.186   2.935
  352    HG2  LYS  28           HG2      LYS  28 -12.966  -3.000   2.134
  353    HG3  LYS  28           HG1      LYS  28 -13.596  -1.366   1.921
  354    HD2  LYS  28           HD2      LYS  28 -13.895  -3.019   4.446
  355    HD3  LYS  28           HD1      LYS  28 -12.710  -1.732   4.216
  356    HE2  LYS  28           HE2      LYS  28 -14.271  -0.274   4.933
  357    HE3  LYS  28           HE1      LYS  28 -15.168  -0.607   3.451
  358    HZ1  LYS  28           HZ1      LYS  28 -16.468  -2.197   4.497
  359    HZ2  LYS  28           HZ2      LYS  28 -16.332  -0.984   5.678
  360    HZ3  LYS  28           HZ3      LYS  28 -15.387  -2.392   5.790
  361    HA   PRO  29           HA       PRO  29 -17.923  -5.580  -1.316
  362    HB2  PRO  29           HB2      PRO  29 -18.147  -8.268  -0.779
  363    HB3  PRO  29           HB1      PRO  29 -16.989  -7.595  -1.940
  364    HG2  PRO  29           HG2      PRO  29 -16.491  -8.674   0.795
  365    HG3  PRO  29           HG1      PRO  29 -15.394  -8.582  -0.592
  366    HD2  PRO  29           HD2      PRO  29 -15.400  -6.836   1.637
  367    HD3  PRO  29           HD1      PRO  29 -14.539  -6.574   0.106
  368    H    THR  30           H        THR  30 -19.327  -4.333   0.150
  369    HA   THR  30           HA       THR  30 -20.805  -6.071   2.087
  370    HB   THR  30           HB       THR  30 -21.309  -3.935   3.321
  371    HG1  THR  30           HG1      THR  30 -20.708  -2.688   1.349
  372   HG21  THR  30          HG21      THR  30 -18.417  -4.755   2.957
  373   HG22  THR  30          HG22      THR  30 -19.553  -5.367   4.159
  374   HG23  THR  30          HG23      THR  30 -18.982  -3.701   4.254
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  -8.935   5.436   2.662
    2    H2   GLY   1           HT2      GLY   1 -10.599   5.496   2.993
    3    H3   GLY   1           HT3      GLY   1  -9.898   4.060   2.416
    4    HA2  GLY   1           HA1      GLY   1  -9.216   5.203   5.015
    5    HA3  GLY   1           HA2      GLY   1 -10.450   3.919   4.831
    6    H    ILE   2           H        ILE   2  -7.893   3.107   3.018
    7    HA   ILE   2           HA       ILE   2  -5.978   2.699   5.270
    8    HB   ILE   2           HB       ILE   2  -6.851   0.660   4.139
    9   HG12  ILE   2          HG12      ILE   2  -4.724  -0.421   3.903
   10   HG13  ILE   2          HG11      ILE   2  -3.933   1.090   3.449
   11   HG21  ILE   2          HG21      ILE   2  -6.827   2.073   1.865
   12   HG22  ILE   2          HG22      ILE   2  -6.693   0.314   1.864
   13   HG23  ILE   2          HG23      ILE   2  -5.246   1.309   1.708
   14   HD11  ILE   2          HD11      ILE   2  -5.324   1.106   6.067
   15   HD12  ILE   2          HD12      ILE   2  -3.775   1.812   5.610
   16   HD13  ILE   2          HD13      ILE   2  -3.887   0.090   5.970
   17    H    VAL   3           H        VAL   3  -6.331   4.099   2.083
   18    HA   VAL   3           HA       VAL   3  -3.421   4.683   1.965
   19    HB   VAL   3           HB       VAL   3  -3.767   5.277  -0.320
   20   HG11  VAL   3          HG11      VAL   3  -3.822   2.925  -0.195
   21   HG12  VAL   3          HG12      VAL   3  -5.266   3.319  -1.127
   22   HG13  VAL   3          HG13      VAL   3  -5.404   2.916   0.583
   23   HG21  VAL   3          HG21      VAL   3  -6.033   5.529  -1.283
   24   HG22  VAL   3          HG22      VAL   3  -5.767   6.684   0.023
   25   HG23  VAL   3          HG23      VAL   3  -6.737   5.240   0.307
   26    H    GLU   4           H        GLU   4  -6.044   6.041   3.387
   27    HA   GLU   4           HA       GLU   4  -6.345   8.672   2.705
   28    HB2  GLU   4           HB2      GLU   4  -6.328   9.164   5.234
   29    HB3  GLU   4           HB1      GLU   4  -7.464   7.941   4.664
   30    HG2  GLU   4           HG2      GLU   4  -6.459   6.334   5.882
   31    HG3  GLU   4           HG1      GLU   4  -4.873   6.764   5.240
   32    H    GLN   5           H        GLN   5  -3.412   7.226   3.998
   33    HA   GLN   5           HA       GLN   5  -2.147   9.924   3.992
   34    HB2  GLN   5           HB2      GLN   5  -0.234   8.480   5.125
   35    HB3  GLN   5           HB1      GLN   5  -1.618   9.030   6.069
   36    HG2  GLN   5           HG2      GLN   5  -2.743   6.872   5.704
   37    HG3  GLN   5           HG1      GLN   5  -1.379   6.318   4.732
   38   HE21  GLN   5          HE21      GLN   5  -2.150   4.940   7.125
   39   HE22  GLN   5          HE22      GLN   5  -0.916   5.137   8.275
   40    H    CYS   6           H        CYS   6  -1.535   6.565   2.896
   41    HA   CYS   6           HA       CYS   6   0.809   7.168   1.397
   42    HB2  CYS   6           HB2      CYS   6  -1.233   5.097   0.586
   43    HB3  CYS   6           HB1      CYS   6   0.516   5.047   0.361
   44    H    CYS   7           H        CYS   7  -2.595   7.607   0.704
   45    HA   CYS   7           HA       CYS   7  -2.161   8.158  -2.132
   46    HB2  CYS   7           HB2      CYS   7  -4.447   7.958  -0.308
   47    HB3  CYS   7           HB1      CYS   7  -4.613   9.228  -1.515
   48    H    THR   8           H        THR   8  -3.395  10.198   0.544
   49    HA   THR   8           HA       THR   8  -2.947  12.655  -0.870
   50    HB   THR   8           HB       THR   8  -4.480  12.331   1.124
   51    HG1  THR   8           HG1      THR   8  -2.578  14.373   0.878
   52   HG21  THR   8          HG21      THR   8  -1.971  12.705   2.759
   53   HG22  THR   8          HG22      THR   8  -2.625  11.103   2.417
   54   HG23  THR   8          HG23      THR   8  -3.586  12.276   3.319
   55    H    SER   9           H        SER   9  -0.999  10.871   1.517
   56    HA   SER   9           HA       SER   9   1.263  12.717   0.863
   57    HB2  SER   9           HB2      SER   9   2.004  11.491   3.201
   58    HB3  SER   9           HB1      SER   9   1.254  13.077   3.097
   59    HG   SER   9           HG       SER   9   0.292  11.213   4.443
   60    H    ILE  10           H        ILE  10   3.313  11.180   1.973
   61    HA   ILE  10           HA       ILE  10   3.495   9.037  -0.055
   62    HB   ILE  10           HB       ILE  10   5.710   9.697   1.858
   63   HG12  ILE  10          HG12      ILE  10   4.778  11.889   1.147
   64   HG13  ILE  10          HG11      ILE  10   6.370  11.605   0.447
   65   HG21  ILE  10          HG21      ILE  10   6.863   8.472   0.363
   66   HG22  ILE  10          HG22      ILE  10   6.395   9.575  -0.931
   67   HG23  ILE  10          HG23      ILE  10   5.368   8.198  -0.531
   68   HD11  ILE  10          HD11      ILE  10   5.381  12.098  -1.534
   69   HD12  ILE  10          HD12      ILE  10   3.760  11.851  -0.885
   70   HD13  ILE  10          HD13      ILE  10   4.710  10.470  -1.433
   71    H    CYS  11           H        CYS  11   4.696   6.978   0.784
   72    HA   CYS  11           HA       CYS  11   3.977   6.290   3.569
   73    HB2  CYS  11           HB2      CYS  11   2.477   5.410   1.221
   74    HB3  CYS  11           HB1      CYS  11   3.099   4.054   2.162
   75    H    SER  12           H        SER  12   4.527   3.655   3.632
   76    HA   SER  12           HA       SER  12   7.211   3.391   2.338
   77    HB2  SER  12           HB2      SER  12   7.705   2.034   4.528
   78    HB3  SER  12           HB1      SER  12   7.809   3.793   4.553
   79    HG   SER  12           HG       SER  12   6.071   3.880   5.760
   80    H    LEU  13           H        LEU  13   7.790   1.227   1.765
   81    HA   LEU  13           HA       LEU  13   5.566  -0.442   1.029
   82    HB2  LEU  13           HB2      LEU  13   7.594  -2.177   0.769
   83    HB3  LEU  13           HB1      LEU  13   7.283  -0.912  -0.415
   84    HG   LEU  13           HG       LEU  13   8.986   0.502   0.553
   85   HD11  LEU  13          HD11      LEU  13  10.365  -0.694   2.481
   86   HD12  LEU  13          HD12      LEU  13   8.820  -1.479   2.790
   87   HD13  LEU  13          HD13      LEU  13   8.948   0.280   2.861
   88   HD21  LEU  13          HD21      LEU  13   9.695  -1.384  -0.947
   89   HD22  LEU  13          HD22      LEU  13  10.048  -2.332   0.497
   90   HD23  LEU  13          HD23      LEU  13  10.954  -0.855   0.169
   91    H    TYR  14           H        TYR  14   7.549  -0.280   3.879
   92    HA   TYR  14           HA       TYR  14   6.863  -2.972   4.727
   93    HB2  TYR  14           HB2      TYR  14   7.828  -2.222   6.949
   94    HB3  TYR  14           HB1      TYR  14   8.935  -2.119   5.583
   95    HD1  TYR  14           HD1      TYR  14   6.422  -0.058   7.458
   96    HD2  TYR  14           HD2      TYR  14  10.050  -0.110   5.155
   97    HE1  TYR  14           HE1      TYR  14   6.738   2.363   7.899
   98    HE2  TYR  14           HE2      TYR  14  10.367   2.311   5.596
   99    HH   TYR  14           HH       TYR  14   8.272   4.331   6.353
  100    H    GLN  15           H        GLN  15   5.675   0.270   5.290
  101    HA   GLN  15           HA       GLN  15   3.770  -0.520   7.314
  102    HB2  GLN  15           HB2      GLN  15   3.217   1.719   7.378
  103    HB3  GLN  15           HB1      GLN  15   4.800   1.843   6.631
  104    HG2  GLN  15           HG2      GLN  15   3.836   2.051   4.438
  105    HG3  GLN  15           HG1      GLN  15   2.226   1.660   5.041
  106   HE21  GLN  15          HE21      GLN  15   1.024   3.337   6.117
  107   HE22  GLN  15          HE22      GLN  15   1.564   4.945   6.182
  108    H    LEU  16           H        LEU  16   3.741  -0.088   3.831
  109    HA   LEU  16           HA       LEU  16   0.968  -0.411   3.352
  110    HB2  LEU  16           HB2      LEU  16   3.483  -0.770   1.785
  111    HB3  LEU  16           HB1      LEU  16   2.022  -1.521   1.145
  112    HG   LEU  16           HG       LEU  16   0.861   0.674   1.373
  113   HD11  LEU  16          HD11      LEU  16   3.509   2.019   1.630
  114   HD12  LEU  16          HD12      LEU  16   2.749   1.395   3.092
  115   HD13  LEU  16          HD13      LEU  16   1.911   2.590   2.106
  116   HD21  LEU  16          HD21      LEU  16   2.254   1.802  -0.486
  117   HD22  LEU  16          HD22      LEU  16   1.647   0.179  -0.812
  118   HD23  LEU  16          HD23      LEU  16   3.330   0.413  -0.341
  119    H    GLU  17           H        GLU  17   3.472  -2.720   4.161
  120    HA   GLU  17           HA       GLU  17   2.262  -5.118   3.272
  121    HB2  GLU  17           HB2      GLU  17   4.328  -5.591   4.168
  122    HB3  GLU  17           HB1      GLU  17   4.187  -4.349   5.409
  123    HG2  GLU  17           HG2      GLU  17   2.673  -5.779   6.704
  124    HG3  GLU  17           HG1      GLU  17   2.736  -7.012   5.446
  125    H    ASN  18           H        ASN  18   1.346  -2.893   5.742
  126    HA   ASN  18           HA       ASN  18  -0.241  -4.613   7.389
  127    HB2  ASN  18           HB2      ASN  18   0.486  -1.973   7.471
  128    HB3  ASN  18           HB1      ASN  18  -1.219  -1.853   7.034
  129   HD21  ASN  18          HD21      ASN  18   0.917  -3.521   9.412
  130   HD22  ASN  18          HD22      ASN  18  -0.227  -3.516  10.665
  131    H    TYR  19           H        TYR  19  -0.752  -3.287   4.249
  132    HA   TYR  19           HA       TYR  19  -3.668  -3.634   4.335
  133    HB2  TYR  19           HB2      TYR  19  -2.048  -3.207   1.829
  134    HB3  TYR  19           HB1      TYR  19  -3.703  -2.707   2.165
  135    HD1  TYR  19           HD2      TYR  19  -2.705  -1.830   5.133
  136    HD2  TYR  19           HD1      TYR  19  -1.609  -0.838   1.097
  137    HE1  TYR  19           HE2      TYR  19  -1.877   0.380   5.899
  138    HE2  TYR  19           HE1      TYR  19  -0.785   1.372   1.865
  139    HH   TYR  19           HH       TYR  19  -1.577   2.827   4.463
  140    H    CYS  20           H        CYS  20  -0.989  -5.638   3.880
  141    HA   CYS  20           HA       CYS  20  -2.117  -7.408   1.872
  142    HB2  CYS  20           HB2      CYS  20   0.084  -7.874   3.900
  143    HB3  CYS  20           HB1      CYS  20  -0.292  -8.942   2.548
  144    H    ASN  21           H        ASN  21  -3.108  -6.769   4.955
  145    HA   ASN  21           HA       ASN  21  -3.839  -9.594   5.550
  146    HB2  ASN  21           HB2      ASN  21  -3.504  -7.118   7.163
  147    HB3  ASN  21           HB1      ASN  21  -4.787  -8.218   7.674
  148   HD21  ASN  21          HD21      ASN  21  -1.480  -7.620   8.018
  149   HD22  ASN  21          HD22      ASN  21  -0.996  -9.159   8.546
  150    H1   PHE   1           HT1      PHE   1  11.986   2.457  -0.905
  151    H2   PHE   1           HT2      PHE   1  11.004   1.156  -0.422
  152    H3   PHE   1           HT3      PHE   1  11.250   2.473   0.623
  153    HA   PHE   1           HA       PHE   1   9.530   2.260  -1.738
  154    HB2  PHE   1           HB2      PHE   1   9.009   2.325   0.904
  155    HB3  PHE   1           HB1      PHE   1   9.020   4.058   0.580
  156    HD1  PHE   1           HD1      PHE   1   7.684   0.878  -0.919
  157    HD2  PHE   1           HD2      PHE   1   7.043   5.057  -0.146
  158    HE1  PHE   1           HE1      PHE   1   5.421   0.719  -1.922
  159    HE2  PHE   1           HE2      PHE   1   4.781   4.896  -1.147
  160    HZ   PHE   1           HZ       PHE   1   3.969   2.726  -2.035
  161    H    VAL   2           H        VAL   2   8.842   4.239  -2.797
  162    HA   VAL   2           HA       VAL   2  11.040   6.206  -2.988
  163    HB   VAL   2           HB       VAL   2   9.520   7.119  -4.866
  164   HG11  VAL   2          HG11      VAL   2  11.499   5.244  -4.840
  165   HG12  VAL   2          HG12      VAL   2  10.719   5.825  -6.311
  166   HG13  VAL   2          HG13      VAL   2  10.183   4.321  -5.563
  167   HG21  VAL   2          HG21      VAL   2   7.574   5.688  -3.807
  168   HG22  VAL   2          HG22      VAL   2   8.273   4.389  -4.774
  169   HG23  VAL   2          HG23      VAL   2   7.686   5.856  -5.559
  170    H    ASN   3           H        ASN   3  10.013   8.577  -3.440
  171    HA   ASN   3           HA       ASN   3   8.196   9.095  -1.118
  172    HB2  ASN   3           HB2      ASN   3  10.701  10.373  -2.026
  173    HB3  ASN   3           HB1      ASN   3   9.414  11.501  -1.603
  174   HD21  ASN   3          HD21      ASN   3  11.302  11.799   0.184
  175   HD22  ASN   3          HD22      ASN   3  11.056  10.910   1.609
  176    H    GLN   4           H        GLN   4   6.393   8.785  -2.668
  177    HA   GLN   4           HA       GLN   4   5.650  11.331  -3.899
  178    HB2  GLN   4           HB2      GLN   4   5.077   9.929  -6.080
  179    HB3  GLN   4           HB1      GLN   4   6.669  10.651  -5.863
  180    HG2  GLN   4           HG2      GLN   4   7.631   8.586  -5.176
  181    HG3  GLN   4           HG1      GLN   4   6.049   7.844  -4.938
  182   HE21  GLN   4          HE21      GLN   4   4.765   7.354  -6.922
  183   HE22  GLN   4          HE22      GLN   4   5.555   7.151  -8.411
  184    H    HIS   5           H        HIS   5   3.390  11.436  -4.301
  185    HA   HIS   5           HA       HIS   5   1.780   9.680  -2.668
  186    HB2  HIS   5           HB2      HIS   5   0.724  11.512  -4.825
  187    HB3  HIS   5           HB1      HIS   5  -0.067  11.025  -3.327
  188    HD2  HIS   5           HD2      HIS   5   2.610  13.598  -4.560
  189    HE1  HIS   5           HE1      HIS   5   1.932  14.254  -0.438
  190    HE2  HIS   5           HE2      HIS   5   3.085  15.153  -2.528
  191    H    LEU   6           H        LEU   6   0.442   7.982  -3.317
  192    HA   LEU   6           HA       LEU   6   0.267   7.362  -6.196
  193    HB2  LEU   6           HB2      LEU   6   0.971   5.009  -5.834
  194    HB3  LEU   6           HB1      LEU   6   2.270   6.150  -5.532
  195    HG   LEU   6           HG       LEU   6   2.279   4.434  -3.810
  196   HD11  LEU   6          HD11      LEU   6   2.646   5.840  -2.060
  197   HD12  LEU   6          HD12      LEU   6   1.084   6.638  -2.232
  198   HD13  LEU   6          HD13      LEU   6   2.424   7.079  -3.293
  199   HD21  LEU   6          HD21      LEU   6  -0.286   5.213  -2.585
  200   HD22  LEU   6          HD22      LEU   6   0.441   3.619  -2.770
  201   HD23  LEU   6          HD23      LEU   6  -0.433   4.348  -4.116
  202    H    CYS   7           H        CYS   7  -1.512   5.973  -6.704
  203    HA   CYS   7           HA       CYS   7  -3.249   5.061  -4.503
  204    HB2  CYS   7           HB2      CYS   7  -4.148   7.170  -6.490
  205    HB3  CYS   7           HB1      CYS   7  -5.210   6.330  -5.361
  206    H    GLY   8           H        GLY   8  -5.246   3.965  -5.467
  207    HA2  GLY   8           HA2      GLY   8  -6.114   2.298  -6.860
  208    HA3  GLY   8           HA1      GLY   8  -5.513   3.286  -8.187
  209    H    SER   9           H        SER   9  -4.517   1.871  -9.517
  210    HA   SER   9           HA       SER   9  -3.274  -0.558  -8.835
  211    HB2  SER   9           HB2      SER   9  -3.321   1.226 -11.172
  212    HB3  SER   9           HB1      SER   9  -1.851   0.265 -11.042
  213    HG   SER   9           HG       SER   9  -2.995  -1.367 -11.678
  214    H    ASP  10           H        ASP  10  -2.160   2.647  -8.316
  215    HA   ASP  10           HA       ASP  10   0.670   1.931  -8.267
  216    HB2  ASP  10           HB2      ASP  10  -0.605   4.355  -6.983
  217    HB3  ASP  10           HB1      ASP  10   1.064   4.179  -7.522
  218    H    LEU  11           H        LEU  11  -1.957   2.120  -5.966
  219    HA   LEU  11           HA       LEU  11  -0.359   1.918  -3.589
  220    HB2  LEU  11           HB2      LEU  11  -3.144   0.810  -4.040
  221    HB3  LEU  11           HB1      LEU  11  -2.402   1.178  -2.483
  222    HG   LEU  11           HG       LEU  11  -2.639   3.320  -4.574
  223   HD11  LEU  11          HD11      LEU  11  -4.787   2.378  -2.655
  224   HD12  LEU  11          HD12      LEU  11  -4.897   2.473  -4.412
  225   HD13  LEU  11          HD13      LEU  11  -4.813   3.951  -3.453
  226   HD21  LEU  11          HD21      LEU  11  -2.148   4.728  -2.830
  227   HD22  LEU  11          HD22      LEU  11  -1.432   3.267  -2.151
  228   HD23  LEU  11          HD23      LEU  11  -3.050   3.765  -1.664
  229    H    VAL  12           H        VAL  12  -1.430  -0.363  -5.991
  230    HA   VAL  12           HA       VAL  12  -0.549  -2.649  -4.357
  231    HB   VAL  12           HB       VAL  12  -0.986  -3.952  -6.498
  232   HG11  VAL  12          HG11      VAL  12  -3.184  -2.369  -5.152
  233   HG12  VAL  12          HG12      VAL  12  -2.585  -3.964  -4.696
  234   HG13  VAL  12          HG13      VAL  12  -3.477  -3.755  -6.202
  235   HG21  VAL  12          HG21      VAL  12  -2.234  -1.314  -7.320
  236   HG22  VAL  12          HG22      VAL  12  -2.376  -2.840  -8.190
  237   HG23  VAL  12          HG23      VAL  12  -0.808  -2.049  -8.054
  238    H    GLU  13           H        GLU  13   0.510  -0.946  -7.338
  239    HA   GLU  13           HA       GLU  13   2.720  -2.482  -8.012
  240    HB2  GLU  13           HB2      GLU  13   2.316  -0.529  -9.326
  241    HB3  GLU  13           HB1      GLU  13   2.393   0.524  -7.913
  242    HG2  GLU  13           HG2      GLU  13   4.633   0.720  -8.077
  243    HG3  GLU  13           HG1      GLU  13   4.838  -1.026  -8.219
  244    H    ALA  14           H        ALA  14   2.272  -0.262  -5.386
  245    HA   ALA  14           HA       ALA  14   4.944  -0.430  -4.294
  246    HB1  ALA  14           HB1      ALA  14   3.802   1.483  -3.598
  247    HB2  ALA  14           HB2      ALA  14   3.581   0.423  -2.205
  248    HB3  ALA  14           HB3      ALA  14   2.284   0.611  -3.385
  249    H    LEU  15           H        LEU  15   1.843  -1.950  -3.522
  250    HA   LEU  15           HA       LEU  15   3.014  -3.615  -1.438
  251    HB2  LEU  15           HB2      LEU  15   0.324  -3.321  -2.707
  252    HB3  LEU  15           HB1      LEU  15   0.676  -4.818  -1.843
  253    HG   LEU  15           HG       LEU  15   1.479  -2.347  -0.433
  254   HD11  LEU  15          HD11      LEU  15  -1.189  -2.518   0.272
  255   HD12  LEU  15          HD12      LEU  15  -1.239  -2.719  -1.479
  256   HD13  LEU  15          HD13      LEU  15  -0.492  -1.283  -0.777
  257   HD21  LEU  15          HD21      LEU  15   0.441  -5.068   0.118
  258   HD22  LEU  15          HD22      LEU  15  -0.063  -3.819   1.256
  259   HD23  LEU  15          HD23      LEU  15   1.653  -4.130   0.990
  260    H    TYR  16           H        TYR  16   1.393  -4.390  -4.458
  261    HA   TYR  16           HA       TYR  16   1.745  -6.954  -5.000
  262    HB2  TYR  16           HB2      TYR  16   1.050  -5.875  -6.896
  263    HB3  TYR  16           HB1      TYR  16   2.167  -4.536  -6.670
  264    HD1  TYR  16           HD1      TYR  16   2.652  -8.239  -7.036
  265    HD2  TYR  16           HD2      TYR  16   3.544  -4.310  -8.528
  266    HE1  TYR  16           HE1      TYR  16   4.182  -9.229  -8.723
  267    HE2  TYR  16           HE2      TYR  16   5.075  -5.298 -10.215
  268    HH   TYR  16           HH       TYR  16   6.352  -8.210 -10.056
  269    H    LEU  17           H        LEU  17   4.576  -4.720  -5.022
  270    HA   LEU  17           HA       LEU  17   6.269  -7.130  -5.444
  271    HB2  LEU  17           HB2      LEU  17   8.066  -5.078  -5.306
  272    HB3  LEU  17           HB1      LEU  17   7.326  -5.670  -6.787
  273    HG   LEU  17           HG       LEU  17   5.468  -4.009  -6.424
  274   HD11  LEU  17          HD11      LEU  17   5.713  -3.629  -4.058
  275   HD12  LEU  17          HD12      LEU  17   6.083  -2.109  -4.867
  276   HD13  LEU  17          HD13      LEU  17   7.387  -3.124  -4.257
  277   HD21  LEU  17          HD21      LEU  17   8.281  -3.445  -7.108
  278   HD22  LEU  17          HD22      LEU  17   7.327  -2.015  -6.716
  279   HD23  LEU  17          HD23      LEU  17   6.810  -3.090  -8.014
  280    H    VAL  18           H        VAL  18   5.376  -4.980  -2.838
  281    HA   VAL  18           HA       VAL  18   7.733  -5.713  -1.253
  282    HB   VAL  18           HB       VAL  18   6.766  -4.456   0.540
  283   HG11  VAL  18          HG11      VAL  18   6.522  -3.347  -2.217
  284   HG12  VAL  18          HG12      VAL  18   7.610  -2.877  -0.916
  285   HG13  VAL  18          HG13      VAL  18   5.919  -2.375  -0.875
  286   HG21  VAL  18          HG21      VAL  18   4.381  -3.462   0.026
  287   HG22  VAL  18          HG22      VAL  18   4.535  -5.069   0.735
  288   HG23  VAL  18          HG23      VAL  18   4.235  -4.891  -0.990
  289    H    CYS  19           H        CYS  19   4.348  -6.657  -1.400
  290    HA   CYS  19           HA       CYS  19   4.770  -8.678   0.717
  291    HB2  CYS  19           HB2      CYS  19   2.438  -7.408  -0.579
  292    HB3  CYS  19           HB1      CYS  19   2.236  -9.123  -0.227
  293    H    GLY  20           H        GLY  20   4.124  -8.481  -2.764
  294    HA2  GLY  20           HA2      GLY  20   4.324 -10.107  -4.443
  295    HA3  GLY  20           HA1      GLY  20   5.495 -10.888  -3.379
  296    H    GLU  21           H        GLU  21   4.922 -12.863  -2.603
  297    HA   GLU  21           HA       GLU  21   2.150 -13.788  -3.040
  298    HB2  GLU  21           HB2      GLU  21   4.496 -15.067  -3.401
  299    HB3  GLU  21           HB1      GLU  21   4.159 -15.557  -1.740
  300    HG2  GLU  21           HG2      GLU  21   2.278 -16.752  -2.326
  301    HG3  GLU  21           HG1      GLU  21   1.914 -15.707  -3.699
  302    H    ARG  22           H        ARG  22   2.950 -11.824  -0.876
  303    HA   ARG  22           HA       ARG  22   2.502 -13.352   1.603
  304    HB2  ARG  22           HB2      ARG  22   3.957 -11.166   1.212
  305    HB3  ARG  22           HB1      ARG  22   2.413 -10.359   1.496
  306    HG2  ARG  22           HG2      ARG  22   2.351 -10.960   3.700
  307    HG3  ARG  22           HG1      ARG  22   3.097 -12.530   3.397
  308    HD2  ARG  22           HD2      ARG  22   4.774 -10.089   2.999
  309    HD3  ARG  22           HD1      ARG  22   4.426 -10.588   4.653
  310    HE   ARG  22           HE       ARG  22   5.263 -12.920   3.388
  311   HH11  ARG  22          HH21      ARG  22   6.633 -10.890   5.443
  312   HH12  ARG  22          HH22      ARG  22   8.223 -10.865   4.757
  313   HH21  ARG  22          HH11      ARG  22   7.257 -12.402   1.801
  314   HH22  ARG  22          HH12      ARG  22   8.576 -11.720   2.693
  315    H    GLY  23           H        GLY  23   0.604 -11.898  -0.813
  316    HA2  GLY  23           HA2      GLY  23  -1.846 -12.397  -0.630
  317    HA3  GLY  23           HA1      GLY  23  -1.740 -11.857   1.047
  318    H    ALA  24           H        ALA  24  -3.591 -10.643  -0.599
  319    HA   ALA  24           HA       ALA  24  -2.924  -7.878  -0.345
  320    HB1  ALA  24           HB1      ALA  24  -1.621  -7.689  -2.206
  321    HB2  ALA  24           HB2      ALA  24  -3.167  -7.687  -3.056
  322    HB3  ALA  24           HB3      ALA  24  -2.241  -9.182  -2.910
  323    H    PHE  25           H        PHE  25  -5.121  -9.637   0.242
  324    HA   PHE  25           HA       PHE  25  -7.235  -8.759  -1.639
  325    HB2  PHE  25           HB2      PHE  25  -8.673 -10.328  -0.242
  326    HB3  PHE  25           HB1      PHE  25  -7.365 -11.102  -1.136
  327    HD1  PHE  25           HD2      PHE  25  -5.377 -11.955   0.008
  328    HD2  PHE  25           HD1      PHE  25  -8.564 -10.070   2.191
  329    HE1  PHE  25           HE2      PHE  25  -4.441 -12.832   2.132
  330    HE2  PHE  25           HE1      PHE  25  -7.628 -10.947   4.314
  331    HZ   PHE  25           HZ       PHE  25  -5.567 -12.328   4.286
  332    H    TYR  26           H        TYR  26  -6.272  -6.629  -0.259
  333    HA   TYR  26           HA       TYR  26  -7.455  -6.134   2.293
  334    HB2  TYR  26           HB2      TYR  26  -6.924  -3.816   1.913
  335    HB3  TYR  26           HB1      TYR  26  -5.627  -4.772   1.199
  336    HD1  TYR  26           HD2      TYR  26  -5.543  -5.132  -1.271
  337    HD2  TYR  26           HD1      TYR  26  -8.401  -2.492   0.554
  338    HE1  TYR  26           HE2      TYR  26  -5.990  -4.088  -3.478
  339    HE2  TYR  26           HE1      TYR  26  -8.847  -1.448  -1.651
  340    HH   TYR  26           HH       TYR  26  -8.414  -2.602  -4.351
  341    H    THR  27           H        THR  27  -8.870  -6.417  -0.791
  342    HA   THR  27           HA       THR  27 -11.270  -4.872   0.092
  343    HB   THR  27           HB       THR  27 -10.411  -4.129  -2.058
  344    HG1  THR  27           HG1      THR  27 -12.686  -4.344  -1.820
  345   HG21  THR  27          HG21      THR  27  -9.978  -6.987  -2.407
  346   HG22  THR  27          HG22      THR  27  -9.249  -5.632  -3.270
  347   HG23  THR  27          HG23      THR  27 -10.802  -6.279  -3.796
  348    H    LYS  28           H        LYS  28 -12.109  -6.571   1.434
  349    HA   LYS  28           HA       LYS  28 -12.473  -9.264   0.493
  350    HB2  LYS  28           HB2      LYS  28 -13.127  -7.722   2.863
  351    HB3  LYS  28           HB1      LYS  28 -14.474  -8.763   2.398
  352    HG2  LYS  28           HG2      LYS  28 -13.233 -10.717   2.652
  353    HG3  LYS  28           HG1      LYS  28 -11.693  -9.891   2.403
  354    HD2  LYS  28           HD2      LYS  28 -11.509  -9.300   4.596
  355    HD3  LYS  28           HD1      LYS  28 -13.235  -8.972   4.753
  356    HE2  LYS  28           HE2      LYS  28 -13.701 -11.386   4.852
  357    HE3  LYS  28           HE1      LYS  28 -11.982 -11.732   4.664
  358    HZ1  LYS  28           HZ1      LYS  28 -13.247 -10.260   6.910
  359    HZ2  LYS  28           HZ2      LYS  28 -11.574 -10.474   6.714
  360    HZ3  LYS  28           HZ3      LYS  28 -12.580 -11.817   6.977
  361    HA   PRO  29           HA       PRO  29 -16.914  -7.863  -0.564
  362    HB2  PRO  29           HB2      PRO  29 -17.496  -5.187  -0.324
  363    HB3  PRO  29           HB1      PRO  29 -17.710  -6.357   0.989
  364    HG2  PRO  29           HG2      PRO  29 -15.603  -4.275   0.658
  365    HG3  PRO  29           HG1      PRO  29 -16.228  -5.015   2.142
  366    HD2  PRO  29           HD2      PRO  29 -13.786  -5.662   0.858
  367    HD3  PRO  29           HD1      PRO  29 -14.567  -6.593   2.152
  368    H    THR  30           H        THR  30 -16.006  -8.290  -2.694
  369    HA   THR  30           HA       THR  30 -15.412  -5.833  -4.293
  370    HB   THR  30           HB       THR  30 -14.057  -7.185  -5.734
  371    HG1  THR  30           HG1      THR  30 -13.955  -9.519  -5.133
  372   HG21  THR  30          HG21      THR  30 -12.641  -8.478  -3.911
  373   HG22  THR  30          HG22      THR  30 -13.701  -7.619  -2.794
  374   HG23  THR  30          HG23      THR  30 -12.690  -6.715  -3.922
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1 -10.373   3.016   2.146
    2    H2   GLY   1           HT2      GLY   1  -9.107   3.707   1.250
    3    H3   GLY   1           HT3      GLY   1 -10.546   4.575   1.496
    4    HA2  GLY   1           HA1      GLY   1  -8.715   5.258   3.010
    5    HA3  GLY   1           HA2      GLY   1 -10.202   4.784   3.885
    6    H    ILE   2           H        ILE   2  -8.086   2.394   2.512
    7    HA   ILE   2           HA       ILE   2  -6.463   2.088   4.886
    8    HB   ILE   2           HB       ILE   2  -7.088   0.158   3.498
    9   HG12  ILE   2          HG12      ILE   2  -4.978  -0.951   3.526
   10   HG13  ILE   2          HG11      ILE   2  -4.101   0.550   3.233
   11   HG21  ILE   2          HG21      ILE   2  -7.176   0.847   1.285
   12   HG22  ILE   2          HG22      ILE   2  -5.614   0.027   1.294
   13   HG23  ILE   2          HG23      ILE   2  -5.689   1.785   1.408
   14   HD11  ILE   2          HD11      ILE   2  -4.238   1.222   5.426
   15   HD12  ILE   2          HD12      ILE   2  -4.343  -0.517   5.693
   16   HD13  ILE   2          HD13      ILE   2  -5.810   0.460   5.668
   17    H    VAL   3           H        VAL   3  -6.035   3.691   1.802
   18    HA   VAL   3           HA       VAL   3  -3.182   4.239   2.464
   19    HB   VAL   3           HB       VAL   3  -3.047   5.089   0.132
   20   HG11  VAL   3          HG11      VAL   3  -2.478   2.959  -0.280
   21   HG12  VAL   3          HG12      VAL   3  -4.172   2.604  -0.621
   22   HG13  VAL   3          HG13      VAL   3  -3.538   2.400   1.012
   23   HG21  VAL   3          HG21      VAL   3  -5.941   4.172   0.019
   24   HG22  VAL   3          HG22      VAL   3  -4.983   4.685  -1.369
   25   HG23  VAL   3          HG23      VAL   3  -5.383   5.840  -0.097
   26    H    GLU   4           H        GLU   4  -5.773   5.468   3.564
   27    HA   GLU   4           HA       GLU   4  -6.308   8.051   2.823
   28    HB2  GLU   4           HB2      GLU   4  -6.735   8.583   5.157
   29    HB3  GLU   4           HB1      GLU   4  -7.226   6.917   4.857
   30    HG2  GLU   4           HG2      GLU   4  -5.163   6.075   5.824
   31    HG3  GLU   4           HG1      GLU   4  -4.529   7.713   5.989
   32    H    GLN   5           H        GLN   5  -3.235   6.904   4.062
   33    HA   GLN   5           HA       GLN   5  -2.291   9.708   4.295
   34    HB2  GLN   5           HB2      GLN   5  -0.144   8.015   4.922
   35    HB3  GLN   5           HB1      GLN   5  -1.164   8.884   6.064
   36    HG2  GLN   5           HG2      GLN   5  -2.784   6.895   5.878
   37    HG3  GLN   5           HG1      GLN   5  -1.457   6.037   5.095
   38   HE21  GLN   5          HE21      GLN   5  -0.148   4.894   6.523
   39   HE22  GLN   5          HE22      GLN   5   0.068   5.270   8.164
   40    H    CYS   6           H        CYS   6  -0.472   6.832   3.205
   41    HA   CYS   6           HA       CYS   6   1.280   8.038   1.489
   42    HB2  CYS   6           HB2      CYS   6  -0.001   5.388   1.509
   43    HB3  CYS   6           HB1      CYS   6   0.633   5.884  -0.058
   44    H    CYS   7           H        CYS   7  -2.097   7.261   0.633
   45    HA   CYS   7           HA       CYS   7  -1.920   8.152  -2.063
   46    HB2  CYS   7           HB2      CYS   7  -4.045   7.469  -0.192
   47    HB3  CYS   7           HB1      CYS   7  -4.500   8.752  -1.300
   48    H    THR   8           H        THR   8  -2.446   9.928   0.953
   49    HA   THR   8           HA       THR   8  -2.751  12.441  -0.616
   50    HB   THR   8           HB       THR   8  -4.352  11.860   1.276
   51    HG1  THR   8           HG1      THR   8  -2.807  14.209   1.175
   52   HG21  THR   8          HG21      THR   8  -2.685  10.920   2.817
   53   HG22  THR   8          HG22      THR   8  -3.518  12.284   3.564
   54   HG23  THR   8          HG23      THR   8  -1.888  12.490   2.925
   55    H    SER   9           H        SER   9  -0.547  10.758   1.518
   56    HA   SER   9           HA       SER   9   1.430  12.933   1.062
   57    HB2  SER   9           HB2      SER   9   2.050  12.143   3.612
   58    HB3  SER   9           HB1      SER   9   1.135  13.588   3.209
   59    HG   SER   9           HG       SER   9  -0.136  11.083   3.436
   60    H    ILE  10           H        ILE  10   3.511  11.820   2.565
   61    HA   ILE  10           HA       ILE  10   4.031   9.346   0.992
   62    HB   ILE  10           HB       ILE  10   6.176  10.725   2.555
   63   HG12  ILE  10          HG12      ILE  10   4.781  12.524   1.416
   64   HG13  ILE  10          HG11      ILE  10   6.463  12.451   0.899
   65   HG21  ILE  10          HG21      ILE  10   7.048   8.943   1.360
   66   HG22  ILE  10          HG22      ILE  10   7.233  10.227   0.166
   67   HG23  ILE  10          HG23      ILE  10   5.874   9.108   0.055
   68   HD11  ILE  10          HD11      ILE  10   4.946  12.651  -1.041
   69   HD12  ILE  10          HD12      ILE  10   4.131  11.167  -0.550
   70   HD13  ILE  10          HD13      ILE  10   5.816  11.117  -1.067
   71    H    CYS  11           H        CYS  11   2.835   7.961   2.479
   72    HA   CYS  11           HA       CYS  11   3.614   7.844   5.280
   73    HB2  CYS  11           HB2      CYS  11   1.973   6.195   5.523
   74    HB3  CYS  11           HB1      CYS  11   1.347   7.138   4.176
   75    H    SER  12           H        SER  12   3.942   5.141   5.798
   76    HA   SER  12           HA       SER  12   6.662   4.713   4.700
   77    HB2  SER  12           HB2      SER  12   6.240   2.686   6.483
   78    HB3  SER  12           HB1      SER  12   6.928   4.250   6.907
   79    HG   SER  12           HG       SER  12   5.161   3.768   8.240
   80    H    LEU  13           H        LEU  13   6.911   3.353   2.990
   81    HA   LEU  13           HA       LEU  13   4.782   1.827   1.889
   82    HB2  LEU  13           HB2      LEU  13   6.532   0.721   0.512
   83    HB3  LEU  13           HB1      LEU  13   6.695   2.476   0.520
   84    HG   LEU  13           HG       LEU  13   8.174   0.972   2.625
   85   HD11  LEU  13          HD11      LEU  13  10.016   0.464   1.085
   86   HD12  LEU  13          HD12      LEU  13   9.076   1.090  -0.269
   87   HD13  LEU  13          HD13      LEU  13   8.550  -0.370   0.569
   88   HD21  LEU  13          HD21      LEU  13   8.111   3.585   1.475
   89   HD22  LEU  13          HD22      LEU  13   9.698   2.889   1.136
   90   HD23  LEU  13          HD23      LEU  13   9.124   3.008   2.800
   91    H    TYR  14           H        TYR  14   7.264   0.981   4.231
   92    HA   TYR  14           HA       TYR  14   6.723  -1.847   4.184
   93    HB2  TYR  14           HB2      TYR  14   7.636  -1.660   6.649
   94    HB3  TYR  14           HB1      TYR  14   8.730  -1.420   5.290
   95    HD1  TYR  14           HD2      TYR  14   9.551   0.815   4.705
   96    HD2  TYR  14           HD1      TYR  14   6.901   0.211   8.036
   97    HE1  TYR  14           HE2      TYR  14  10.102   3.080   5.556
   98    HE2  TYR  14           HE1      TYR  14   7.459   2.473   8.889
   99    HH   TYR  14           HH       TYR  14   9.654   4.627   7.085
  100    H    GLN  15           H        GLN  15   5.139   0.900   5.508
  101    HA   GLN  15           HA       GLN  15   3.511  -0.563   7.414
  102    HB2  GLN  15           HB2      GLN  15   2.738   1.508   8.005
  103    HB3  GLN  15           HB1      GLN  15   4.132   2.062   7.096
  104    HG2  GLN  15           HG2      GLN  15   2.489   3.328   6.078
  105    HG3  GLN  15           HG1      GLN  15   2.422   1.889   5.059
  106   HE21  GLN  15          HE21      GLN  15   0.769   3.595   7.705
  107   HE22  GLN  15          HE22      GLN  15  -0.677   2.712   7.598
  108    H    LEU  16           H        LEU  16   3.453   0.132   4.028
  109    HA   LEU  16           HA       LEU  16   0.643  -0.349   3.582
  110    HB2  LEU  16           HB2      LEU  16   3.089  -0.273   1.833
  111    HB3  LEU  16           HB1      LEU  16   1.569  -0.896   1.185
  112    HG   LEU  16           HG       LEU  16   0.478   1.236   2.027
  113   HD11  LEU  16          HD11      LEU  16   2.629   2.985   1.992
  114   HD12  LEU  16          HD12      LEU  16   3.221   1.620   2.937
  115   HD13  LEU  16          HD13      LEU  16   1.750   2.459   3.427
  116   HD21  LEU  16          HD21      LEU  16   2.309   0.869  -0.242
  117   HD22  LEU  16          HD22      LEU  16   2.047   2.562   0.178
  118   HD23  LEU  16          HD23      LEU  16   0.674   1.529  -0.217
  119    H    GLU  17           H        GLU  17   3.483  -2.376   3.896
  120    HA   GLU  17           HA       GLU  17   2.491  -4.773   2.752
  121    HB2  GLU  17           HB2      GLU  17   4.165  -5.880   3.978
  122    HB3  GLU  17           HB1      GLU  17   4.803  -4.243   3.855
  123    HG2  GLU  17           HG2      GLU  17   3.656  -3.797   6.107
  124    HG3  GLU  17           HG1      GLU  17   3.462  -5.546   6.227
  125    H    ASN  18           H        ASN  18   1.632  -3.034   5.581
  126    HA   ASN  18           HA       ASN  18   0.389  -5.048   7.158
  127    HB2  ASN  18           HB2      ASN  18   0.820  -2.723   7.931
  128    HB3  ASN  18           HB1      ASN  18  -0.439  -2.146   6.839
  129   HD21  ASN  18          HD21      ASN  18  -0.486  -5.122   8.847
  130   HD22  ASN  18          HD22      ASN  18  -1.845  -4.670   9.759
  131    H    TYR  19           H        TYR  19  -0.494  -3.800   4.108
  132    HA   TYR  19           HA       TYR  19  -3.361  -4.368   4.424
  133    HB2  TYR  19           HB2      TYR  19  -1.937  -3.796   1.825
  134    HB3  TYR  19           HB1      TYR  19  -3.626  -3.501   2.231
  135    HD1  TYR  19           HD2      TYR  19  -2.544  -2.522   5.167
  136    HD2  TYR  19           HD1      TYR  19  -1.899  -1.369   1.076
  137    HE1  TYR  19           HE2      TYR  19  -1.965  -0.225   5.906
  138    HE2  TYR  19           HE1      TYR  19  -1.326   0.927   1.817
  139    HH   TYR  19           HH       TYR  19  -1.402   1.822   5.270
  140    H    CYS  20           H        CYS  20  -0.533  -6.098   3.647
  141    HA   CYS  20           HA       CYS  20  -1.599  -7.977   1.752
  142    HB2  CYS  20           HB2      CYS  20   0.579  -8.438   3.807
  143    HB3  CYS  20           HB1      CYS  20   0.315  -9.367   2.334
  144    H    ASN  21           H        ASN  21  -2.241  -7.465   5.052
  145    HA   ASN  21           HA       ASN  21  -2.899 -10.240   5.702
  146    HB2  ASN  21           HB2      ASN  21  -3.546  -7.645   7.127
  147    HB3  ASN  21           HB1      ASN  21  -3.839  -9.255   7.782
  148   HD21  ASN  21          HD21      ASN  21  -2.280  -8.763   9.547
  149   HD22  ASN  21          HD22      ASN  21  -0.611  -8.813   9.245
  150    H1   PHE   1           HT1      PHE   1  10.239   0.559  -5.210
  151    H2   PHE   1           HT2      PHE   1  11.316   0.785  -3.915
  152    H3   PHE   1           HT3      PHE   1  11.305   1.878  -5.216
  153    HA   PHE   1           HA       PHE   1   8.813   2.177  -4.529
  154    HB2  PHE   1           HB2      PHE   1   9.513   0.367  -2.650
  155    HB3  PHE   1           HB1      PHE   1   9.929   1.852  -1.792
  156    HD1  PHE   1           HD2      PHE   1   7.980   3.794  -2.642
  157    HD2  PHE   1           HD1      PHE   1   7.443  -0.400  -1.875
  158    HE1  PHE   1           HE2      PHE   1   5.581   4.191  -2.156
  159    HE2  PHE   1           HE1      PHE   1   5.042  -0.003  -1.389
  160    HZ   PHE   1           HZ       PHE   1   4.111   2.292  -1.529
  161    H    VAL   2           H        VAL   2   8.978   4.336  -4.898
  162    HA   VAL   2           HA       VAL   2  11.244   5.830  -3.692
  163    HB   VAL   2           HB       VAL   2  10.301   7.700  -5.185
  164   HG11  VAL   2          HG11      VAL   2  11.005   5.451  -6.978
  165   HG12  VAL   2          HG12      VAL   2  12.128   5.729  -5.647
  166   HG13  VAL   2          HG13      VAL   2  11.778   7.025  -6.791
  167   HG21  VAL   2          HG21      VAL   2   8.719   7.122  -6.852
  168   HG22  VAL   2          HG22      VAL   2   8.072   6.400  -5.378
  169   HG23  VAL   2          HG23      VAL   2   8.915   5.394  -6.558
  170    H    ASN   3           H        ASN   3  10.576   8.147  -2.947
  171    HA   ASN   3           HA       ASN   3   8.295   7.813  -1.071
  172    HB2  ASN   3           HB2      ASN   3  10.602   9.772  -1.180
  173    HB3  ASN   3           HB1      ASN   3   9.275   9.911  -0.027
  174   HD21  ASN   3          HD21      ASN   3  12.319   8.440  -0.545
  175   HD22  ASN   3          HD22      ASN   3  12.247   7.304   0.714
  176    H    GLN   4           H        GLN   4   6.504   8.288  -2.407
  177    HA   GLN   4           HA       GLN   4   6.065  11.125  -2.932
  178    HB2  GLN   4           HB2      GLN   4   5.461  10.612  -5.378
  179    HB3  GLN   4           HB1      GLN   4   7.181  10.694  -4.992
  180    HG2  GLN   4           HG2      GLN   4   7.501   8.462  -5.344
  181    HG3  GLN   4           HG1      GLN   4   5.936   8.029  -4.653
  182   HE21  GLN   4          HE21      GLN   4   4.114   9.367  -6.232
  183   HE22  GLN   4          HE22      GLN   4   4.260   8.891  -7.855
  184    H    HIS   5           H        HIS   5   3.796  11.277  -4.109
  185    HA   HIS   5           HA       HIS   5   1.950   9.682  -2.499
  186    HB2  HIS   5           HB2      HIS   5   1.154  11.532  -4.744
  187    HB3  HIS   5           HB1      HIS   5   0.259  11.140  -3.276
  188    HD2  HIS   5           HD2      HIS   5   3.186  13.481  -4.422
  189    HE1  HIS   5           HE1      HIS   5   2.267  14.358  -0.389
  190    HE2  HIS   5           HE2      HIS   5   3.624  15.087  -2.422
  191    H    LEU   6           H        LEU   6   0.673   7.991  -3.233
  192    HA   LEU   6           HA       LEU   6   0.589   7.414  -6.119
  193    HB2  LEU   6           HB2      LEU   6   1.307   5.057  -5.776
  194    HB3  LEU   6           HB1      LEU   6   2.588   6.214  -5.450
  195    HG   LEU   6           HG       LEU   6   2.596   4.474  -3.749
  196   HD11  LEU   6          HD11      LEU   6   2.730   7.110  -3.204
  197   HD12  LEU   6          HD12      LEU   6   2.939   5.861  -1.977
  198   HD13  LEU   6          HD13      LEU   6   1.378   6.660  -2.162
  199   HD21  LEU   6          HD21      LEU   6   0.761   3.639  -2.723
  200   HD22  LEU   6          HD22      LEU   6  -0.111   4.372  -4.068
  201   HD23  LEU   6          HD23      LEU   6   0.023   5.227  -2.529
  202    H    CYS   7           H        CYS   7  -1.170   6.041  -6.703
  203    HA   CYS   7           HA       CYS   7  -2.929   4.981  -4.597
  204    HB2  CYS   7           HB2      CYS   7  -3.851   7.214  -6.428
  205    HB3  CYS   7           HB1      CYS   7  -4.905   6.270  -5.379
  206    H    GLY   8           H        GLY   8  -4.910   3.944  -5.648
  207    HA2  GLY   8           HA2      GLY   8  -5.818   2.460  -7.213
  208    HA3  GLY   8           HA1      GLY   8  -5.070   3.467  -8.447
  209    H    SER   9           H        SER   9  -4.116   1.995  -9.776
  210    HA   SER   9           HA       SER   9  -3.032  -0.503  -9.096
  211    HB2  SER   9           HB2      SER   9  -1.843  -0.407 -11.220
  212    HB3  SER   9           HB1      SER   9  -3.439   0.308 -11.426
  213    HG   SER   9           HG       SER   9  -1.144   1.413 -11.965
  214    H    ASP  10           H        ASP  10  -1.788   2.643  -8.473
  215    HA   ASP  10           HA       ASP  10   0.989   1.803  -8.219
  216    HB2  ASP  10           HB2      ASP  10  -0.322   4.247  -7.003
  217    HB3  ASP  10           HB1      ASP  10   1.396   4.013  -7.323
  218    H    LEU  11           H        LEU  11  -1.808   1.964  -6.142
  219    HA   LEU  11           HA       LEU  11  -0.394   1.672  -3.651
  220    HB2  LEU  11           HB2      LEU  11  -3.189   0.715  -4.341
  221    HB3  LEU  11           HB1      LEU  11  -2.547   0.976  -2.719
  222    HG   LEU  11           HG       LEU  11  -2.711   3.155  -4.815
  223   HD11  LEU  11          HD11      LEU  11  -4.717   3.931  -3.779
  224   HD12  LEU  11          HD12      LEU  11  -4.549   2.793  -2.442
  225   HD13  LEU  11          HD13      LEU  11  -4.961   2.206  -4.053
  226   HD21  LEU  11          HD21      LEU  11  -1.782   4.510  -3.245
  227   HD22  LEU  11          HD22      LEU  11  -1.218   3.011  -2.515
  228   HD23  LEU  11          HD23      LEU  11  -2.697   3.777  -1.934
  229    H    VAL  12           H        VAL  12  -1.347  -0.506  -6.192
  230    HA   VAL  12           HA       VAL  12  -0.603  -2.852  -4.558
  231    HB   VAL  12           HB       VAL  12  -0.959  -4.103  -6.756
  232   HG11  VAL  12          HG11      VAL  12  -2.620  -4.142  -5.001
  233   HG12  VAL  12          HG12      VAL  12  -3.448  -3.929  -6.543
  234   HG13  VAL  12          HG13      VAL  12  -3.215  -2.550  -5.470
  235   HG21  VAL  12          HG21      VAL  12  -2.290  -2.932  -8.461
  236   HG22  VAL  12          HG22      VAL  12  -0.718  -2.166  -8.253
  237   HG23  VAL  12          HG23      VAL  12  -2.157  -1.432  -7.545
  238    H    GLU  13           H        GLU  13   0.573  -1.082  -7.449
  239    HA   GLU  13           HA       GLU  13   2.810  -2.571  -8.108
  240    HB2  GLU  13           HB2      GLU  13   2.464  -0.542  -9.324
  241    HB3  GLU  13           HB1      GLU  13   2.489   0.426  -7.849
  242    HG2  GLU  13           HG2      GLU  13   4.725   0.650  -7.959
  243    HG3  GLU  13           HG1      GLU  13   4.939  -1.096  -8.095
  244    H    ALA  14           H        ALA  14   2.255  -0.522  -5.367
  245    HA   ALA  14           HA       ALA  14   4.873  -0.750  -4.173
  246    HB1  ALA  14           HB1      ALA  14   2.177   0.251  -3.387
  247    HB2  ALA  14           HB2      ALA  14   3.742   1.054  -3.271
  248    HB3  ALA  14           HB3      ALA  14   3.287  -0.167  -2.082
  249    H    LEU  15           H        LEU  15   1.744  -2.085  -3.177
  250    HA   LEU  15           HA       LEU  15   2.767  -4.051  -1.398
  251    HB2  LEU  15           HB2      LEU  15   0.201  -3.655  -2.881
  252    HB3  LEU  15           HB1      LEU  15   0.495  -5.230  -2.143
  253    HG   LEU  15           HG       LEU  15   1.075  -2.850  -0.456
  254   HD11  LEU  15          HD11      LEU  15  -0.957  -1.920  -0.828
  255   HD12  LEU  15          HD12      LEU  15  -1.613  -3.308   0.043
  256   HD13  LEU  15          HD13      LEU  15  -1.529  -3.332  -1.719
  257   HD21  LEU  15          HD21      LEU  15  -0.214  -5.568  -0.067
  258   HD22  LEU  15          HD22      LEU  15  -0.052  -4.376   1.222
  259   HD23  LEU  15          HD23      LEU  15   1.388  -5.061   0.468
  260    H    TYR  16           H        TYR  16   1.414  -4.575  -4.588
  261    HA   TYR  16           HA       TYR  16   1.820  -7.063  -5.334
  262    HB2  TYR  16           HB2      TYR  16   1.261  -5.726  -7.129
  263    HB3  TYR  16           HB1      TYR  16   2.497  -4.531  -6.762
  264    HD1  TYR  16           HD1      TYR  16   2.411  -8.193  -7.564
  265    HD2  TYR  16           HD2      TYR  16   4.186  -4.356  -8.328
  266    HE1  TYR  16           HE1      TYR  16   3.916  -9.228  -9.249
  267    HE2  TYR  16           HE2      TYR  16   5.692  -5.389 -10.014
  268    HH   TYR  16           HH       TYR  16   6.567  -8.159 -10.245
  269    H    LEU  17           H        LEU  17   4.682  -4.878  -4.979
  270    HA   LEU  17           HA       LEU  17   6.337  -7.333  -5.346
  271    HB2  LEU  17           HB2      LEU  17   8.181  -5.343  -5.298
  272    HB3  LEU  17           HB1      LEU  17   7.394  -5.926  -6.758
  273    HG   LEU  17           HG       LEU  17   5.601  -4.175  -6.363
  274   HD11  LEU  17          HD11      LEU  17   7.660  -2.933  -4.541
  275   HD12  LEU  17          HD12      LEU  17   6.355  -3.933  -3.911
  276   HD13  LEU  17          HD13      LEU  17   5.984  -2.447  -4.777
  277   HD21  LEU  17          HD21      LEU  17   8.120  -4.001  -7.564
  278   HD22  LEU  17          HD22      LEU  17   7.983  -2.517  -6.621
  279   HD23  LEU  17          HD23      LEU  17   6.761  -2.910  -7.831
  280    H    VAL  18           H        VAL  18   5.385  -5.122  -2.846
  281    HA   VAL  18           HA       VAL  18   7.727  -5.582  -1.185
  282    HB   VAL  18           HB       VAL  18   6.528  -4.513   0.591
  283   HG11  VAL  18          HG11      VAL  18   5.215  -2.735  -1.113
  284   HG12  VAL  18          HG12      VAL  18   6.506  -3.418  -2.103
  285   HG13  VAL  18          HG13      VAL  18   6.891  -2.622  -0.576
  286   HG21  VAL  18          HG21      VAL  18   4.109  -5.250  -1.036
  287   HG22  VAL  18          HG22      VAL  18   4.035  -3.969   0.169
  288   HG23  VAL  18          HG23      VAL  18   4.446  -5.614   0.653
  289    H    CYS  19           H        CYS  19   4.517  -7.005  -1.401
  290    HA   CYS  19           HA       CYS  19   5.288  -9.054   0.608
  291    HB2  CYS  19           HB2      CYS  19   2.692  -8.096  -0.551
  292    HB3  CYS  19           HB1      CYS  19   2.781  -9.731   0.105
  293    H    GLY  20           H        GLY  20   3.698  -8.981  -2.605
  294    HA2  GLY  20           HA2      GLY  20   3.832 -10.493  -4.391
  295    HA3  GLY  20           HA1      GLY  20   5.442 -10.895  -3.792
  296    H    GLU  21           H        GLU  21   2.279 -12.044  -4.190
  297    HA   GLU  21           HA       GLU  21   1.229 -14.040  -3.552
  298    HB2  GLU  21           HB2      GLU  21   3.487 -14.839  -4.501
  299    HB3  GLU  21           HB1      GLU  21   3.977 -15.045  -2.820
  300    HG2  GLU  21           HG2      GLU  21   2.410 -16.732  -2.428
  301    HG3  GLU  21           HG1      GLU  21   1.370 -16.210  -3.754
  302    H    ARG  22           H        ARG  22   2.170 -11.928  -1.444
  303    HA   ARG  22           HA       ARG  22   1.939 -13.712   0.943
  304    HB2  ARG  22           HB2      ARG  22   3.718 -11.616   0.411
  305    HB3  ARG  22           HB1      ARG  22   2.539 -10.921   1.525
  306    HG2  ARG  22           HG2      ARG  22   3.658 -11.948   3.191
  307    HG3  ARG  22           HG1      ARG  22   3.045 -13.474   2.551
  308    HD2  ARG  22           HD2      ARG  22   5.172 -14.061   2.108
  309    HD3  ARG  22           HD1      ARG  22   5.209 -12.786   0.890
  310    HE   ARG  22           HE       ARG  22   5.820 -11.327   3.043
  311   HH11  ARG  22          HH21      ARG  22   6.290 -14.184   4.268
  312   HH12  ARG  22          HH22      ARG  22   8.019 -14.249   4.183
  313   HH21  ARG  22          HH11      ARG  22   8.279 -11.545   2.029
  314   HH22  ARG  22          HH12      ARG  22   9.144 -12.754   2.917
  315    H    GLY  23           H        GLY  23  -0.275 -12.812  -0.818
  316    HA2  GLY  23           HA2      GLY  23  -2.551 -12.402  -0.183
  317    HA3  GLY  23           HA1      GLY  23  -1.975 -11.675   1.319
  318    H    ALA  24           H        ALA  24  -3.776 -10.127   0.260
  319    HA   ALA  24           HA       ALA  24  -2.508  -7.676  -0.344
  320    HB1  ALA  24           HB1      ALA  24  -2.051  -7.780  -2.546
  321    HB2  ALA  24           HB2      ALA  24  -3.758  -8.073  -2.875
  322    HB3  ALA  24           HB3      ALA  24  -2.666  -9.431  -2.607
  323    H    PHE  25           H        PHE  25  -5.384  -9.590  -1.267
  324    HA   PHE  25           HA       PHE  25  -7.284  -7.578  -1.485
  325    HB2  PHE  25           HB2      PHE  25  -8.930  -9.239  -0.540
  326    HB3  PHE  25           HB1      PHE  25  -7.919  -9.889  -1.829
  327    HD1  PHE  25           HD2      PHE  25  -5.959 -11.353  -1.269
  328    HD2  PHE  25           HD1      PHE  25  -8.797 -10.088   1.701
  329    HE1  PHE  25           HE2      PHE  25  -5.156 -13.134   0.259
  330    HE2  PHE  25           HE1      PHE  25  -7.994 -11.868   3.228
  331    HZ   PHE  25           HZ       PHE  25  -6.173 -13.393   2.508
  332    H    TYR  26           H        TYR  26  -6.970  -5.814  -0.101
  333    HA   TYR  26           HA       TYR  26  -7.127  -6.367   2.827
  334    HB2  TYR  26           HB2      TYR  26  -6.329  -3.996   3.053
  335    HB3  TYR  26           HB1      TYR  26  -5.190  -5.044   2.208
  336    HD1  TYR  26           HD1      TYR  26  -8.010  -2.662   1.587
  337    HD2  TYR  26           HD2      TYR  26  -4.423  -4.471   0.062
  338    HE1  TYR  26           HE1      TYR  26  -8.095  -1.163  -0.388
  339    HE2  TYR  26           HE2      TYR  26  -4.507  -2.971  -1.913
  340    HH   TYR  26           HH       TYR  26  -6.706  -0.289  -2.091
  341    H    THR  27           H        THR  27  -9.014  -5.354   0.214
  342    HA   THR  27           HA       THR  27 -10.862  -3.877   2.046
  343    HB   THR  27           HB       THR  27 -10.206  -2.441   0.233
  344    HG1  THR  27           HG1      THR  27 -12.206  -1.928  -0.029
  345   HG21  THR  27          HG21      THR  27  -9.303  -3.634  -1.497
  346   HG22  THR  27          HG22      THR  27 -10.932  -3.480  -2.153
  347   HG23  THR  27          HG23      THR  27 -10.453  -4.958  -1.319
  348    H    LYS  28           H        LYS  28 -12.885  -4.722   2.355
  349    HA   LYS  28           HA       LYS  28 -13.430  -7.391   1.332
  350    HB2  LYS  28           HB2      LYS  28 -15.476  -5.720   2.767
  351    HB3  LYS  28           HB1      LYS  28 -15.208  -7.459   2.845
  352    HG2  LYS  28           HG2      LYS  28 -13.465  -5.286   4.035
  353    HG3  LYS  28           HG1      LYS  28 -14.373  -6.525   4.902
  354    HD2  LYS  28           HD2      LYS  28 -12.968  -8.279   3.995
  355    HD3  LYS  28           HD1      LYS  28 -12.141  -7.130   2.942
  356    HE2  LYS  28           HE2      LYS  28 -10.762  -6.451   4.600
  357    HE3  LYS  28           HE1      LYS  28 -12.091  -6.313   5.752
  358    HZ1  LYS  28           HZ1      LYS  28 -10.447  -8.668   5.093
  359    HZ2  LYS  28           HZ2      LYS  28 -12.010  -8.870   5.728
  360    HZ3  LYS  28           HZ3      LYS  28 -10.831  -8.026   6.615
  361    HA   PRO  29           HA       PRO  29 -16.847  -5.068  -1.066
  362    HB2  PRO  29           HB2      PRO  29 -16.670  -2.329  -1.185
  363    HB3  PRO  29           HB1      PRO  29 -17.581  -3.197   0.063
  364    HG2  PRO  29           HG2      PRO  29 -14.964  -1.792   0.288
  365    HG3  PRO  29           HG1      PRO  29 -16.166  -2.134   1.544
  366    HD2  PRO  29           HD2      PRO  29 -13.748  -3.552   1.104
  367    HD3  PRO  29           HD1      PRO  29 -15.079  -4.051   2.167
  368    H    THR  30           H        THR  30 -15.365  -6.071  -2.666
  369    HA   THR  30           HA       THR  30 -14.318  -4.053  -4.557
  370    HB   THR  30           HB       THR  30 -12.265  -4.429  -3.511
  371    HG1  THR  30           HG1      THR  30 -11.807  -4.975  -5.547
  372   HG21  THR  30          HG21      THR  30 -13.208  -7.278  -3.106
  373   HG22  THR  30          HG22      THR  30 -12.985  -6.045  -1.865
  374   HG23  THR  30          HG23      THR  30 -11.586  -6.716  -2.704
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1 -10.466   2.411   3.650
    2    H2   GLY   1           HT2      GLY   1 -10.194   3.185   2.163
    3    H3   GLY   1           HT3      GLY   1 -11.386   3.771   3.221
    4    HA2  GLY   1           HA1      GLY   1  -8.874   4.707   3.160
    5    HA3  GLY   1           HA2      GLY   1  -9.997   4.960   4.531
    6    H    ILE   2           H        ILE   2  -8.119   2.342   2.766
    7    HA   ILE   2           HA       ILE   2  -6.241   2.013   4.989
    8    HB   ILE   2           HB       ILE   2  -6.907   0.005   3.883
    9   HG12  ILE   2          HG12      ILE   2  -4.383   0.439   4.397
   10   HG13  ILE   2          HG11      ILE   2  -4.818  -0.963   3.424
   11   HG21  ILE   2          HG21      ILE   2  -6.134  -0.093   1.316
   12   HG22  ILE   2          HG22      ILE   2  -6.451   1.638   1.433
   13   HG23  ILE   2          HG23      ILE   2  -7.731   0.480   1.794
   14   HD11  ILE   2          HD11      ILE   2  -3.679  -0.174   1.646
   15   HD12  ILE   2          HD12      ILE   2  -3.027   1.071   2.710
   16   HD13  ILE   2          HD13      ILE   2  -4.475   1.394   1.758
   17    H    VAL   3           H        VAL   3  -6.238   3.474   1.782
   18    HA   VAL   3           HA       VAL   3  -3.361   4.188   2.143
   19    HB   VAL   3           HB       VAL   3  -3.550   4.908  -0.278
   20   HG11  VAL   3          HG11      VAL   3  -4.361   2.112  -0.412
   21   HG12  VAL   3          HG12      VAL   3  -3.204   2.411   0.886
   22   HG13  VAL   3          HG13      VAL   3  -2.797   2.843  -0.771
   23   HG21  VAL   3          HG21      VAL   3  -5.969   3.230  -0.586
   24   HG22  VAL   3          HG22      VAL   3  -5.514   4.712  -1.428
   25   HG23  VAL   3          HG23      VAL   3  -6.241   4.796   0.178
   26    H    GLU   4           H        GLU   4  -6.053   5.401   3.200
   27    HA   GLU   4           HA       GLU   4  -6.622   7.913   2.231
   28    HB2  GLU   4           HB2      GLU   4  -7.099   8.618   4.527
   29    HB3  GLU   4           HB1      GLU   4  -7.613   6.945   4.302
   30    HG2  GLU   4           HG2      GLU   4  -5.679   6.101   5.433
   31    HG3  GLU   4           HG1      GLU   4  -4.899   7.684   5.418
   32    H    GLN   5           H        GLN   5  -3.622   6.879   3.712
   33    HA   GLN   5           HA       GLN   5  -2.620   9.681   3.593
   34    HB2  GLN   5           HB2      GLN   5  -0.604   8.462   4.819
   35    HB3  GLN   5           HB1      GLN   5  -2.048   8.932   5.715
   36    HG2  GLN   5           HG2      GLN   5  -2.938   6.718   5.637
   37    HG3  GLN   5           HG1      GLN   5  -1.761   6.213   4.426
   38   HE21  GLN   5          HE21      GLN   5  -1.481   4.495   6.323
   39   HE22  GLN   5          HE22      GLN   5  -0.290   4.872   7.473
   40    H    CYS   6           H        CYS   6  -1.772   6.353   2.576
   41    HA   CYS   6           HA       CYS   6   0.568   7.129   1.106
   42    HB2  CYS   6           HB2      CYS   6  -1.226   4.833   0.330
   43    HB3  CYS   6           HB1      CYS   6   0.528   4.942   0.195
   44    H    CYS   7           H        CYS   7  -2.814   7.395   0.531
   45    HA   CYS   7           HA       CYS   7  -2.413   7.951  -2.351
   46    HB2  CYS   7           HB2      CYS   7  -4.645   7.076  -0.678
   47    HB3  CYS   7           HB1      CYS   7  -5.084   8.347  -1.812
   48    H    THR   8           H        THR   8  -2.667   9.623   0.637
   49    HA   THR   8           HA       THR   8  -3.673  12.085  -0.675
   50    HB   THR   8           HB       THR   8  -4.421  11.290   1.659
   51    HG1  THR   8           HG1      THR   8  -3.475  13.853   1.000
   52   HG21  THR   8          HG21      THR   8  -3.003  11.568   3.489
   53   HG22  THR   8          HG22      THR   8  -1.945  12.685   2.625
   54   HG23  THR   8          HG23      THR   8  -1.888  10.960   2.267
   55    H    SER   9           H        SER   9  -0.722  10.780   0.779
   56    HA   SER   9           HA       SER   9   0.763  13.019  -0.488
   57    HB2  SER   9           HB2      SER   9   2.177  12.792   1.811
   58    HB3  SER   9           HB1      SER   9   0.894  13.976   1.583
   59    HG   SER   9           HG       SER   9   0.397  11.351   2.518
   60    H    ILE  10           H        ILE  10   2.228  10.885   1.864
   61    HA   ILE  10           HA       ILE  10   3.310   9.202  -0.351
   62    HB   ILE  10           HB       ILE  10   5.090  10.046   1.916
   63   HG12  ILE  10          HG12      ILE  10   4.062  12.118   0.914
   64   HG13  ILE  10          HG11      ILE  10   5.807  12.011   0.683
   65   HG21  ILE  10          HG21      ILE  10   6.399   8.662   0.692
   66   HG22  ILE  10          HG22      ILE  10   6.490   9.981  -0.475
   67   HG23  ILE  10          HG23      ILE  10   5.292   8.703  -0.682
   68   HD11  ILE  10          HD11      ILE  10   4.520  10.651  -1.487
   69   HD12  ILE  10          HD12      ILE  10   5.535  12.091  -1.547
   70   HD13  ILE  10          HD13      ILE  10   3.793  12.249  -1.318
   71    H    CYS  11           H        CYS  11   4.806   7.421   0.975
   72    HA   CYS  11           HA       CYS  11   3.694   6.582   3.514
   73    HB2  CYS  11           HB2      CYS  11   2.313   5.782   1.108
   74    HB3  CYS  11           HB1      CYS  11   3.003   4.365   1.900
   75    H    SER  12           H        SER  12   4.585   4.395   4.130
   76    HA   SER  12           HA       SER  12   7.249   4.015   2.843
   77    HB2  SER  12           HB2      SER  12   7.374   2.535   5.107
   78    HB3  SER  12           HB1      SER  12   7.794   4.243   5.053
   79    HG   SER  12           HG       SER  12   6.316   4.044   6.663
   80    H    LEU  13           H        LEU  13   7.744   2.021   1.912
   81    HA   LEU  13           HA       LEU  13   5.578   0.288   1.235
   82    HB2  LEU  13           HB2      LEU  13   7.084  -0.792  -0.120
   83    HB3  LEU  13           HB1      LEU  13   8.028   0.663   0.187
   84    HG   LEU  13           HG       LEU  13   8.239  -1.915   1.769
   85   HD11  LEU  13          HD11      LEU  13  10.021  -2.524   0.458
   86   HD12  LEU  13          HD12      LEU  13  10.487  -0.854   0.134
   87   HD13  LEU  13          HD13      LEU  13   9.145  -1.582  -0.748
   88   HD21  LEU  13          HD21      LEU  13   9.549  -0.786   3.228
   89   HD22  LEU  13          HD22      LEU  13   8.903   0.689   2.508
   90   HD23  LEU  13          HD23      LEU  13  10.427   0.018   1.926
   91    H    TYR  14           H        TYR  14   7.794   0.281   3.937
   92    HA   TYR  14           HA       TYR  14   7.218  -2.464   4.684
   93    HB2  TYR  14           HB2      TYR  14   8.136  -1.648   6.976
   94    HB3  TYR  14           HB1      TYR  14   9.242  -1.726   5.608
   95    HD1  TYR  14           HD1      TYR  14   7.207   0.535   7.723
   96    HD2  TYR  14           HD2      TYR  14  10.184   0.264   4.635
   97    HE1  TYR  14           HE1      TYR  14   7.717   2.947   8.002
   98    HE2  TYR  14           HE2      TYR  14  10.690   2.677   4.911
   99    HH   TYR  14           HH       TYR  14  10.437   4.390   6.903
  100    H    GLN  15           H        GLN  15   5.808   0.654   5.302
  101    HA   GLN  15           HA       GLN  15   4.053  -0.301   7.406
  102    HB2  GLN  15           HB2      GLN  15   3.443   1.892   7.595
  103    HB3  GLN  15           HB1      GLN  15   4.871   2.167   6.616
  104    HG2  GLN  15           HG2      GLN  15   3.569   2.331   4.609
  105    HG3  GLN  15           HG1      GLN  15   2.121   1.743   5.420
  106   HE21  GLN  15          HE21      GLN  15   4.453   4.175   6.650
  107   HE22  GLN  15          HE22      GLN  15   3.324   5.440   6.733
  108    H    LEU  16           H        LEU  16   4.098  -0.262   3.953
  109    HA   LEU  16           HA       LEU  16   1.284  -0.595   3.471
  110    HB2  LEU  16           HB2      LEU  16   3.815  -1.001   1.943
  111    HB3  LEU  16           HB1      LEU  16   2.381  -1.840   1.358
  112    HG   LEU  16           HG       LEU  16   2.839   0.517   0.432
  113   HD11  LEU  16          HD11      LEU  16   0.166   0.870   1.358
  114   HD12  LEU  16          HD12      LEU  16   0.434  -0.860   1.141
  115   HD13  LEU  16          HD13      LEU  16   0.700   0.249  -0.203
  116   HD21  LEU  16          HD21      LEU  16   3.066   1.214   3.048
  117   HD22  LEU  16          HD22      LEU  16   1.376   1.614   2.759
  118   HD23  LEU  16          HD23      LEU  16   2.640   2.351   1.773
  119    H    GLU  17           H        GLU  17   3.905  -2.769   4.322
  120    HA   GLU  17           HA       GLU  17   2.781  -5.259   3.674
  121    HB2  GLU  17           HB2      GLU  17   4.812  -5.688   4.612
  122    HB3  GLU  17           HB1      GLU  17   4.758  -4.231   5.596
  123    HG2  GLU  17           HG2      GLU  17   4.795  -6.129   7.089
  124    HG3  GLU  17           HG1      GLU  17   3.176  -5.434   7.152
  125    H    ASN  18           H        ASN  18   1.798  -2.916   6.016
  126    HA   ASN  18           HA       ASN  18   0.330  -4.511   7.839
  127    HB2  ASN  18           HB2      ASN  18   0.100  -1.678   6.883
  128    HB3  ASN  18           HB1      ASN  18  -1.171  -2.346   7.907
  129   HD21  ASN  18          HD21      ASN  18  -0.492  -3.177  10.079
  130   HD22  ASN  18          HD22      ASN  18   0.914  -2.564  10.806
  131    H    TYR  19           H        TYR  19  -0.391  -3.579   4.571
  132    HA   TYR  19           HA       TYR  19  -3.160  -4.635   4.829
  133    HB2  TYR  19           HB2      TYR  19  -2.116  -3.486   2.270
  134    HB3  TYR  19           HB1      TYR  19  -3.728  -3.368   2.977
  135    HD1  TYR  19           HD2      TYR  19  -3.499  -2.291   5.557
  136    HD2  TYR  19           HD1      TYR  19  -1.046  -1.423   2.137
  137    HE1  TYR  19           HE2      TYR  19  -2.904  -0.094   6.543
  138    HE2  TYR  19           HE1      TYR  19  -0.449   0.774   3.123
  139    HH   TYR  19           HH       TYR  19  -1.462   2.380   4.781
  140    H    CYS  20           H        CYS  20  -1.431  -6.678   5.065
  141    HA   CYS  20           HA       CYS  20  -1.468  -7.945   2.370
  142    HB2  CYS  20           HB2      CYS  20   0.649  -7.967   4.497
  143    HB3  CYS  20           HB1      CYS  20   0.502  -9.333   3.390
  144    H    ASN  21           H        ASN  21  -2.091  -8.248   5.780
  145    HA   ASN  21           HA       ASN  21  -2.730 -11.112   5.579
  146    HB2  ASN  21           HB2      ASN  21  -3.414  -9.323   7.907
  147    HB3  ASN  21           HB1      ASN  21  -3.063 -11.052   7.916
  148   HD21  ASN  21          HD21      ASN  21  -0.683 -11.358   6.674
  149   HD22  ASN  21          HD22      ASN  21   0.531 -10.404   7.377
  150    H1   PHE   1           HT1      PHE   1  10.267   0.701  -1.904
  151    H2   PHE   1           HT2      PHE   1   8.760   0.109  -2.417
  152    H3   PHE   1           HT3      PHE   1   8.839   1.415  -1.334
  153    HA   PHE   1           HA       PHE   1   9.964   1.534  -4.071
  154    HB2  PHE   1           HB2      PHE   1   7.794   3.030  -4.334
  155    HB3  PHE   1           HB1      PHE   1   7.713   1.287  -4.595
  156    HD1  PHE   1           HD2      PHE   1   6.866  -0.215  -2.785
  157    HD2  PHE   1           HD1      PHE   1   6.696   4.069  -2.467
  158    HE1  PHE   1           HE2      PHE   1   5.216  -0.416  -0.942
  159    HE2  PHE   1           HE1      PHE   1   5.046   3.866  -0.625
  160    HZ   PHE   1           HZ       PHE   1   4.307   1.624   0.138
  161    H    VAL   2           H        VAL   2   9.480   4.099  -4.605
  162    HA   VAL   2           HA       VAL   2  11.156   5.511  -2.669
  163    HB   VAL   2           HB       VAL   2  10.748   7.454  -4.287
  164   HG11  VAL   2          HG11      VAL   2  12.009   4.823  -5.016
  165   HG12  VAL   2          HG12      VAL   2  12.789   6.347  -4.594
  166   HG13  VAL   2          HG13      VAL   2  12.023   6.155  -6.171
  167   HG21  VAL   2          HG21      VAL   2   9.823   5.495  -6.303
  168   HG22  VAL   2          HG22      VAL   2   9.380   7.189  -6.094
  169   HG23  VAL   2          HG23      VAL   2   8.623   5.950  -5.094
  170    H    ASN   3           H        ASN   3  10.247   8.009  -2.432
  171    HA   ASN   3           HA       ASN   3   7.667   7.652  -0.986
  172    HB2  ASN   3           HB2      ASN   3  10.035   9.442  -0.660
  173    HB3  ASN   3           HB1      ASN   3   8.461  10.072  -0.174
  174   HD21  ASN   3          HD21      ASN   3  10.805   7.461   0.454
  175   HD22  ASN   3          HD22      ASN   3  10.160   7.020   1.962
  176    H    GLN   4           H        GLN   4   6.004   8.112  -2.384
  177    HA   GLN   4           HA       GLN   4   5.798  10.832  -3.423
  178    HB2  GLN   4           HB2      GLN   4   5.286   9.836  -5.784
  179    HB3  GLN   4           HB1      GLN   4   6.969  10.075  -5.314
  180    HG2  GLN   4           HG2      GLN   4   7.395   7.860  -5.381
  181    HG3  GLN   4           HG1      GLN   4   5.959   7.488  -4.426
  182   HE21  GLN   4          HE21      GLN   4   7.278   6.812  -7.368
  183   HE22  GLN   4          HE22      GLN   4   5.866   6.614  -8.288
  184    H    HIS   5           H        HIS   5   3.651  10.779  -4.921
  185    HA   HIS   5           HA       HIS   5   1.591   9.579  -3.180
  186    HB2  HIS   5           HB2      HIS   5   0.997  11.178  -5.656
  187    HB3  HIS   5           HB1      HIS   5   0.089  11.092  -4.147
  188    HD2  HIS   5           HD2      HIS   5   3.400  12.782  -5.494
  189    HE1  HIS   5           HE1      HIS   5   2.244  14.669  -1.892
  190    HE2  HIS   5           HE2      HIS   5   3.892  14.728  -3.838
  191    H    LEU   6           H        LEU   6   0.318   7.852  -3.789
  192    HA   LEU   6           HA       LEU   6   0.263   7.019  -6.607
  193    HB2  LEU   6           HB2      LEU   6   0.945   4.695  -6.067
  194    HB3  LEU   6           HB1      LEU   6   2.238   5.852  -5.810
  195    HG   LEU   6           HG       LEU   6   2.198   4.257  -3.978
  196   HD11  LEU   6          HD11      LEU   6   2.493   5.768  -2.297
  197   HD12  LEU   6          HD12      LEU   6   0.957   6.575  -2.608
  198   HD13  LEU   6          HD13      LEU   6   2.353   6.915  -3.629
  199   HD21  LEU   6          HD21      LEU   6  -0.392   5.109  -2.870
  200   HD22  LEU   6          HD22      LEU   6   0.336   3.505  -2.942
  201   HD23  LEU   6          HD23      LEU   6  -0.506   4.152  -4.348
  202    H    CYS   7           H        CYS   7  -1.511   5.616  -7.083
  203    HA   CYS   7           HA       CYS   7  -3.303   4.791  -4.900
  204    HB2  CYS   7           HB2      CYS   7  -4.065   6.930  -6.898
  205    HB3  CYS   7           HB1      CYS   7  -5.250   6.019  -5.961
  206    H    GLY   8           H        GLY   8  -5.234   3.611  -5.811
  207    HA2  GLY   8           HA2      GLY   8  -6.112   1.939  -7.192
  208    HA3  GLY   8           HA1      GLY   8  -5.472   2.877  -8.539
  209    H    SER   9           H        SER   9  -4.416   1.429  -9.794
  210    HA   SER   9           HA       SER   9  -3.211  -0.981  -8.991
  211    HB2  SER   9           HB2      SER   9  -1.768   0.299 -11.182
  212    HB3  SER   9           HB1      SER   9  -2.736  -1.172 -11.192
  213    HG   SER   9           HG       SER   9  -3.401   0.993 -12.329
  214    H    ASP  10           H        ASP  10  -2.120   2.248  -8.537
  215    HA   ASP  10           HA       ASP  10   0.693   1.528  -8.252
  216    HB2  ASP  10           HB2      ASP  10  -0.592   4.011  -7.127
  217    HB3  ASP  10           HB1      ASP  10   1.064   3.801  -7.696
  218    H    LEU  11           H        LEU  11  -2.115   1.713  -6.197
  219    HA   LEU  11           HA       LEU  11  -0.709   1.712  -3.684
  220    HB2  LEU  11           HB2      LEU  11  -3.432   0.521  -4.297
  221    HB3  LEU  11           HB1      LEU  11  -2.820   0.961  -2.703
  222    HG   LEU  11           HG       LEU  11  -3.089   2.954  -4.964
  223   HD11  LEU  11          HD11      LEU  11  -5.318   2.087  -4.422
  224   HD12  LEU  11          HD12      LEU  11  -5.140   3.725  -3.793
  225   HD13  LEU  11          HD13      LEU  11  -5.017   2.344  -2.704
  226   HD21  LEU  11          HD21      LEU  11  -1.775   3.031  -2.492
  227   HD22  LEU  11          HD22      LEU  11  -3.285   3.900  -2.219
  228   HD23  LEU  11          HD23      LEU  11  -2.191   4.416  -3.496
  229    H    VAL  12           H        VAL  12  -1.568  -0.767  -6.007
  230    HA   VAL  12           HA       VAL  12  -0.682  -2.884  -4.160
  231    HB   VAL  12           HB       VAL  12  -0.794  -4.316  -6.306
  232   HG11  VAL  12          HG11      VAL  12  -3.488  -3.225  -5.677
  233   HG12  VAL  12          HG12      VAL  12  -2.535  -3.852  -4.331
  234   HG13  VAL  12          HG13      VAL  12  -2.923  -4.896  -5.698
  235   HG21  VAL  12          HG21      VAL  12  -0.802  -2.402  -7.869
  236   HG22  VAL  12          HG22      VAL  12  -2.362  -1.892  -7.224
  237   HG23  VAL  12          HG23      VAL  12  -2.218  -3.427  -8.079
  238    H    GLU  13           H        GLU  13   0.514  -1.211  -7.081
  239    HA   GLU  13           HA       GLU  13   2.856  -2.597  -7.589
  240    HB2  GLU  13           HB2      GLU  13   2.518  -0.680  -8.929
  241    HB3  GLU  13           HB1      GLU  13   2.267   0.361  -7.528
  242    HG2  GLU  13           HG2      GLU  13   4.509   0.657  -7.173
  243    HG3  GLU  13           HG1      GLU  13   4.914  -0.976  -7.706
  244    H    ALA  14           H        ALA  14   2.009  -0.632  -4.887
  245    HA   ALA  14           HA       ALA  14   4.629  -0.607  -3.631
  246    HB1  ALA  14           HB1      ALA  14   3.214   0.212  -1.655
  247    HB2  ALA  14           HB2      ALA  14   1.829   0.107  -2.743
  248    HB3  ALA  14           HB3      ALA  14   3.156   1.208  -3.109
  249    H    LEU  15           H        LEU  15   1.535  -2.156  -2.862
  250    HA   LEU  15           HA       LEU  15   2.719  -3.963  -0.909
  251    HB2  LEU  15           HB2      LEU  15  -0.006  -3.634  -2.147
  252    HB3  LEU  15           HB1      LEU  15   0.356  -5.031  -1.135
  253    HG   LEU  15           HG       LEU  15   1.239  -2.481   0.028
  254   HD11  LEU  15          HD11      LEU  15  -1.420  -2.678  -1.122
  255   HD12  LEU  15          HD12      LEU  15  -0.646  -1.299  -0.341
  256   HD13  LEU  15          HD13      LEU  15  -1.505  -2.493   0.629
  257   HD21  LEU  15          HD21      LEU  15  -0.207  -4.982   0.853
  258   HD22  LEU  15          HD22      LEU  15  -0.268  -3.566   1.902
  259   HD23  LEU  15          HD23      LEU  15   1.285  -4.297   1.497
  260    H    TYR  16           H        TYR  16   2.832  -3.940  -4.196
  261    HA   TYR  16           HA       TYR  16   2.380  -6.799  -4.668
  262    HB2  TYR  16           HB2      TYR  16   1.709  -5.752  -6.583
  263    HB3  TYR  16           HB1      TYR  16   2.715  -4.345  -6.281
  264    HD1  TYR  16           HD1      TYR  16   2.835  -7.883  -7.445
  265    HD2  TYR  16           HD2      TYR  16   4.748  -4.038  -7.405
  266    HE1  TYR  16           HE1      TYR  16   4.487  -8.689  -9.118
  267    HE2  TYR  16           HE2      TYR  16   6.402  -4.839  -9.078
  268    HH   TYR  16           HH       TYR  16   7.088  -6.551 -10.308
  269    H    LEU  17           H        LEU  17   5.085  -4.525  -4.492
  270    HA   LEU  17           HA       LEU  17   6.964  -6.769  -4.968
  271    HB2  LEU  17           HB2      LEU  17   8.557  -4.575  -4.542
  272    HB3  LEU  17           HB1      LEU  17   8.012  -5.139  -6.115
  273    HG   LEU  17           HG       LEU  17   5.973  -3.677  -5.837
  274   HD11  LEU  17          HD11      LEU  17   6.149  -3.491  -3.359
  275   HD12  LEU  17          HD12      LEU  17   6.054  -1.916  -4.148
  276   HD13  LEU  17          HD13      LEU  17   7.605  -2.517  -3.562
  277   HD21  LEU  17          HD21      LEU  17   8.781  -2.649  -6.042
  278   HD22  LEU  17          HD22      LEU  17   7.442  -1.501  -6.053
  279   HD23  LEU  17          HD23      LEU  17   7.537  -2.757  -7.287
  280    H    VAL  18           H        VAL  18   5.534  -5.083  -2.388
  281    HA   VAL  18           HA       VAL  18   7.754  -5.610  -0.522
  282    HB   VAL  18           HB       VAL  18   6.415  -4.575   1.158
  283   HG11  VAL  18          HG11      VAL  18   7.043  -2.714  -0.001
  284   HG12  VAL  18          HG12      VAL  18   5.323  -2.620  -0.382
  285   HG13  VAL  18          HG13      VAL  18   6.443  -3.348  -1.533
  286   HG21  VAL  18          HG21      VAL  18   4.330  -5.703   0.906
  287   HG22  VAL  18          HG22      VAL  18   4.131  -5.107  -0.741
  288   HG23  VAL  18          HG23      VAL  18   3.986  -3.997   0.621
  289    H    CYS  19           H        CYS  19   4.521  -6.827  -1.214
  290    HA   CYS  19           HA       CYS  19   5.038  -9.125   0.614
  291    HB2  CYS  19           HB2      CYS  19   2.591  -7.713  -0.314
  292    HB3  CYS  19           HB1      CYS  19   2.456  -9.460  -0.106
  293    H    GLY  20           H        GLY  20   3.248  -8.690  -2.461
  294    HA2  GLY  20           HA2      GLY  20   3.966  -9.801  -4.529
  295    HA3  GLY  20           HA1      GLY  20   4.759 -11.028  -3.540
  296    H    GLU  21           H        GLU  21   3.656 -12.908  -3.315
  297    HA   GLU  21           HA       GLU  21   0.798 -12.960  -4.107
  298    HB2  GLU  21           HB2      GLU  21   2.610 -14.606  -4.963
  299    HB3  GLU  21           HB1      GLU  21   2.461 -15.366  -3.379
  300    HG2  GLU  21           HG2      GLU  21  -0.165 -14.850  -4.450
  301    HG3  GLU  21           HG1      GLU  21   0.789 -15.754  -5.628
  302    H    ARG  22           H        ARG  22   2.320 -12.299  -1.336
  303    HA   ARG  22           HA       ARG  22   1.157 -14.147   0.540
  304    HB2  ARG  22           HB2      ARG  22   1.835 -11.264   1.144
  305    HB3  ARG  22           HB1      ARG  22   1.902 -12.652   2.232
  306    HG2  ARG  22           HG2      ARG  22   3.657 -13.609   0.591
  307    HG3  ARG  22           HG1      ARG  22   3.758 -11.967  -0.046
  308    HD2  ARG  22           HD2      ARG  22   5.156 -11.443   1.637
  309    HD3  ARG  22           HD1      ARG  22   3.840 -11.734   2.774
  310    HE   ARG  22           HE       ARG  22   4.838 -14.268   2.224
  311   HH11  ARG  22          HH21      ARG  22   5.042 -12.806   4.894
  312   HH12  ARG  22          HH22      ARG  22   6.754 -12.839   5.161
  313   HH21  ARG  22          HH11      ARG  22   7.518 -13.650   1.878
  314   HH22  ARG  22          HH12      ARG  22   8.155 -13.314   3.453
  315    H    GLY  23           H        GLY  23  -0.256 -11.798  -1.423
  316    HA2  GLY  23           HA2      GLY  23  -2.857 -12.070  -1.031
  317    HA3  GLY  23           HA1      GLY  23  -2.468 -11.262   0.489
  318    H    ALA  24           H        ALA  24  -1.789  -9.056   0.428
  319    HA   ALA  24           HA       ALA  24  -1.644  -6.883  -0.463
  320    HB1  ALA  24           HB1      ALA  24  -1.790  -7.318  -3.265
  321    HB2  ALA  24           HB2      ALA  24  -0.799  -8.615  -2.597
  322    HB3  ALA  24           HB3      ALA  24  -0.360  -6.931  -2.310
  323    H    PHE  25           H        PHE  25  -4.145  -7.928   0.230
  324    HA   PHE  25           HA       PHE  25  -5.872  -6.441  -1.662
  325    HB2  PHE  25           HB2      PHE  25  -7.546  -8.221  -1.692
  326    HB3  PHE  25           HB1      PHE  25  -6.006  -8.858  -2.271
  327    HD1  PHE  25           HD2      PHE  25  -4.410  -9.765  -0.311
  328    HD2  PHE  25           HD1      PHE  25  -8.692  -9.471  -0.094
  329    HE1  PHE  25           HE2      PHE  25  -4.436 -11.475   1.487
  330    HE2  PHE  25           HE1      PHE  25  -8.718 -11.181   1.705
  331    HZ   PHE  25           HZ       PHE  25  -6.589 -12.183   2.496
  332    H    TYR  26           H        TYR  26  -6.671  -4.871  -0.342
  333    HA   TYR  26           HA       TYR  26  -7.407  -5.621   2.452
  334    HB2  TYR  26           HB2      TYR  26  -7.528  -3.053   2.700
  335    HB3  TYR  26           HB1      TYR  26  -5.927  -3.769   2.509
  336    HD1  TYR  26           HD1      TYR  26  -8.715  -2.162   0.616
  337    HD2  TYR  26           HD2      TYR  26  -4.539  -3.175   0.686
  338    HE1  TYR  26           HE1      TYR  26  -8.351  -0.801  -1.426
  339    HE2  TYR  26           HE2      TYR  26  -4.174  -1.813  -1.356
  340    HH   TYR  26           HH       TYR  26  -6.112   0.463  -2.416
  341    H    THR  27           H        THR  27  -8.746  -4.997  -0.598
  342    HA   THR  27           HA       THR  27 -11.240  -3.799   0.366
  343    HB   THR  27           HB       THR  27 -11.969  -3.938  -1.938
  344    HG1  THR  27           HG1      THR  27  -9.726  -5.646  -2.226
  345   HG21  THR  27          HG21      THR  27  -8.996  -3.348  -1.857
  346   HG22  THR  27          HG22      THR  27 -10.266  -2.217  -1.388
  347   HG23  THR  27          HG23      THR  27 -10.142  -2.758  -3.062
  348    H    LYS  28           H        LYS  28 -13.351  -4.945  -0.031
  349    HA   LYS  28           HA       LYS  28 -13.240  -7.883  -0.124
  350    HB2  LYS  28           HB2      LYS  28 -13.156  -6.593   2.371
  351    HB3  LYS  28           HB1      LYS  28 -14.831  -7.111   2.178
  352    HG2  LYS  28           HG2      LYS  28 -14.085  -9.128   2.903
  353    HG3  LYS  28           HG1      LYS  28 -13.453  -9.308   1.266
  354    HD2  LYS  28           HD2      LYS  28 -11.388  -9.442   2.153
  355    HD3  LYS  28           HD1      LYS  28 -11.548  -7.751   2.631
  356    HE2  LYS  28           HE2      LYS  28 -12.944  -9.642   4.409
  357    HE3  LYS  28           HE1      LYS  28 -11.190  -9.834   4.384
  358    HZ1  LYS  28           HZ1      LYS  28 -12.333  -7.137   4.594
  359    HZ2  LYS  28           HZ2      LYS  28 -10.851  -7.730   5.178
  360    HZ3  LYS  28           HZ3      LYS  28 -12.299  -8.122   5.974
  361    HA   PRO  29           HA       PRO  29 -17.019  -5.995  -1.936
  362    HB2  PRO  29           HB2      PRO  29 -16.769  -7.288  -4.349
  363    HB3  PRO  29           HB1      PRO  29 -16.024  -5.720  -3.996
  364    HG2  PRO  29           HG2      PRO  29 -14.743  -8.406  -4.186
  365    HG3  PRO  29           HG1      PRO  29 -14.038  -6.805  -4.464
  366    HD2  PRO  29           HD2      PRO  29 -13.709  -8.378  -2.133
  367    HD3  PRO  29           HD1      PRO  29 -13.296  -6.657  -2.300
  368    H    THR  30           H        THR  30 -18.158  -7.387  -0.373
  369    HA   THR  30           HA       THR  30 -19.173  -9.871  -1.653
  370    HB   THR  30           HB       THR  30 -18.922 -11.154   0.390
  371    HG1  THR  30           HG1      THR  30 -18.298  -8.634   1.394
  372   HG21  THR  30          HG21      THR  30 -16.347  -9.666  -0.189
  373   HG22  THR  30          HG22      THR  30 -16.963 -11.019  -1.137
  374   HG23  THR  30          HG23      THR  30 -16.486 -11.263   0.543
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1 -10.864   4.387   5.482
    2    H2   GLY   1           HT2      GLY   1 -11.227   5.144   4.006
    3    H3   GLY   1           HT3      GLY   1  -9.831   5.585   4.867
    4    HA2  GLY   1           HA1      GLY   1  -9.926   2.829   4.151
    5    HA3  GLY   1           HA2      GLY   1  -9.825   3.914   2.730
    6    H    ILE   2           H        ILE   2  -7.871   2.395   2.687
    7    HA   ILE   2           HA       ILE   2  -6.183   2.188   5.122
    8    HB   ILE   2           HB       ILE   2  -6.883   0.230   3.462
    9   HG12  ILE   2          HG12      ILE   2  -5.586  -0.406   5.298
   10   HG13  ILE   2          HG11      ILE   2  -4.526  -0.805   3.949
   11   HG21  ILE   2          HG21      ILE   2  -5.048  -0.203   1.822
   12   HG22  ILE   2          HG22      ILE   2  -4.417   1.409   2.154
   13   HG23  ILE   2          HG23      ILE   2  -6.013   1.219   1.425
   14   HD11  ILE   2          HD11      ILE   2  -3.280   1.259   4.247
   15   HD12  ILE   2          HD12      ILE   2  -3.363   0.425   5.798
   16   HD13  ILE   2          HD13      ILE   2  -4.409   1.806   5.486
   17    H    VAL   3           H        VAL   3  -6.335   3.739   2.014
   18    HA   VAL   3           HA       VAL   3  -3.496   4.612   2.270
   19    HB   VAL   3           HB       VAL   3  -3.562   5.135  -0.049
   20   HG11  VAL   3          HG11      VAL   3  -3.435   2.756   0.298
   21   HG12  VAL   3          HG12      VAL   3  -4.530   3.033  -1.057
   22   HG13  VAL   3          HG13      VAL   3  -5.179   2.645   0.535
   23   HG21  VAL   3          HG21      VAL   3  -5.623   6.343  -0.236
   24   HG22  VAL   3          HG22      VAL   3  -6.566   4.946   0.281
   25   HG23  VAL   3          HG23      VAL   3  -5.787   4.947  -1.301
   26    H    GLU   4           H        GLU   4  -6.267   5.651   3.489
   27    HA   GLU   4           HA       GLU   4  -6.903   8.199   2.657
   28    HB2  GLU   4           HB2      GLU   4  -6.966   8.733   5.240
   29    HB3  GLU   4           HB1      GLU   4  -8.073   7.538   4.563
   30    HG2  GLU   4           HG2      GLU   4  -6.774   5.722   5.344
   31    HG3  GLU   4           HG1      GLU   4  -5.360   6.741   5.617
   32    H    GLN   5           H        GLN   5  -3.910   7.170   4.169
   33    HA   GLN   5           HA       GLN   5  -2.956   9.996   4.122
   34    HB2  GLN   5           HB2      GLN   5  -0.956   8.683   5.392
   35    HB3  GLN   5           HB1      GLN   5  -2.350   9.358   6.234
   36    HG2  GLN   5           HG2      GLN   5  -3.507   7.148   5.983
   37    HG3  GLN   5           HG1      GLN   5  -2.022   6.493   5.292
   38   HE21  GLN   5          HE21      GLN   5  -2.334   5.049   7.368
   39   HE22  GLN   5          HE22      GLN   5  -1.592   5.615   8.786
   40    H    CYS   6           H        CYS   6  -1.599   6.729   3.491
   41    HA   CYS   6           HA       CYS   6   0.669   7.434   2.076
   42    HB2  CYS   6           HB2      CYS   6  -1.219   5.225   1.229
   43    HB3  CYS   6           HB1      CYS   6   0.517   5.303   0.935
   44    H    CYS   7           H        CYS   7  -2.657   7.357   0.811
   45    HA   CYS   7           HA       CYS   7  -1.896   7.979  -1.896
   46    HB2  CYS   7           HB2      CYS   7  -4.386   7.740  -0.355
   47    HB3  CYS   7           HB1      CYS   7  -4.454   8.934  -1.645
   48    H    THR   8           H        THR   8  -3.151  10.016   0.767
   49    HA   THR   8           HA       THR   8  -2.824  12.459  -0.781
   50    HB   THR   8           HB       THR   8  -4.502  12.308   1.015
   51    HG1  THR   8           HG1      THR   8  -3.580  14.336   0.549
   52   HG21  THR   8          HG21      THR   8  -3.002  10.802   2.444
   53   HG22  THR   8          HG22      THR   8  -3.918  12.038   3.305
   54   HG23  THR   8          HG23      THR   8  -2.203  12.282   2.973
   55    H    SER   9           H        SER   9  -1.045  10.989   1.952
   56    HA   SER   9           HA       SER   9   1.207  12.858   1.352
   57    HB2  SER   9           HB2      SER   9   1.864  11.644   3.718
   58    HB3  SER   9           HB1      SER   9   1.038  13.191   3.587
   59    HG   SER   9           HG       SER   9  -0.486  12.179   4.634
   60    H    ILE  10           H        ILE  10   3.265  11.412   2.551
   61    HA   ILE  10           HA       ILE  10   3.680   9.311   0.522
   62    HB   ILE  10           HB       ILE  10   5.650  10.064   2.674
   63   HG12  ILE  10          HG12      ILE  10   4.615  12.126   1.528
   64   HG13  ILE  10          HG11      ILE  10   6.369  11.976   1.450
   65   HG21  ILE  10          HG21      ILE  10   7.001   9.791   0.321
   66   HG22  ILE  10          HG22      ILE  10   5.648   8.690   0.053
   67   HG23  ILE  10          HG23      ILE  10   6.707   8.462   1.443
   68   HD11  ILE  10          HD11      ILE  10   4.564  10.917  -0.733
   69   HD12  ILE  10          HD12      ILE  10   6.303  11.199  -0.804
   70   HD13  ILE  10          HD13      ILE  10   5.190  12.567  -0.745
   71    H    CYS  11           H        CYS  11   5.032   7.335   1.550
   72    HA   CYS  11           HA       CYS  11   4.127   6.518   4.203
   73    HB2  CYS  11           HB2      CYS  11   2.644   5.733   1.791
   74    HB3  CYS  11           HB1      CYS  11   3.162   4.364   2.774
   75    H    SER  12           H        SER  12   5.098   4.455   4.830
   76    HA   SER  12           HA       SER  12   7.634   3.975   3.403
   77    HB2  SER  12           HB2      SER  12   7.576   2.165   5.450
   78    HB3  SER  12           HB1      SER  12   8.199   3.806   5.596
   79    HG   SER  12           HG       SER  12   6.542   4.295   6.793
   80    H    LEU  13           H        LEU  13   7.902   2.300   1.996
   81    HA   LEU  13           HA       LEU  13   5.781   0.701   1.072
   82    HB2  LEU  13           HB2      LEU  13   7.550  -0.738   0.058
   83    HB3  LEU  13           HB1      LEU  13   7.827   0.980  -0.226
   84    HG   LEU  13           HG       LEU  13   9.027  -0.161   2.244
   85   HD11  LEU  13          HD11      LEU  13  10.342  -1.689   1.253
   86   HD12  LEU  13          HD12      LEU  13  10.840  -0.524   0.025
   87   HD13  LEU  13          HD13      LEU  13   9.385  -1.492  -0.215
   88   HD21  LEU  13          HD21      LEU  13  10.122   1.800   2.096
   89   HD22  LEU  13          HD22      LEU  13   9.251   2.160   0.605
   90   HD23  LEU  13          HD23      LEU  13  10.799   1.317   0.541
   91    H    TYR  14           H        TYR  14   7.989   0.165   3.735
   92    HA   TYR  14           HA       TYR  14   7.264  -2.616   4.090
   93    HB2  TYR  14           HB2      TYR  14   8.385  -2.419   6.283
   94    HB3  TYR  14           HB1      TYR  14   9.383  -1.762   4.988
   95    HD1  TYR  14           HD1      TYR  14   6.810  -0.712   7.506
   96    HD2  TYR  14           HD2      TYR  14  10.249   0.400   5.182
   97    HE1  TYR  14           HE1      TYR  14   6.909   1.464   8.693
   98    HE2  TYR  14           HE2      TYR  14  10.349   2.576   6.367
   99    HH   TYR  14           HH       TYR  14   8.041   3.353   8.976
  100    H    GLN  15           H        GLN  15   6.020   0.439   5.233
  101    HA   GLN  15           HA       GLN  15   4.248  -0.745   7.188
  102    HB2  GLN  15           HB2      GLN  15   3.778   1.412   7.738
  103    HB3  GLN  15           HB1      GLN  15   5.160   1.780   6.722
  104    HG2  GLN  15           HG2      GLN  15   3.613   3.181   5.746
  105    HG3  GLN  15           HG1      GLN  15   3.287   1.723   4.811
  106   HE21  GLN  15          HE21      GLN  15   1.461   4.022   5.827
  107   HE22  GLN  15          HE22      GLN  15   0.175   3.205   6.576
  108    H    LEU  16           H        LEU  16   4.123   0.007   3.784
  109    HA   LEU  16           HA       LEU  16   1.313  -0.209   3.373
  110    HB2  LEU  16           HB2      LEU  16   3.762  -0.428   1.685
  111    HB3  LEU  16           HB1      LEU  16   2.276  -1.126   1.035
  112    HG   LEU  16           HG       LEU  16   1.139   1.058   1.591
  113   HD11  LEU  16          HD11      LEU  16   3.666   2.530   1.538
  114   HD12  LEU  16          HD12      LEU  16   3.456   1.549   2.986
  115   HD13  LEU  16          HD13      LEU  16   2.250   2.759   2.563
  116   HD21  LEU  16          HD21      LEU  16   1.585   0.812  -0.693
  117   HD22  LEU  16          HD22      LEU  16   3.331   0.769  -0.442
  118   HD23  LEU  16          HD23      LEU  16   2.460   2.297  -0.318
  119    H    GLU  17           H        GLU  17   3.881  -2.610   3.645
  120    HA   GLU  17           HA       GLU  17   2.468  -4.886   2.724
  121    HB2  GLU  17           HB2      GLU  17   4.670  -5.419   3.195
  122    HB3  GLU  17           HB1      GLU  17   4.724  -4.384   4.619
  123    HG2  GLU  17           HG2      GLU  17   3.878  -6.014   6.010
  124    HG3  GLU  17           HG1      GLU  17   2.945  -6.778   4.723
  125    H    ASN  18           H        ASN  18   2.003  -2.892   5.483
  126    HA   ASN  18           HA       ASN  18   0.706  -4.737   7.242
  127    HB2  ASN  18           HB2      ASN  18   1.534  -2.308   7.675
  128    HB3  ASN  18           HB1      ASN  18  -0.045  -1.826   7.052
  129   HD21  ASN  18          HD21      ASN  18   0.731  -1.399   9.805
  130   HD22  ASN  18          HD22      ASN  18  -0.267  -2.363  10.781
  131    H    TYR  19           H        TYR  19  -0.335  -3.264   4.304
  132    HA   TYR  19           HA       TYR  19  -3.190  -3.493   4.886
  133    HB2  TYR  19           HB2      TYR  19  -1.987  -3.235   2.134
  134    HB3  TYR  19           HB1      TYR  19  -3.559  -2.677   2.696
  135    HD1  TYR  19           HD2      TYR  19  -2.059  -1.754   5.446
  136    HD2  TYR  19           HD1      TYR  19  -1.656  -0.884   1.256
  137    HE1  TYR  19           HE2      TYR  19  -1.074   0.454   5.999
  138    HE2  TYR  19           HE1      TYR  19  -0.677   1.326   1.810
  139    HH   TYR  19           HH       TYR  19  -0.885   2.730   4.810
  140    H    CYS  20           H        CYS  20  -0.877  -5.774   4.384
  141    HA   CYS  20           HA       CYS  20  -2.355  -7.505   2.546
  142    HB2  CYS  20           HB2      CYS  20  -0.052  -8.251   4.361
  143    HB3  CYS  20           HB1      CYS  20  -0.580  -9.093   2.905
  144    H    ASN  21           H        ASN  21  -2.198  -9.991   3.769
  145    HA   ASN  21           HA       ASN  21  -4.539 -10.022   5.395
  146    HB2  ASN  21           HB2      ASN  21  -2.365 -12.128   5.294
  147    HB3  ASN  21           HB1      ASN  21  -4.048 -12.369   5.766
  148   HD21  ASN  21          HD21      ASN  21  -5.621 -12.597   4.089
  149   HD22  ASN  21          HD22      ASN  21  -5.220 -12.602   2.438
  150    H1   PHE   1           HT1      PHE   1   9.037  -0.496  -2.862
  151    H2   PHE   1           HT2      PHE   1   9.010   0.684  -1.640
  152    H3   PHE   1           HT3      PHE   1  10.491   0.045  -2.176
  153    HA   PHE   1           HA       PHE   1  10.314   1.100  -4.269
  154    HB2  PHE   1           HB2      PHE   1   8.260   2.528  -4.715
  155    HB3  PHE   1           HB1      PHE   1   7.977   0.787  -4.733
  156    HD1  PHE   1           HD2      PHE   1   7.035  -0.335  -2.665
  157    HD2  PHE   1           HD1      PHE   1   7.181   3.935  -3.128
  158    HE1  PHE   1           HE2      PHE   1   5.355  -0.081  -0.856
  159    HE2  PHE   1           HE1      PHE   1   5.502   4.189  -1.320
  160    HZ   PHE   1           HZ       PHE   1   4.589   2.181  -0.184
  161    H    VAL   2           H        VAL   2   9.787   3.742  -4.497
  162    HA   VAL   2           HA       VAL   2  11.442   4.888  -2.377
  163    HB   VAL   2           HB       VAL   2  11.430   6.898  -3.708
  164   HG11  VAL   2          HG11      VAL   2  11.831   5.814  -6.061
  165   HG12  VAL   2          HG12      VAL   2  11.592   4.292  -5.202
  166   HG13  VAL   2          HG13      VAL   2  12.896   5.381  -4.724
  167   HG21  VAL   2          HG21      VAL   2   9.186   5.583  -5.271
  168   HG22  VAL   2          HG22      VAL   2   9.927   7.138  -5.649
  169   HG23  VAL   2          HG23      VAL   2   9.000   6.941  -4.162
  170    H    ASN   3           H        ASN   3  10.482   7.369  -1.897
  171    HA   ASN   3           HA       ASN   3   7.914   6.798  -0.489
  172    HB2  ASN   3           HB2      ASN   3   8.650   9.000   0.742
  173    HB3  ASN   3           HB1      ASN   3   9.440   7.476   1.146
  174   HD21  ASN   3          HD21      ASN   3  10.061  10.678   0.202
  175   HD22  ASN   3          HD22      ASN   3  11.659  10.471  -0.330
  176    H    GLN   4           H        GLN   4   6.228   7.487  -1.749
  177    HA   GLN   4           HA       GLN   4   6.067  10.320  -2.441
  178    HB2  GLN   4           HB2      GLN   4   5.514   9.706  -4.886
  179    HB3  GLN   4           HB1      GLN   4   7.216   9.707  -4.425
  180    HG2  GLN   4           HG2      GLN   4   7.157   7.278  -4.100
  181    HG3  GLN   4           HG1      GLN   4   5.436   7.252  -4.483
  182   HE21  GLN   4          HE21      GLN   4   4.986   6.773  -6.635
  183   HE22  GLN   4          HE22      GLN   4   6.043   7.038  -7.936
  184    H    HIS   5           H        HIS   5   3.893  10.427  -3.970
  185    HA   HIS   5           HA       HIS   5   1.825   9.151  -2.294
  186    HB2  HIS   5           HB2      HIS   5   1.254  10.916  -4.664
  187    HB3  HIS   5           HB1      HIS   5   0.331  10.731  -3.173
  188    HD2  HIS   5           HD2      HIS   5   3.445  12.697  -4.503
  189    HE1  HIS   5           HE1      HIS   5   2.650  13.969  -0.550
  190    HE2  HIS   5           HE2      HIS   5   4.043  14.413  -2.641
  191    H    LEU   6           H        LEU   6   0.513   7.485  -3.011
  192    HA   LEU   6           HA       LEU   6   0.524   6.817  -5.882
  193    HB2  LEU   6           HB2      LEU   6   1.050   4.429  -5.419
  194    HB3  LEU   6           HB1      LEU   6   2.392   5.507  -5.073
  195    HG   LEU   6           HG       LEU   6   2.188   3.835  -3.313
  196   HD11  LEU   6          HD11      LEU   6   2.495   6.484  -2.872
  197   HD12  LEU   6          HD12      LEU   6   2.588   5.271  -1.598
  198   HD13  LEU   6          HD13      LEU   6   1.090   6.165  -1.854
  199   HD21  LEU   6          HD21      LEU   6  -0.366   4.841  -2.242
  200   HD22  LEU   6          HD22      LEU   6   0.253   3.195  -2.332
  201   HD23  LEU   6          HD23      LEU   6  -0.503   3.926  -3.745
  202    H    CYS   7           H        CYS   7  -1.280   5.577  -6.530
  203    HA   CYS   7           HA       CYS   7  -3.227   4.681  -4.516
  204    HB2  CYS   7           HB2      CYS   7  -3.954   6.861  -6.497
  205    HB3  CYS   7           HB1      CYS   7  -5.053   6.085  -5.360
  206    H    GLY   8           H        GLY   8  -5.212   3.762  -5.711
  207    HA2  GLY   8           HA2      GLY   8  -6.034   2.205  -7.250
  208    HA3  GLY   8           HA1      GLY   8  -5.264   3.213  -8.470
  209    H    SER   9           H        SER   9  -4.391   1.649  -9.769
  210    HA   SER   9           HA       SER   9  -3.256  -0.806  -9.020
  211    HB2  SER   9           HB2      SER   9  -3.218   0.911 -11.386
  212    HB3  SER   9           HB1      SER   9  -1.730  -0.012 -11.199
  213    HG   SER   9           HG       SER   9  -2.962  -1.890 -11.090
  214    H    ASP  10           H        ASP  10  -2.012   2.372  -8.590
  215    HA   ASP  10           HA       ASP  10   0.777   1.552  -8.402
  216    HB2  ASP  10           HB2      ASP  10  -0.593   4.048  -7.360
  217    HB3  ASP  10           HB1      ASP  10   1.149   3.814  -7.479
  218    H    LEU  11           H        LEU  11  -1.948   1.749  -6.247
  219    HA   LEU  11           HA       LEU  11  -0.489   1.610  -3.780
  220    HB2  LEU  11           HB2      LEU  11  -3.280   0.875  -4.617
  221    HB3  LEU  11           HB1      LEU  11  -2.691   0.386  -3.030
  222    HG   LEU  11           HG       LEU  11  -2.282   3.221  -3.888
  223   HD11  LEU  11          HD11      LEU  11  -4.681   2.605  -4.378
  224   HD12  LEU  11          HD12      LEU  11  -4.495   3.855  -3.146
  225   HD13  LEU  11          HD13      LEU  11  -4.862   2.195  -2.675
  226   HD21  LEU  11          HD21      LEU  11  -2.560   3.570  -1.453
  227   HD22  LEU  11          HD22      LEU  11  -1.316   2.365  -1.787
  228   HD23  LEU  11          HD23      LEU  11  -2.916   1.854  -1.255
  229    H    VAL  12           H        VAL  12  -1.582  -0.775  -6.112
  230    HA   VAL  12           HA       VAL  12  -0.693  -3.006  -4.458
  231    HB   VAL  12           HB       VAL  12  -0.910  -4.327  -6.614
  232   HG11  VAL  12          HG11      VAL  12  -3.557  -3.486  -6.584
  233   HG12  VAL  12          HG12      VAL  12  -2.960  -3.042  -4.985
  234   HG13  VAL  12          HG13      VAL  12  -2.849  -4.714  -5.535
  235   HG21  VAL  12          HG21      VAL  12  -2.121  -3.252  -8.456
  236   HG22  VAL  12          HG22      VAL  12  -0.587  -2.437  -8.163
  237   HG23  VAL  12          HG23      VAL  12  -2.093  -1.715  -7.594
  238    H    GLU  13           H        GLU  13   0.601  -1.287  -7.335
  239    HA   GLU  13           HA       GLU  13   2.889  -2.754  -7.835
  240    HB2  GLU  13           HB2      GLU  13   2.576  -0.762  -9.119
  241    HB3  GLU  13           HB1      GLU  13   2.523   0.245  -7.671
  242    HG2  GLU  13           HG2      GLU  13   4.781   0.393  -7.553
  243    HG3  GLU  13           HG1      GLU  13   4.997  -1.321  -7.913
  244    H    ALA  14           H        ALA  14   2.192  -0.621  -5.193
  245    HA   ALA  14           HA       ALA  14   4.759  -0.826  -3.872
  246    HB1  ALA  14           HB1      ALA  14   2.314   0.610  -3.552
  247    HB2  ALA  14           HB2      ALA  14   3.838   0.871  -2.705
  248    HB3  ALA  14           HB3      ALA  14   2.641  -0.239  -2.041
  249    H    LEU  15           H        LEU  15   1.550  -2.089  -3.030
  250    HA   LEU  15           HA       LEU  15   2.456  -3.919  -1.044
  251    HB2  LEU  15           HB2      LEU  15  -0.031  -3.555  -2.644
  252    HB3  LEU  15           HB1      LEU  15   0.202  -5.124  -1.873
  253    HG   LEU  15           HG       LEU  15   0.869  -2.931  -0.072
  254   HD11  LEU  15          HD11      LEU  15  -1.745  -2.902  -1.534
  255   HD12  LEU  15          HD12      LEU  15  -0.788  -1.551  -0.927
  256   HD13  LEU  15          HD13      LEU  15  -1.749  -2.522   0.188
  257   HD21  LEU  15          HD21      LEU  15  -0.088  -4.348   1.464
  258   HD22  LEU  15          HD22      LEU  15   0.153  -5.523   0.170
  259   HD23  LEU  15          HD23      LEU  15  -1.427  -4.769   0.395
  260    H    TYR  16           H        TYR  16   1.310  -4.635  -4.293
  261    HA   TYR  16           HA       TYR  16   1.757  -7.203  -4.778
  262    HB2  TYR  16           HB2      TYR  16   1.281  -6.146  -6.749
  263    HB3  TYR  16           HB1      TYR  16   2.340  -4.789  -6.401
  264    HD1  TYR  16           HD1      TYR  16   2.469  -8.430  -7.238
  265    HD2  TYR  16           HD2      TYR  16   4.384  -4.595  -7.503
  266    HE1  TYR  16           HE1      TYR  16   4.213  -9.407  -8.714
  267    HE2  TYR  16           HE2      TYR  16   6.130  -5.568  -8.979
  268    HH   TYR  16           HH       TYR  16   6.888  -7.400  -9.968
  269    H    LEU  17           H        LEU  17   4.569  -4.939  -4.489
  270    HA   LEU  17           HA       LEU  17   6.282  -7.372  -4.620
  271    HB2  LEU  17           HB2      LEU  17   8.079  -5.332  -4.452
  272    HB3  LEU  17           HB1      LEU  17   7.464  -6.001  -5.958
  273    HG   LEU  17           HG       LEU  17   5.585  -4.286  -5.803
  274   HD11  LEU  17          HD11      LEU  17   5.729  -2.534  -4.248
  275   HD12  LEU  17          HD12      LEU  17   7.445  -2.804  -3.966
  276   HD13  LEU  17          HD13      LEU  17   6.257  -3.913  -3.293
  277   HD21  LEU  17          HD21      LEU  17   7.034  -3.575  -7.416
  278   HD22  LEU  17          HD22      LEU  17   8.449  -3.844  -6.398
  279   HD23  LEU  17          HD23      LEU  17   7.491  -2.375  -6.207
  280    H    VAL  18           H        VAL  18   5.187  -5.030  -2.265
  281    HA   VAL  18           HA       VAL  18   7.373  -5.533  -0.414
  282    HB   VAL  18           HB       VAL  18   6.102  -4.333   1.217
  283   HG11  VAL  18          HG11      VAL  18   6.630  -2.516  -0.008
  284   HG12  VAL  18          HG12      VAL  18   4.987  -2.581  -0.648
  285   HG13  VAL  18          HG13      VAL  18   6.304  -3.365  -1.519
  286   HG21  VAL  18          HG21      VAL  18   3.775  -5.066  -0.536
  287   HG22  VAL  18          HG22      VAL  18   3.668  -3.705   0.573
  288   HG23  VAL  18          HG23      VAL  18   3.974  -5.327   1.193
  289    H    CYS  19           H        CYS  19   4.141  -6.826  -0.861
  290    HA   CYS  19           HA       CYS  19   4.640  -8.837   1.270
  291    HB2  CYS  19           HB2      CYS  19   2.234  -7.661  -0.003
  292    HB3  CYS  19           HB1      CYS  19   2.127  -9.381   0.375
  293    H    GLY  20           H        GLY  20   4.332  -8.467  -2.189
  294    HA2  GLY  20           HA2      GLY  20   4.937  -9.980  -3.888
  295    HA3  GLY  20           HA1      GLY  20   5.447 -11.111  -2.635
  296    H    GLU  21           H        GLU  21   4.274 -12.955  -2.636
  297    HA   GLU  21           HA       GLU  21   1.518 -12.881  -3.756
  298    HB2  GLU  21           HB2      GLU  21   3.586 -14.596  -4.261
  299    HB3  GLU  21           HB1      GLU  21   2.699 -15.486  -3.024
  300    HG2  GLU  21           HG2      GLU  21   0.806 -14.361  -4.856
  301    HG3  GLU  21           HG1      GLU  21   2.043 -15.209  -5.783
  302    H    ARG  22           H        ARG  22   2.159 -11.933  -1.032
  303    HA   ARG  22           HA       ARG  22   1.053 -14.048   0.712
  304    HB2  ARG  22           HB2      ARG  22   2.916 -12.177   1.227
  305    HB3  ARG  22           HB1      ARG  22   1.481 -11.283   1.731
  306    HG2  ARG  22           HG2      ARG  22   0.823 -13.258   3.138
  307    HG3  ARG  22           HG1      ARG  22   2.369 -14.002   2.733
  308    HD2  ARG  22           HD2      ARG  22   3.581 -12.516   4.015
  309    HD3  ARG  22           HD1      ARG  22   2.419 -11.209   3.784
  310    HE   ARG  22           HE       ARG  22   1.554 -11.880   5.861
  311   HH11  ARG  22          HH21      ARG  22   3.533 -14.393   4.838
  312   HH12  ARG  22          HH22      ARG  22   2.660 -15.646   5.654
  313   HH21  ARG  22          HH11      ARG  22   0.040 -13.578   6.588
  314   HH22  ARG  22          HH12      ARG  22   0.684 -15.185   6.647
  315    H    GLY  23           H        GLY  23  -0.347 -12.155  -1.458
  316    HA2  GLY  23           HA2      GLY  23  -2.874 -12.191  -1.313
  317    HA3  GLY  23           HA1      GLY  23  -2.680 -11.518   0.306
  318    H    ALA  24           H        ALA  24  -1.799  -9.329   0.484
  319    HA   ALA  24           HA       ALA  24  -1.643  -7.083  -0.182
  320    HB1  ALA  24           HB1      ALA  24  -1.373  -8.205  -2.986
  321    HB2  ALA  24           HB2      ALA  24  -0.028  -8.065  -1.854
  322    HB3  ALA  24           HB3      ALA  24  -0.856  -6.616  -2.423
  323    H    PHE  25           H        PHE  25  -4.179  -8.943  -0.582
  324    HA   PHE  25           HA       PHE  25  -5.706  -6.983  -2.224
  325    HB2  PHE  25           HB2      PHE  25  -7.295  -8.746  -2.681
  326    HB3  PHE  25           HB1      PHE  25  -5.681  -9.374  -3.013
  327    HD1  PHE  25           HD2      PHE  25  -4.550 -10.866  -1.350
  328    HD2  PHE  25           HD1      PHE  25  -8.642  -9.631  -0.902
  329    HE1  PHE  25           HE2      PHE  25  -4.916 -12.679   0.304
  330    HE2  PHE  25           HE1      PHE  25  -9.007 -11.443   0.753
  331    HZ   PHE  25           HZ       PHE  25  -7.144 -12.967   1.355
  332    H    TYR  26           H        TYR  26  -6.851  -5.590  -0.972
  333    HA   TYR  26           HA       TYR  26  -8.011  -6.651   1.576
  334    HB2  TYR  26           HB2      TYR  26  -7.918  -4.103   2.208
  335    HB3  TYR  26           HB1      TYR  26  -6.457  -5.081   2.342
  336    HD1  TYR  26           HD2      TYR  26  -4.864  -5.142   0.313
  337    HD2  TYR  26           HD1      TYR  26  -7.960  -2.203   0.812
  338    HE1  TYR  26           HE2      TYR  26  -3.718  -3.659  -1.312
  339    HE2  TYR  26           HE1      TYR  26  -6.814  -0.720  -0.813
  340    HH   TYR  26           HH       TYR  26  -4.027  -0.636  -1.577
  341    H    THR  27           H        THR  27  -8.638  -5.331  -1.480
  342    HA   THR  27           HA       THR  27 -11.126  -3.966  -0.759
  343    HB   THR  27           HB       THR  27  -9.913  -3.174  -2.709
  344    HG1  THR  27           HG1      THR  27 -12.080  -4.597  -3.794
  345   HG21  THR  27          HG21      THR  27  -8.671  -4.829  -3.676
  346   HG22  THR  27          HG22      THR  27 -10.092  -4.992  -4.709
  347   HG23  THR  27          HG23      THR  27  -9.874  -6.072  -3.331
  348    H    LYS  28           H        LYS  28 -13.225  -4.721  -1.792
  349    HA   LYS  28           HA       LYS  28 -13.503  -7.500  -2.544
  350    HB2  LYS  28           HB2      LYS  28 -14.979  -8.009  -0.475
  351    HB3  LYS  28           HB1      LYS  28 -13.227  -8.079  -0.273
  352    HG2  LYS  28           HG2      LYS  28 -13.175  -5.891   0.725
  353    HG3  LYS  28           HG1      LYS  28 -14.864  -5.600   0.310
  354    HD2  LYS  28           HD2      LYS  28 -14.982  -6.214   2.576
  355    HD3  LYS  28           HD1      LYS  28 -15.341  -7.725   1.738
  356    HE2  LYS  28           HE2      LYS  28 -13.649  -7.951   3.599
  357    HE3  LYS  28           HE1      LYS  28 -13.077  -8.507   2.026
  358    HZ1  LYS  28           HZ1      LYS  28 -11.705  -6.834   3.537
  359    HZ2  LYS  28           HZ2      LYS  28 -12.627  -5.703   2.669
  360    HZ3  LYS  28           HZ3      LYS  28 -11.631  -6.803   1.843
  361    HA   PRO  29           HA       PRO  29 -17.035  -5.135  -4.001
  362    HB2  PRO  29           HB2      PRO  29 -17.677  -6.914  -5.996
  363    HB3  PRO  29           HB1      PRO  29 -16.415  -5.681  -6.151
  364    HG2  PRO  29           HG2      PRO  29 -16.125  -8.622  -5.752
  365    HG3  PRO  29           HG1      PRO  29 -15.010  -7.478  -6.518
  366    HD2  PRO  29           HD2      PRO  29 -14.763  -8.527  -3.902
  367    HD3  PRO  29           HD1      PRO  29 -13.867  -7.143  -4.560
  368    H    THR  30           H        THR  30 -18.461  -5.490  -2.224
  369    HA   THR  30           HA       THR  30 -20.630  -7.295  -2.628
  370    HB   THR  30           HB       THR  30 -19.161  -9.096  -2.024
  371    HG1  THR  30           HG1      THR  30 -20.288  -9.858  -0.344
  372   HG21  THR  30          HG21      THR  30 -18.334  -8.387   0.616
  373   HG22  THR  30          HG22      THR  30 -17.890  -7.069  -0.469
  374   HG23  THR  30          HG23      THR  30 -17.324  -8.708  -0.794
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1 -10.579   5.987   3.349
    2    H2   GLY   1           HT2      GLY   1  -9.462   6.075   4.624
    3    H3   GLY   1           HT3      GLY   1 -10.915   5.218   4.824
    4    HA2  GLY   1           HA1      GLY   1  -9.769   3.419   4.153
    5    HA3  GLY   1           HA2      GLY   1  -9.727   4.114   2.506
    6    H    ILE   2           H        ILE   2  -8.149   2.103   3.191
    7    HA   ILE   2           HA       ILE   2  -6.265   2.299   5.342
    8    HB   ILE   2           HB       ILE   2  -6.620   0.149   4.339
    9   HG12  ILE   2          HG12      ILE   2  -4.339  -0.513   3.713
   10   HG13  ILE   2          HG11      ILE   2  -3.912   1.175   3.427
   11   HG21  ILE   2          HG21      ILE   2  -7.117   0.009   2.150
   12   HG22  ILE   2          HG22      ILE   2  -5.444   0.407   1.758
   13   HG23  ILE   2          HG23      ILE   2  -6.642   1.691   1.919
   14   HD11  ILE   2          HD11      ILE   2  -5.043   1.068   6.020
   15   HD12  ILE   2          HD12      ILE   2  -3.357   1.359   5.600
   16   HD13  ILE   2          HD13      ILE   2  -3.917  -0.283   5.914
   17    H    VAL   3           H        VAL   3  -6.375   3.708   2.156
   18    HA   VAL   3           HA       VAL   3  -3.545   4.602   2.403
   19    HB   VAL   3           HB       VAL   3  -3.669   5.167   0.067
   20   HG11  VAL   3          HG11      VAL   3  -5.085   2.566   0.698
   21   HG12  VAL   3          HG12      VAL   3  -3.362   2.805   0.407
   22   HG13  VAL   3          HG13      VAL   3  -4.514   2.993  -0.915
   23   HG21  VAL   3          HG21      VAL   3  -6.645   4.716   0.419
   24   HG22  VAL   3          HG22      VAL   3  -5.866   4.871  -1.156
   25   HG23  VAL   3          HG23      VAL   3  -5.838   6.220  -0.022
   26    H    GLU   4           H        GLU   4  -6.289   5.623   3.645
   27    HA   GLU   4           HA       GLU   4  -7.013   8.138   2.821
   28    HB2  GLU   4           HB2      GLU   4  -7.427   8.712   5.171
   29    HB3  GLU   4           HB1      GLU   4  -7.878   7.033   4.871
   30    HG2  GLU   4           HG2      GLU   4  -5.244   6.756   5.547
   31    HG3  GLU   4           HG1      GLU   4  -5.713   8.126   6.554
   32    H    GLN   5           H        GLN   5  -3.915   7.246   4.225
   33    HA   GLN   5           HA       GLN   5  -3.104  10.114   4.124
   34    HB2  GLN   5           HB2      GLN   5  -1.007   8.952   5.351
   35    HB3  GLN   5           HB1      GLN   5  -2.432   9.500   6.231
   36    HG2  GLN   5           HG2      GLN   5  -3.408   7.224   6.030
   37    HG3  GLN   5           HG1      GLN   5  -1.942   6.685   5.212
   38   HE21  GLN   5          HE21      GLN   5  -1.657   5.158   7.085
   39   HE22  GLN   5          HE22      GLN   5  -0.990   5.743   8.533
   40    H    CYS   6           H        CYS   6  -1.727   6.888   3.371
   41    HA   CYS   6           HA       CYS   6   0.512   7.736   1.924
   42    HB2  CYS   6           HB2      CYS   6  -1.214   5.397   1.102
   43    HB3  CYS   6           HB1      CYS   6   0.529   5.570   0.900
   44    H    CYS   7           H        CYS   7  -2.854   7.577   0.882
   45    HA   CYS   7           HA       CYS   7  -2.261   8.068  -1.910
   46    HB2  CYS   7           HB2      CYS   7  -4.644   7.748  -0.230
   47    HB3  CYS   7           HB1      CYS   7  -4.855   8.893  -1.548
   48    H    THR   8           H        THR   8  -2.913  10.150   0.876
   49    HA   THR   8           HA       THR   8  -2.884  12.506  -0.955
   50    HB   THR   8           HB       THR   8  -4.698  12.854   0.440
   51    HG1  THR   8           HG1      THR   8  -3.853  14.173   2.266
   52   HG21  THR   8          HG21      THR   8  -3.089  11.555   2.654
   53   HG22  THR   8          HG22      THR   8  -4.422  10.823   1.761
   54   HG23  THR   8          HG23      THR   8  -4.726  12.188   2.835
   55    H    SER   9           H        SER   9  -0.911  10.793   1.268
   56    HA   SER   9           HA       SER   9   1.063  13.023   1.136
   57    HB2  SER   9           HB2      SER   9   1.644  11.851   3.543
   58    HB3  SER   9           HB1      SER   9   0.716  13.332   3.350
   59    HG   SER   9           HG       SER   9  -0.551  11.976   4.530
   60    H    ILE  10           H        ILE  10   3.134  11.773   2.470
   61    HA   ILE  10           HA       ILE  10   3.849   9.668   0.519
   62    HB   ILE  10           HB       ILE  10   5.719  10.642   2.649
   63   HG12  ILE  10          HG12      ILE  10   4.573  12.687   1.827
   64   HG13  ILE  10          HG11      ILE  10   6.250  12.633   1.291
   65   HG21  ILE  10          HG21      ILE  10   6.846  10.676   0.069
   66   HG22  ILE  10          HG22      ILE  10   5.818   9.245   0.115
   67   HG23  ILE  10          HG23      ILE  10   7.093   9.455   1.316
   68   HD11  ILE  10          HD11      ILE  10   4.950  13.256  -0.626
   69   HD12  ILE  10          HD12      ILE  10   3.778  11.973  -0.323
   70   HD13  ILE  10          HD13      ILE  10   5.407  11.568  -0.861
   71    H    CYS  11           H        CYS  11   4.466   7.554   1.183
   72    HA   CYS  11           HA       CYS  11   3.986   6.921   4.062
   73    HB2  CYS  11           HB2      CYS  11   2.502   5.988   1.716
   74    HB3  CYS  11           HB1      CYS  11   3.116   4.667   2.710
   75    H    SER  12           H        SER  12   4.722   4.539   4.455
   76    HA   SER  12           HA       SER  12   7.391   4.213   3.159
   77    HB2  SER  12           HB2      SER  12   7.408   2.554   5.321
   78    HB3  SER  12           HB1      SER  12   7.989   4.216   5.348
   79    HG   SER  12           HG       SER  12   6.416   4.626   6.667
   80    H    LEU  13           H        LEU  13   7.494   2.553   1.704
   81    HA   LEU  13           HA       LEU  13   5.399   0.789   1.154
   82    HB2  LEU  13           HB2      LEU  13   6.947  -0.560  -0.131
   83    HB3  LEU  13           HB1      LEU  13   7.324   1.136  -0.370
   84    HG   LEU  13           HG       LEU  13   9.392  -0.062  -0.102
   85   HD11  LEU  13          HD11      LEU  13   9.183   2.157   1.037
   86   HD12  LEU  13          HD12      LEU  13  10.396   1.099   1.755
   87   HD13  LEU  13          HD13      LEU  13   8.832   1.302   2.537
   88   HD21  LEU  13          HD21      LEU  13   9.733  -1.787   1.332
   89   HD22  LEU  13          HD22      LEU  13   7.974  -1.805   1.468
   90   HD23  LEU  13          HD23      LEU  13   8.943  -0.954   2.671
   91    H    TYR  14           H        TYR  14   7.637   0.674   3.769
   92    HA   TYR  14           HA       TYR  14   7.244  -2.166   4.283
   93    HB2  TYR  14           HB2      TYR  14   8.328  -1.758   6.452
   94    HB3  TYR  14           HB1      TYR  14   9.262  -1.041   5.145
   95    HD1  TYR  14           HD1      TYR  14   6.440  -0.089   7.459
   96    HD2  TYR  14           HD2      TYR  14  10.056   1.111   5.469
   97    HE1  TYR  14           HE1      TYR  14   6.339   2.110   8.597
   98    HE2  TYR  14           HE2      TYR  14   9.954   3.311   6.609
   99    HH   TYR  14           HH       TYR  14   7.258   4.118   8.804
  100    H    GLN  15           H        GLN  15   5.684   0.813   5.163
  101    HA   GLN  15           HA       GLN  15   3.976  -0.388   7.175
  102    HB2  GLN  15           HB2      GLN  15   3.210   1.752   7.500
  103    HB3  GLN  15           HB1      GLN  15   4.690   2.154   6.646
  104    HG2  GLN  15           HG2      GLN  15   3.494   2.383   4.551
  105    HG3  GLN  15           HG1      GLN  15   2.007   1.779   5.282
  106   HE21  GLN  15          HE21      GLN  15   4.420   4.282   6.282
  107   HE22  GLN  15          HE22      GLN  15   3.261   5.492   6.554
  108    H    LEU  16           H        LEU  16   4.030  -0.163   3.742
  109    HA   LEU  16           HA       LEU  16   1.186  -0.575   3.311
  110    HB2  LEU  16           HB2      LEU  16   3.656  -0.706   1.595
  111    HB3  LEU  16           HB1      LEU  16   2.120  -1.314   0.979
  112    HG   LEU  16           HG       LEU  16   2.684   1.148   0.489
  113   HD11  LEU  16          HD11      LEU  16   0.173  -0.029   1.541
  114   HD12  LEU  16          HD12      LEU  16   0.486   0.757  -0.007
  115   HD13  LEU  16          HD13      LEU  16   0.214   1.731   1.438
  116   HD21  LEU  16          HD21      LEU  16   2.042   2.701   2.346
  117   HD22  LEU  16          HD22      LEU  16   3.503   1.778   2.695
  118   HD23  LEU  16          HD23      LEU  16   1.970   1.313   3.433
  119    H    GLU  17           H        GLU  17   3.990  -2.624   3.794
  120    HA   GLU  17           HA       GLU  17   2.882  -5.084   2.847
  121    HB2  GLU  17           HB2      GLU  17   4.517  -5.155   5.345
  122    HB3  GLU  17           HB1      GLU  17   4.665  -6.127   3.882
  123    HG2  GLU  17           HG2      GLU  17   5.247  -3.647   2.917
  124    HG3  GLU  17           HG1      GLU  17   5.895  -3.531   4.552
  125    H    ASN  18           H        ASN  18   2.174  -3.072   5.518
  126    HA   ASN  18           HA       ASN  18   1.013  -4.977   7.317
  127    HB2  ASN  18           HB2      ASN  18   1.446  -2.247   7.337
  128    HB3  ASN  18           HB1      ASN  18  -0.312  -2.359   7.239
  129   HD21  ASN  18          HD21      ASN  18   1.642  -1.707   9.574
  130   HD22  ASN  18          HD22      ASN  18   1.109  -2.722  10.827
  131    H    TYR  19           H        TYR  19  -0.037  -3.751   4.285
  132    HA   TYR  19           HA       TYR  19  -2.862  -4.472   4.813
  133    HB2  TYR  19           HB2      TYR  19  -1.773  -3.526   2.167
  134    HB3  TYR  19           HB1      TYR  19  -3.404  -3.353   2.810
  135    HD1  TYR  19           HD2      TYR  19  -2.211  -2.623   5.685
  136    HD2  TYR  19           HD1      TYR  19  -1.677  -1.086   1.708
  137    HE1  TYR  19           HE2      TYR  19  -1.604  -0.407   6.622
  138    HE2  TYR  19           HE1      TYR  19  -1.071   1.129   2.645
  139    HH   TYR  19           HH       TYR  19  -1.715   2.322   5.105
  140    H    CYS  20           H        CYS  20  -0.479  -6.395   4.524
  141    HA   CYS  20           HA       CYS  20  -1.327  -7.927   2.145
  142    HB2  CYS  20           HB2      CYS  20   0.892  -8.515   4.113
  143    HB3  CYS  20           HB1      CYS  20   0.632  -9.310   2.562
  144    H    ASN  21           H        ASN  21  -0.389  -9.008   5.379
  145    HA   ASN  21           HA       ASN  21  -2.185 -11.258   5.316
  146    HB2  ASN  21           HB2      ASN  21  -0.565  -9.929   7.484
  147    HB3  ASN  21           HB1      ASN  21  -1.661 -11.261   7.853
  148   HD21  ASN  21          HD21      ASN  21   0.653 -12.213   8.423
  149   HD22  ASN  21          HD22      ASN  21   1.430 -13.048   7.167
  150    H1   PHE   1           HT1      PHE   1  12.450   2.886  -1.548
  151    H2   PHE   1           HT2      PHE   1  12.158   1.541  -2.544
  152    H3   PHE   1           HT3      PHE   1  11.530   1.585  -0.966
  153    HA   PHE   1           HA       PHE   1  10.243   2.357  -3.262
  154    HB2  PHE   1           HB2      PHE   1   9.538   1.680  -0.774
  155    HB3  PHE   1           HB1      PHE   1   9.374   3.428  -0.612
  156    HD1  PHE   1           HD1      PHE   1   8.637   0.889  -3.287
  157    HD2  PHE   1           HD2      PHE   1   7.200   4.196  -0.947
  158    HE1  PHE   1           HE1      PHE   1   6.471   0.793  -4.483
  159    HE2  PHE   1           HE2      PHE   1   5.035   4.098  -2.143
  160    HZ   PHE   1           HZ       PHE   1   4.666   2.399  -3.914
  161    H    VAL   2           H        VAL   2   8.997   4.558  -3.375
  162    HA   VAL   2           HA       VAL   2  11.048   6.712  -3.179
  163    HB   VAL   2           HB       VAL   2   9.513   7.901  -4.812
  164   HG11  VAL   2          HG11      VAL   2  10.114   6.265  -6.713
  165   HG12  VAL   2          HG12      VAL   2  10.827   5.258  -5.454
  166   HG13  VAL   2          HG13      VAL   2  11.447   6.883  -5.738
  167   HG21  VAL   2          HG21      VAL   2   8.292   5.230  -5.384
  168   HG22  VAL   2          HG22      VAL   2   7.647   6.845  -5.687
  169   HG23  VAL   2          HG23      VAL   2   7.626   6.179  -4.054
  170    H    ASN   3           H        ASN   3   9.648   8.981  -3.086
  171    HA   ASN   3           HA       ASN   3   7.776   8.661  -0.775
  172    HB2  ASN   3           HB2      ASN   3   8.705  10.861   0.054
  173    HB3  ASN   3           HB1      ASN   3   9.853   9.523   0.107
  174   HD21  ASN   3          HD21      ASN   3  11.545   9.463  -1.592
  175   HD22  ASN   3          HD22      ASN   3  11.962  10.878  -2.433
  176    H    GLN   4           H        GLN   4   5.980   8.847  -2.249
  177    HA   GLN   4           HA       GLN   4   5.257  11.611  -2.827
  178    HB2  GLN   4           HB2      GLN   4   4.748  10.992  -5.277
  179    HB3  GLN   4           HB1      GLN   4   6.435  11.299  -4.865
  180    HG2  GLN   4           HG2      GLN   4   6.991   9.015  -4.899
  181    HG3  GLN   4           HG1      GLN   4   5.312   8.509  -4.709
  182   HE21  GLN   4          HE21      GLN   4   7.777   9.035  -7.022
  183   HE22  GLN   4          HE22      GLN   4   6.806   8.988  -8.414
  184    H    HIS   5           H        HIS   5   2.989  11.628  -3.818
  185    HA   HIS   5           HA       HIS   5   1.299   9.834  -2.297
  186    HB2  HIS   5           HB2      HIS   5   0.365  11.558  -4.592
  187    HB3  HIS   5           HB1      HIS   5  -0.525  11.086  -3.145
  188    HD2  HIS   5           HD2      HIS   5   2.402  13.558  -4.125
  189    HE1  HIS   5           HE1      HIS   5   0.860  14.660  -0.346
  190    HE2  HIS   5           HE2      HIS   5   2.476  15.315  -2.207
  191    H    LEU   6           H        LEU   6   0.187   8.015  -3.021
  192    HA   LEU   6           HA       LEU   6   0.221   7.377  -5.894
  193    HB2  LEU   6           HB2      LEU   6   1.168   5.118  -5.503
  194    HB3  LEU   6           HB1      LEU   6   2.316   6.399  -5.161
  195    HG   LEU   6           HG       LEU   6   2.463   4.693  -3.438
  196   HD11  LEU   6          HD11      LEU   6   2.301   7.330  -2.916
  197   HD12  LEU   6          HD12      LEU   6   2.595   6.121  -1.666
  198   HD13  LEU   6          HD13      LEU   6   0.967   6.752  -1.916
  199   HD21  LEU   6          HD21      LEU   6   0.705   3.662  -2.469
  200   HD22  LEU   6          HD22      LEU   6  -0.217   4.310  -3.823
  201   HD23  LEU   6          HD23      LEU   6  -0.197   5.163  -2.278
  202    H    CYS   7           H        CYS   7  -1.389   5.873  -6.492
  203    HA   CYS   7           HA       CYS   7  -3.072   4.642  -4.413
  204    HB2  CYS   7           HB2      CYS   7  -4.252   6.677  -6.325
  205    HB3  CYS   7           HB1      CYS   7  -5.129   5.753  -5.108
  206    H    GLY   8           H        GLY   8  -5.040   3.570  -5.600
  207    HA2  GLY   8           HA2      GLY   8  -5.765   1.994  -7.163
  208    HA3  GLY   8           HA1      GLY   8  -5.003   3.022  -8.372
  209    H    SER   9           H        SER   9  -4.037   1.487  -9.624
  210    HA   SER   9           HA       SER   9  -2.812  -0.906  -8.804
  211    HB2  SER   9           HB2      SER   9  -3.332   0.012 -11.196
  212    HB3  SER   9           HB1      SER   9  -1.709   0.689 -11.101
  213    HG   SER   9           HG       SER   9  -1.218  -1.260 -11.783
  214    H    ASP  10           H        ASP  10  -1.728   2.322  -8.373
  215    HA   ASP  10           HA       ASP  10   1.102   1.647  -8.231
  216    HB2  ASP  10           HB2      ASP  10  -0.530   4.074  -7.520
  217    HB3  ASP  10           HB1      ASP  10   1.152   3.955  -7.003
  218    H    LEU  11           H        LEU  11  -1.586   1.708  -6.008
  219    HA   LEU  11           HA       LEU  11   0.019   1.580  -3.604
  220    HB2  LEU  11           HB2      LEU  11  -2.810   0.633  -4.156
  221    HB3  LEU  11           HB1      LEU  11  -2.065   0.644  -2.558
  222    HG   LEU  11           HG       LEU  11  -2.035   3.158  -4.183
  223   HD11  LEU  11          HD11      LEU  11  -4.385   2.126  -2.563
  224   HD12  LEU  11          HD12      LEU  11  -4.370   2.425  -4.300
  225   HD13  LEU  11          HD13      LEU  11  -4.231   3.774  -3.172
  226   HD21  LEU  11          HD21      LEU  11  -2.451   2.712  -1.219
  227   HD22  LEU  11          HD22      LEU  11  -1.926   4.189  -2.025
  228   HD23  LEU  11          HD23      LEU  11  -0.848   2.797  -1.946
  229    H    VAL  12           H        VAL  12  -1.081  -0.672  -6.009
  230    HA   VAL  12           HA       VAL  12  -0.180  -2.980  -4.423
  231    HB   VAL  12           HB       VAL  12  -0.654  -4.271  -6.543
  232   HG11  VAL  12          HG11      VAL  12  -3.101  -4.109  -6.264
  233   HG12  VAL  12          HG12      VAL  12  -2.892  -2.599  -5.375
  234   HG13  VAL  12          HG13      VAL  12  -2.271  -4.109  -4.708
  235   HG21  VAL  12          HG21      VAL  12  -2.015  -3.119  -8.258
  236   HG22  VAL  12          HG22      VAL  12  -0.394  -2.441  -8.146
  237   HG23  VAL  12          HG23      VAL  12  -1.757  -1.589  -7.424
  238    H    GLU  13           H        GLU  13   0.838  -1.275  -7.427
  239    HA   GLU  13           HA       GLU  13   3.047  -2.793  -8.111
  240    HB2  GLU  13           HB2      GLU  13   3.810  -0.951  -9.288
  241    HB3  GLU  13           HB1      GLU  13   2.168  -0.405  -8.961
  242    HG2  GLU  13           HG2      GLU  13   3.042   0.729  -6.887
  243    HG3  GLU  13           HG1      GLU  13   4.672   0.318  -7.415
  244    H    ALA  14           H        ALA  14   2.607  -0.617  -5.455
  245    HA   ALA  14           HA       ALA  14   5.293  -0.810  -4.378
  246    HB1  ALA  14           HB1      ALA  14   4.472   0.541  -2.638
  247    HB2  ALA  14           HB2      ALA  14   2.847  -0.133  -2.767
  248    HB3  ALA  14           HB3      ALA  14   3.432   0.997  -3.988
  249    H    LEU  15           H        LEU  15   2.169  -1.981  -3.167
  250    HA   LEU  15           HA       LEU  15   3.226  -3.799  -1.260
  251    HB2  LEU  15           HB2      LEU  15   0.615  -3.296  -2.532
  252    HB3  LEU  15           HB1      LEU  15   0.851  -4.964  -2.008
  253    HG   LEU  15           HG       LEU  15   1.784  -3.019  -0.026
  254   HD11  LEU  15          HD11      LEU  15  -1.202  -3.162  -0.294
  255   HD12  LEU  15          HD12      LEU  15  -0.318  -1.975  -1.253
  256   HD13  LEU  15          HD13      LEU  15  -0.210  -1.943   0.507
  257   HD21  LEU  15          HD21      LEU  15   1.468  -5.442   0.375
  258   HD22  LEU  15          HD22      LEU  15  -0.256  -5.267   0.046
  259   HD23  LEU  15          HD23      LEU  15   0.457  -4.480   1.453
  260    H    TYR  16           H        TYR  16   1.793  -4.547  -4.384
  261    HA   TYR  16           HA       TYR  16   2.148  -7.136  -4.857
  262    HB2  TYR  16           HB2      TYR  16   1.506  -6.048  -6.779
  263    HB3  TYR  16           HB1      TYR  16   2.695  -4.770  -6.584
  264    HD1  TYR  16           HD1      TYR  16   2.607  -8.472  -7.143
  265    HD2  TYR  16           HD2      TYR  16   4.479  -4.717  -8.059
  266    HE1  TYR  16           HE1      TYR  16   4.111  -9.621  -8.752
  267    HE2  TYR  16           HE2      TYR  16   5.985  -5.862  -9.671
  268    HH   TYR  16           HH       TYR  16   5.450  -8.764 -10.948
  269    H    LEU  17           H        LEU  17   5.008  -4.908  -4.937
  270    HA   LEU  17           HA       LEU  17   6.671  -7.368  -5.138
  271    HB2  LEU  17           HB2      LEU  17   8.501  -5.359  -5.218
  272    HB3  LEU  17           HB1      LEU  17   7.719  -6.051  -6.632
  273    HG   LEU  17           HG       LEU  17   5.905  -4.294  -6.349
  274   HD11  LEU  17          HD11      LEU  17   6.828  -3.897  -3.911
  275   HD12  LEU  17          HD12      LEU  17   6.190  -2.540  -4.827
  276   HD13  LEU  17          HD13      LEU  17   7.929  -2.790  -4.721
  277   HD21  LEU  17          HD21      LEU  17   7.060  -3.225  -7.961
  278   HD22  LEU  17          HD22      LEU  17   8.488  -4.154  -7.505
  279   HD23  LEU  17          HD23      LEU  17   8.187  -2.581  -6.768
  280    H    VAL  18           H        VAL  18   5.823  -4.959  -2.757
  281    HA   VAL  18           HA       VAL  18   8.181  -5.434  -1.116
  282    HB   VAL  18           HB       VAL  18   7.099  -4.166   0.593
  283   HG11  VAL  18          HG11      VAL  18   7.041  -3.276  -2.171
  284   HG12  VAL  18          HG12      VAL  18   7.500  -2.382  -0.722
  285   HG13  VAL  18          HG13      VAL  18   5.807  -2.464  -1.210
  286   HG21  VAL  18          HG21      VAL  18   4.968  -5.100   0.840
  287   HG22  VAL  18          HG22      VAL  18   4.599  -4.935  -0.873
  288   HG23  VAL  18          HG23      VAL  18   4.617  -3.511   0.160
  289    H    CYS  19           H        CYS  19   4.918  -6.703  -1.238
  290    HA   CYS  19           HA       CYS  19   5.556  -8.637   0.925
  291    HB2  CYS  19           HB2      CYS  19   3.086  -7.484  -0.217
  292    HB3  CYS  19           HB1      CYS  19   2.987  -9.201   0.173
  293    H    GLY  20           H        GLY  20   3.593  -9.031  -2.027
  294    HA2  GLY  20           HA2      GLY  20   4.009 -10.493  -3.868
  295    HA3  GLY  20           HA1      GLY  20   5.447 -11.089  -3.039
  296    H    GLU  21           H        GLU  21   2.513 -12.075  -4.062
  297    HA   GLU  21           HA       GLU  21   0.977 -13.730  -3.370
  298    HB2  GLU  21           HB2      GLU  21   3.374 -14.798  -3.838
  299    HB3  GLU  21           HB1      GLU  21   3.267 -15.179  -2.120
  300    HG2  GLU  21           HG2      GLU  21   1.459 -16.598  -2.403
  301    HG3  GLU  21           HG1      GLU  21   0.888 -15.751  -3.842
  302    H    ARG  22           H        ARG  22   1.590 -11.590  -1.352
  303    HA   ARG  22           HA       ARG  22   1.150 -13.157   1.153
  304    HB2  ARG  22           HB2      ARG  22   2.995 -11.248   0.780
  305    HB3  ARG  22           HB1      ARG  22   1.638 -10.214   1.231
  306    HG2  ARG  22           HG2      ARG  22   2.007 -10.732   3.387
  307    HG3  ARG  22           HG1      ARG  22   1.606 -12.410   3.022
  308    HD2  ARG  22           HD2      ARG  22   3.886 -12.956   2.562
  309    HD3  ARG  22           HD1      ARG  22   4.358 -11.257   2.532
  310    HE   ARG  22           HE       ARG  22   3.243 -11.983   5.100
  311   HH11  ARG  22          HH21      ARG  22   5.778 -13.364   3.404
  312   HH12  ARG  22          HH22      ARG  22   7.006 -12.969   4.559
  313   HH21  ARG  22          HH11      ARG  22   4.931 -10.949   6.468
  314   HH22  ARG  22          HH12      ARG  22   6.526 -11.603   6.295
  315    H    GLY  23           H        GLY  23  -0.896 -12.535  -0.937
  316    HA2  GLY  23           HA2      GLY  23  -3.203 -12.053  -0.825
  317    HA3  GLY  23           HA1      GLY  23  -2.986 -11.629   0.874
  318    H    ALA  24           H        ALA  24  -4.412 -10.189  -1.359
  319    HA   ALA  24           HA       ALA  24  -3.390  -7.523  -0.704
  320    HB1  ALA  24           HB1      ALA  24  -3.548  -8.204  -3.637
  321    HB2  ALA  24           HB2      ALA  24  -2.052  -8.447  -2.734
  322    HB3  ALA  24           HB3      ALA  24  -2.750  -6.833  -2.866
  323    H    PHE  25           H        PHE  25  -5.890  -9.219  -0.563
  324    HA   PHE  25           HA       PHE  25  -7.704  -7.441  -2.121
  325    HB2  PHE  25           HB2      PHE  25  -9.369  -9.395  -1.440
  326    HB3  PHE  25           HB1      PHE  25  -8.300  -9.565  -2.831
  327    HD1  PHE  25           HD1      PHE  25  -8.752 -10.438   0.749
  328    HD2  PHE  25           HD2      PHE  25  -6.476 -11.126  -2.831
  329    HE1  PHE  25           HE1      PHE  25  -7.673 -12.402   1.813
  330    HE2  PHE  25           HE2      PHE  25  -5.396 -13.090  -1.767
  331    HZ   PHE  25           HZ       PHE  25  -5.995 -13.728   0.555
  332    H    TYR  26           H        TYR  26  -7.209  -5.930  -0.209
  333    HA   TYR  26           HA       TYR  26  -8.555  -6.666   2.309
  334    HB2  TYR  26           HB2      TYR  26  -7.803  -4.413   3.059
  335    HB3  TYR  26           HB1      TYR  26  -6.470  -5.387   2.438
  336    HD1  TYR  26           HD1      TYR  26  -8.758  -2.572   1.698
  337    HD2  TYR  26           HD2      TYR  26  -5.337  -4.816   0.380
  338    HE1  TYR  26           HE1      TYR  26  -8.260  -0.823   0.010
  339    HE2  TYR  26           HE2      TYR  26  -4.840  -3.068  -1.307
  340    HH   TYR  26           HH       TYR  26  -5.288  -0.762  -1.752
  341    H    THR  27           H        THR  27  -9.456  -5.338  -0.660
  342    HA   THR  27           HA       THR  27 -11.492  -3.508   0.396
  343    HB   THR  27           HB       THR  27 -10.398  -3.069  -1.784
  344    HG1  THR  27           HG1      THR  27 -12.702  -2.573  -1.270
  345   HG21  THR  27          HG21      THR  27 -10.474  -4.534  -3.574
  346   HG22  THR  27          HG22      THR  27 -11.960  -5.302  -3.016
  347   HG23  THR  27          HG23      THR  27 -10.424  -5.680  -2.235
  348    H    LYS  28           H        LYS  28 -12.853  -4.829   1.671
  349    HA   LYS  28           HA       LYS  28 -13.954  -7.319   0.688
  350    HB2  LYS  28           HB2      LYS  28 -13.927  -5.906   3.140
  351    HB3  LYS  28           HB1      LYS  28 -15.623  -6.097   2.695
  352    HG2  LYS  28           HG2      LYS  28 -15.564  -8.283   3.220
  353    HG3  LYS  28           HG1      LYS  28 -14.194  -8.539   2.139
  354    HD2  LYS  28           HD2      LYS  28 -13.923  -7.390   4.928
  355    HD3  LYS  28           HD1      LYS  28 -13.736  -9.106   4.562
  356    HE2  LYS  28           HE2      LYS  28 -11.596  -8.719   3.986
  357    HE3  LYS  28           HE1      LYS  28 -12.162  -7.690   2.671
  358    HZ1  LYS  28           HZ1      LYS  28 -11.475  -6.902   5.440
  359    HZ2  LYS  28           HZ2      LYS  28 -12.373  -5.894   4.407
  360    HZ3  LYS  28           HZ3      LYS  28 -10.788  -6.346   3.992
  361    HA   PRO  29           HA       PRO  29 -17.826  -4.662  -0.182
  362    HB2  PRO  29           HB2      PRO  29 -17.595  -1.940   0.123
  363    HB3  PRO  29           HB1      PRO  29 -18.104  -3.032   1.423
  364    HG2  PRO  29           HG2      PRO  29 -15.490  -1.647   1.050
  365    HG3  PRO  29           HG1      PRO  29 -16.260  -2.207   2.544
  366    HD2  PRO  29           HD2      PRO  29 -14.153  -3.507   1.170
  367    HD3  PRO  29           HD1      PRO  29 -15.140  -4.205   2.472
  368    H    THR  30           H        THR  30 -17.632  -5.018  -2.397
  369    HA   THR  30           HA       THR  30 -16.900  -2.799  -4.103
  370    HB   THR  30           HB       THR  30 -14.641  -3.320  -3.929
  371    HG1  THR  30           HG1      THR  30 -14.191  -4.795  -5.742
  372   HG21  THR  30          HG21      THR  30 -14.881  -5.186  -2.385
  373   HG22  THR  30          HG22      THR  30 -13.809  -5.664  -3.702
  374   HG23  THR  30          HG23      THR  30 -15.482  -6.219  -3.682
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1 -10.103   6.712   2.713
    2    H2   GLY   1           HT2      GLY   1 -10.028   5.610   1.422
    3    H3   GLY   1           HT3      GLY   1  -8.598   6.250   2.078
    4    HA2  GLY   1           HA1      GLY   1  -9.674   5.070   4.201
    5    HA3  GLY   1           HA2      GLY   1 -10.263   3.964   2.922
    6    H    ILE   2           H        ILE   2  -8.254   2.599   2.930
    7    HA   ILE   2           HA       ILE   2  -6.412   2.805   5.128
    8    HB   ILE   2           HB       ILE   2  -6.886   0.621   4.251
    9   HG12  ILE   2          HG12      ILE   2  -4.625  -0.205   3.706
   10   HG13  ILE   2          HG11      ILE   2  -4.097   1.448   3.383
   11   HG21  ILE   2          HG21      ILE   2  -5.813   0.330   1.771
   12   HG22  ILE   2          HG22      ILE   2  -6.389   1.993   1.672
   13   HG23  ILE   2          HG23      ILE   2  -7.515   0.692   2.057
   14   HD11  ILE   2          HD11      ILE   2  -3.584   1.638   5.568
   15   HD12  ILE   2          HD12      ILE   2  -4.315   0.072   5.921
   16   HD13  ILE   2          HD13      ILE   2  -5.308   1.528   5.925
   17    H    VAL   3           H        VAL   3  -6.413   4.109   1.915
   18    HA   VAL   3           HA       VAL   3  -3.517   4.774   2.138
   19    HB   VAL   3           HB       VAL   3  -3.592   5.264  -0.223
   20   HG11  VAL   3          HG11      VAL   3  -4.893   2.743   0.726
   21   HG12  VAL   3          HG12      VAL   3  -3.329   2.969  -0.059
   22   HG13  VAL   3          HG13      VAL   3  -4.813   3.049  -1.008
   23   HG21  VAL   3          HG21      VAL   3  -6.590   4.904   0.073
   24   HG22  VAL   3          HG22      VAL   3  -5.756   5.068  -1.471
   25   HG23  VAL   3          HG23      VAL   3  -5.748   6.403  -0.319
   26    H    GLU   4           H        GLU   4  -6.105   6.064   3.377
   27    HA   GLU   4           HA       GLU   4  -6.659   8.586   2.417
   28    HB2  GLU   4           HB2      GLU   4  -6.957   9.319   4.748
   29    HB3  GLU   4           HB1      GLU   4  -7.585   7.685   4.529
   30    HG2  GLU   4           HG2      GLU   4  -4.808   7.488   5.184
   31    HG3  GLU   4           HG1      GLU   4  -5.575   8.561   6.355
   32    H    GLN   5           H        GLN   5  -3.606   7.479   3.723
   33    HA   GLN   5           HA       GLN   5  -2.551  10.261   3.550
   34    HB2  GLN   5           HB2      GLN   5  -0.488   8.835   4.613
   35    HB3  GLN   5           HB1      GLN   5  -1.725   9.640   5.577
   36    HG2  GLN   5           HG2      GLN   5  -3.003   7.600   5.770
   37    HG3  GLN   5           HG1      GLN   5  -1.956   6.775   4.615
   38   HE21  GLN   5          HE21      GLN   5   0.397   6.523   5.316
   39   HE22  GLN   5          HE22      GLN   5   0.726   6.350   6.972
   40    H    CYS   6           H        CYS   6  -1.199   6.990   2.925
   41    HA   CYS   6           HA       CYS   6   0.861   7.642   1.226
   42    HB2  CYS   6           HB2      CYS   6  -1.104   5.391   0.725
   43    HB3  CYS   6           HB1      CYS   6   0.550   5.480   0.122
   44    H    CYS   7           H        CYS   7  -2.572   7.449   0.301
   45    HA   CYS   7           HA       CYS   7  -2.115   8.006  -2.477
   46    HB2  CYS   7           HB2      CYS   7  -4.419   7.772  -0.690
   47    HB3  CYS   7           HB1      CYS   7  -4.642   8.965  -1.965
   48    H    THR   8           H        THR   8  -3.000  10.132   0.267
   49    HA   THR   8           HA       THR   8  -2.868  12.503  -1.454
   50    HB   THR   8           HB       THR   8  -4.435  12.277   0.516
   51    HG1  THR   8           HG1      THR   8  -2.666  14.375   0.061
   52   HG21  THR   8          HG21      THR   8  -1.965  12.858   2.158
   53   HG22  THR   8          HG22      THR   8  -2.626  11.235   1.974
   54   HG23  THR   8          HG23      THR   8  -3.590  12.496   2.740
   55    H    SER   9           H        SER   9  -0.913  11.174   1.233
   56    HA   SER   9           HA       SER   9   1.298  12.960   0.300
   57    HB2  SER   9           HB2      SER   9   1.959  12.356   2.888
   58    HB3  SER   9           HB1      SER   9   1.147  13.831   2.384
   59    HG   SER   9           HG       SER   9   0.225  12.129   4.053
   60    H    ILE  10           H        ILE  10   3.343  11.816   1.825
   61    HA   ILE  10           HA       ILE  10   3.598   9.182   0.465
   62    HB   ILE  10           HB       ILE  10   5.889  10.522   1.851
   63   HG12  ILE  10          HG12      ILE  10   4.589  12.281   0.525
   64   HG13  ILE  10          HG11      ILE  10   6.266  12.048   0.037
   65   HG21  ILE  10          HG21      ILE  10   6.855   9.682  -0.477
   66   HG22  ILE  10          HG22      ILE  10   5.406   8.679  -0.459
   67   HG23  ILE  10          HG23      ILE  10   6.583   8.551   0.848
   68   HD11  ILE  10          HD11      ILE  10   5.689  11.198  -1.990
   69   HD12  ILE  10          HD12      ILE  10   4.141  11.986  -1.687
   70   HD13  ILE  10          HD13      ILE  10   4.343  10.272  -1.324
   71    H    CYS  11           H        CYS  11   4.277   7.336   1.659
   72    HA   CYS  11           HA       CYS  11   4.317   7.633   4.624
   73    HB2  CYS  11           HB2      CYS  11   2.947   5.509   4.749
   74    HB3  CYS  11           HB1      CYS  11   2.066   6.911   4.145
   75    H    SER  12           H        SER  12   4.651   4.938   5.257
   76    HA   SER  12           HA       SER  12   7.332   4.448   4.069
   77    HB2  SER  12           HB2      SER  12   7.119   2.626   6.066
   78    HB3  SER  12           HB1      SER  12   7.709   4.267   6.311
   79    HG   SER  12           HG       SER  12   6.071   3.914   7.771
   80    H    LEU  13           H        LEU  13   7.583   2.826   2.606
   81    HA   LEU  13           HA       LEU  13   5.410   1.268   1.650
   82    HB2  LEU  13           HB2      LEU  13   7.149  -0.078   0.486
   83    HB3  LEU  13           HB1      LEU  13   7.407   1.656   0.290
   84    HG   LEU  13           HG       LEU  13   8.705   0.476   2.666
   85   HD11  LEU  13          HD11      LEU  13   8.877  -1.009   0.329
   86   HD12  LEU  13          HD12      LEU  13  10.028  -1.054   1.665
   87   HD13  LEU  13          HD13      LEU  13  10.323   0.000   0.282
   88   HD21  LEU  13          HD21      LEU  13  10.255   1.926   0.622
   89   HD22  LEU  13          HD22      LEU  13  10.108   2.238   2.351
   90   HD23  LEU  13          HD23      LEU  13   8.864   2.817   1.243
   91    H    TYR  14           H        TYR  14   7.734   0.652   4.206
   92    HA   TYR  14           HA       TYR  14   7.103  -2.152   4.458
   93    HB2  TYR  14           HB2      TYR  14   8.207  -1.991   6.674
   94    HB3  TYR  14           HB1      TYR  14   9.187  -1.268   5.400
   95    HD1  TYR  14           HD1      TYR  14   6.616  -0.393   7.979
   96    HD2  TYR  14           HD2      TYR  14   9.946   0.936   5.613
   97    HE1  TYR  14           HE1      TYR  14   6.640   1.754   9.220
   98    HE2  TYR  14           HE2      TYR  14   9.972   3.083   6.851
   99    HH   TYR  14           HH       TYR  14   8.902   4.359   8.342
  100    H    GLN  15           H        GLN  15   5.671   0.798   5.557
  101    HA   GLN  15           HA       GLN  15   3.984  -0.425   7.565
  102    HB2  GLN  15           HB2      GLN  15   3.233   1.721   7.944
  103    HB3  GLN  15           HB1      GLN  15   4.736   2.105   7.123
  104    HG2  GLN  15           HG2      GLN  15   3.353   3.382   5.821
  105    HG3  GLN  15           HG1      GLN  15   3.114   1.851   4.983
  106   HE21  GLN  15          HE21      GLN  15   1.235   4.263   5.643
  107   HE22  GLN  15          HE22      GLN  15  -0.149   3.511   6.277
  108    H    LEU  16           H        LEU  16   3.891   0.081   4.131
  109    HA   LEU  16           HA       LEU  16   1.069  -0.319   3.728
  110    HB2  LEU  16           HB2      LEU  16   3.532  -0.455   2.021
  111    HB3  LEU  16           HB1      LEU  16   2.040  -1.157   1.399
  112    HG   LEU  16           HG       LEU  16   2.484   1.303   0.833
  113   HD11  LEU  16          HD11      LEU  16  -0.012   1.819   1.727
  114   HD12  LEU  16          HD12      LEU  16   0.017   0.068   1.936
  115   HD13  LEU  16          HD13      LEU  16   0.308   0.771   0.345
  116   HD21  LEU  16          HD21      LEU  16   1.792   2.899   2.612
  117   HD22  LEU  16          HD22      LEU  16   3.259   2.022   3.037
  118   HD23  LEU  16          HD23      LEU  16   1.716   1.558   3.754
  119    H    GLU  17           H        GLU  17   3.834  -2.465   4.085
  120    HA   GLU  17           HA       GLU  17   2.744  -4.884   3.157
  121    HB2  GLU  17           HB2      GLU  17   4.951  -5.122   3.845
  122    HB3  GLU  17           HB1      GLU  17   4.717  -4.138   5.285
  123    HG2  GLU  17           HG2      GLU  17   3.998  -5.908   6.547
  124    HG3  GLU  17           HG1      GLU  17   3.198  -6.688   5.183
  125    H    ASN  18           H        ASN  18   1.864  -2.943   5.879
  126    HA   ASN  18           HA       ASN  18   0.619  -4.862   7.554
  127    HB2  ASN  18           HB2      ASN  18   0.255  -1.930   7.073
  128    HB3  ASN  18           HB1      ASN  18  -0.950  -2.781   8.040
  129   HD21  ASN  18          HD21      ASN  18   0.131  -1.181   9.725
  130   HD22  ASN  18          HD22      ASN  18   1.447  -1.809  10.594
  131    H    TYR  19           H        TYR  19  -0.412  -3.459   4.543
  132    HA   TYR  19           HA       TYR  19  -3.136  -4.583   4.848
  133    HB2  TYR  19           HB2      TYR  19  -2.218  -3.278   2.316
  134    HB3  TYR  19           HB1      TYR  19  -3.788  -3.192   3.115
  135    HD1  TYR  19           HD2      TYR  19  -2.803  -2.558   5.918
  136    HD2  TYR  19           HD1      TYR  19  -1.737  -0.943   2.079
  137    HE1  TYR  19           HE2      TYR  19  -2.133  -0.427   6.999
  138    HE2  TYR  19           HE1      TYR  19  -1.069   1.188   3.162
  139    HH   TYR  19           HH       TYR  19  -1.544   1.708   6.644
  140    H    CYS  20           H        CYS  20  -1.438  -6.656   4.856
  141    HA   CYS  20           HA       CYS  20  -1.537  -7.708   2.068
  142    HB2  CYS  20           HB2      CYS  20   0.551  -7.876   4.184
  143    HB3  CYS  20           HB1      CYS  20   0.293  -9.319   3.202
  144    H    ASN  21           H        ASN  21  -3.757  -7.880   3.809
  145    HA   ASN  21           HA       ASN  21  -3.698 -10.570   5.015
  146    HB2  ASN  21           HB2      ASN  21  -5.676  -8.309   4.926
  147    HB3  ASN  21           HB1      ASN  21  -6.222  -9.928   5.365
  148   HD21  ASN  21          HD21      ASN  21  -6.517  -8.312   7.450
  149   HD22  ASN  21          HD22      ASN  21  -5.253  -8.435   8.577
  150    H1   PHE   1           HT1      PHE   1   9.764   0.098  -2.149
  151    H2   PHE   1           HT2      PHE   1   8.135  -0.311  -2.406
  152    H3   PHE   1           HT3      PHE   1   8.535   1.037  -1.453
  153    HA   PHE   1           HA       PHE   1   9.315   0.854  -4.299
  154    HB2  PHE   1           HB2      PHE   1   7.291   2.370  -4.655
  155    HB3  PHE   1           HB1      PHE   1   6.930   0.670  -4.358
  156    HD1  PHE   1           HD2      PHE   1   6.234  -0.074  -2.056
  157    HD2  PHE   1           HD1      PHE   1   6.594   4.072  -3.131
  158    HE1  PHE   1           HE2      PHE   1   4.875   0.557  -0.078
  159    HE2  PHE   1           HE1      PHE   1   5.237   4.703  -1.152
  160    HZ   PHE   1           HZ       PHE   1   4.376   2.945   0.374
  161    H    VAL   2           H        VAL   2   8.833   3.466  -4.902
  162    HA   VAL   2           HA       VAL   2  10.929   4.825  -3.385
  163    HB   VAL   2           HB       VAL   2  10.360   6.733  -4.972
  164   HG11  VAL   2          HG11      VAL   2  10.920   5.021  -7.026
  165   HG12  VAL   2          HG12      VAL   2  11.379   4.039  -5.635
  166   HG13  VAL   2          HG13      VAL   2  12.125   5.617  -5.885
  167   HG21  VAL   2          HG21      VAL   2   8.826   4.809  -6.631
  168   HG22  VAL   2          HG22      VAL   2   8.629   6.552  -6.458
  169   HG23  VAL   2          HG23      VAL   2   7.977   5.465  -5.233
  170    H    ASN   3           H        ASN   3  10.173   7.413  -3.161
  171    HA   ASN   3           HA       ASN   3   7.857   7.269  -1.276
  172    HB2  ASN   3           HB2      ASN   3  10.311   9.043  -1.305
  173    HB3  ASN   3           HB1      ASN   3   8.922   9.336  -0.255
  174   HD21  ASN   3          HD21      ASN   3  11.101   6.588  -1.145
  175   HD22  ASN   3          HD22      ASN   3  11.183   5.958   0.430
  176    H    GLN   4           H        GLN   4   6.349   7.685  -3.040
  177    HA   GLN   4           HA       GLN   4   6.172  10.573  -3.671
  178    HB2  GLN   4           HB2      GLN   4   5.766  10.141  -6.040
  179    HB3  GLN   4           HB1      GLN   4   7.339   9.485  -5.591
  180    HG2  GLN   4           HG2      GLN   4   6.455   7.248  -5.461
  181    HG3  GLN   4           HG1      GLN   4   4.801   7.834  -5.632
  182   HE21  GLN   4          HE21      GLN   4   4.741   6.335  -7.584
  183   HE22  GLN   4          HE22      GLN   4   5.371   6.900  -9.054
  184    H    HIS   5           H        HIS   5   3.957  10.585  -5.232
  185    HA   HIS   5           HA       HIS   5   1.898   9.555  -3.384
  186    HB2  HIS   5           HB2      HIS   5   1.615  11.244  -5.886
  187    HB3  HIS   5           HB1      HIS   5   0.342  10.913  -4.713
  188    HD2  HIS   5           HD2      HIS   5   3.700  12.971  -4.924
  189    HE1  HIS   5           HE1      HIS   5   1.560  14.181  -1.484
  190    HE2  HIS   5           HE2      HIS   5   3.601  14.652  -2.939
  191    H    LEU   6           H        LEU   6   0.428   7.935  -3.935
  192    HA   LEU   6           HA       LEU   6   0.321   6.919  -6.675
  193    HB2  LEU   6           HB2      LEU   6   1.030   4.644  -6.087
  194    HB3  LEU   6           HB1      LEU   6   2.326   5.793  -5.808
  195    HG   LEU   6           HG       LEU   6   2.270   4.264  -3.946
  196   HD11  LEU   6          HD11      LEU   6   2.357   6.884  -3.580
  197   HD12  LEU   6          HD12      LEU   6   2.314   5.777  -2.209
  198   HD13  LEU   6          HD13      LEU   6   0.838   6.587  -2.732
  199   HD21  LEU   6          HD21      LEU   6  -0.441   4.087  -4.441
  200   HD22  LEU   6          HD22      LEU   6  -0.375   4.959  -2.908
  201   HD23  LEU   6          HD23      LEU   6   0.395   3.381  -3.058
  202    H    CYS   7           H        CYS   7  -1.488   5.531  -7.019
  203    HA   CYS   7           HA       CYS   7  -3.196   4.821  -4.729
  204    HB2  CYS   7           HB2      CYS   7  -4.084   6.805  -6.841
  205    HB3  CYS   7           HB1      CYS   7  -5.177   6.009  -5.709
  206    H    GLY   8           H        GLY   8  -5.248   3.712  -5.594
  207    HA2  GLY   8           HA2      GLY   8  -6.138   1.927  -6.816
  208    HA3  GLY   8           HA1      GLY   8  -5.550   2.795  -8.231
  209    H    SER   9           H        SER   9  -4.548   1.294  -9.454
  210    HA   SER   9           HA       SER   9  -3.331  -1.090  -8.597
  211    HB2  SER   9           HB2      SER   9  -3.803  -0.810 -10.931
  212    HB3  SER   9           HB1      SER   9  -2.810   0.641 -11.023
  213    HG   SER   9           HG       SER   9  -2.069  -1.831 -11.465
  214    H    ASP  10           H        ASP  10  -2.186   2.142  -8.325
  215    HA   ASP  10           HA       ASP  10   0.632   1.411  -8.170
  216    HB2  ASP  10           HB2      ASP  10  -0.575   3.922  -7.026
  217    HB3  ASP  10           HB1      ASP  10   1.042   3.693  -7.693
  218    H    LEU  11           H        LEU  11  -2.045   1.705  -5.953
  219    HA   LEU  11           HA       LEU  11  -0.482   1.720  -3.535
  220    HB2  LEU  11           HB2      LEU  11  -3.257   0.559  -3.921
  221    HB3  LEU  11           HB1      LEU  11  -2.538   1.090  -2.400
  222    HG   LEU  11           HG       LEU  11  -2.823   2.988  -4.726
  223   HD11  LEU  11          HD11      LEU  11  -4.880   2.201  -2.656
  224   HD12  LEU  11          HD12      LEU  11  -5.075   2.294  -4.405
  225   HD13  LEU  11          HD13      LEU  11  -4.916   3.772  -3.455
  226   HD21  LEU  11          HD21      LEU  11  -1.544   3.179  -2.304
  227   HD22  LEU  11          HD22      LEU  11  -3.122   3.870  -1.927
  228   HD23  LEU  11          HD23      LEU  11  -2.147   4.557  -3.222
  229    H    VAL  12           H        VAL  12  -1.583  -0.797  -5.720
  230    HA   VAL  12           HA       VAL  12  -0.650  -2.894  -3.885
  231    HB   VAL  12           HB       VAL  12  -0.879  -4.361  -6.001
  232   HG11  VAL  12          HG11      VAL  12  -3.201  -4.700  -5.528
  233   HG12  VAL  12          HG12      VAL  12  -3.382  -3.047  -4.940
  234   HG13  VAL  12          HG13      VAL  12  -2.432  -4.211  -4.018
  235   HG21  VAL  12          HG21      VAL  12  -0.936  -2.506  -7.612
  236   HG22  VAL  12          HG22      VAL  12  -2.428  -1.913  -6.883
  237   HG23  VAL  12          HG23      VAL  12  -2.405  -3.474  -7.701
  238    H    GLU  13           H        GLU  13   0.484  -1.289  -6.866
  239    HA   GLU  13           HA       GLU  13   2.761  -2.756  -7.448
  240    HB2  GLU  13           HB2      GLU  13   2.453  -0.848  -8.801
  241    HB3  GLU  13           HB1      GLU  13   2.259   0.216  -7.409
  242    HG2  GLU  13           HG2      GLU  13   4.501   0.524  -7.172
  243    HG3  GLU  13           HG1      GLU  13   4.866  -1.162  -7.541
  244    H    ALA  14           H        ALA  14   2.068  -0.762  -4.723
  245    HA   ALA  14           HA       ALA  14   4.735  -0.789  -3.574
  246    HB1  ALA  14           HB1      ALA  14   3.445   1.046  -2.878
  247    HB2  ALA  14           HB2      ALA  14   3.279  -0.055  -1.509
  248    HB3  ALA  14           HB3      ALA  14   1.988   0.067  -2.704
  249    H    LEU  15           H        LEU  15   1.650  -2.286  -2.675
  250    HA   LEU  15           HA       LEU  15   2.897  -4.130  -0.796
  251    HB2  LEU  15           HB2      LEU  15   0.118  -3.701  -1.864
  252    HB3  LEU  15           HB1      LEU  15   0.490  -5.136  -0.908
  253    HG   LEU  15           HG       LEU  15   1.602  -2.775   0.350
  254   HD11  LEU  15          HD11      LEU  15  -0.304  -1.689  -0.883
  255   HD12  LEU  15          HD12      LEU  15  -0.454  -1.596   0.872
  256   HD13  LEU  15          HD13      LEU  15  -1.407  -2.773  -0.032
  257   HD21  LEU  15          HD21      LEU  15   1.229  -4.301   1.980
  258   HD22  LEU  15          HD22      LEU  15   0.081  -5.190   0.978
  259   HD23  LEU  15          HD23      LEU  15  -0.462  -3.803   1.923
  260    H    TYR  16           H        TYR  16   2.837  -4.094  -4.082
  261    HA   TYR  16           HA       TYR  16   2.287  -6.940  -4.543
  262    HB2  TYR  16           HB2      TYR  16   1.550  -5.878  -6.423
  263    HB3  TYR  16           HB1      TYR  16   2.593  -4.487  -6.159
  264    HD1  TYR  16           HD1      TYR  16   2.806  -8.100  -7.137
  265    HD2  TYR  16           HD2      TYR  16   4.373  -4.127  -7.595
  266    HE1  TYR  16           HE1      TYR  16   4.360  -8.917  -8.896
  267    HE2  TYR  16           HE2      TYR  16   5.927  -4.941  -9.355
  268    HH   TYR  16           HH       TYR  16   5.714  -7.237 -11.073
  269    H    LEU  17           H        LEU  17   5.057  -4.740  -4.506
  270    HA   LEU  17           HA       LEU  17   6.849  -7.029  -5.096
  271    HB2  LEU  17           HB2      LEU  17   8.521  -4.884  -4.726
  272    HB3  LEU  17           HB1      LEU  17   7.883  -5.413  -6.276
  273    HG   LEU  17           HG       LEU  17   5.898  -3.900  -5.872
  274   HD11  LEU  17          HD11      LEU  17   7.690  -2.856  -3.660
  275   HD12  LEU  17          HD12      LEU  17   6.175  -3.725  -3.421
  276   HD13  LEU  17          HD13      LEU  17   6.167  -2.135  -4.181
  277   HD21  LEU  17          HD21      LEU  17   7.209  -1.808  -6.365
  278   HD22  LEU  17          HD22      LEU  17   7.640  -3.185  -7.377
  279   HD23  LEU  17          HD23      LEU  17   8.682  -2.720  -6.031
  280    H    VAL  18           H        VAL  18   5.617  -5.300  -2.432
  281    HA   VAL  18           HA       VAL  18   7.906  -5.914  -0.687
  282    HB   VAL  18           HB       VAL  18   6.669  -4.865   1.065
  283   HG11  VAL  18          HG11      VAL  18   7.308  -3.024  -0.130
  284   HG12  VAL  18          HG12      VAL  18   5.571  -2.865  -0.395
  285   HG13  VAL  18          HG13      VAL  18   6.585  -3.623  -1.622
  286   HG21  VAL  18          HG21      VAL  18   4.291  -5.314  -0.740
  287   HG22  VAL  18          HG22      VAL  18   4.236  -4.231   0.651
  288   HG23  VAL  18          HG23      VAL  18   4.548  -5.951   0.884
  289    H    CYS  19           H        CYS  19   4.620  -7.051  -1.240
  290    HA   CYS  19           HA       CYS  19   5.064  -9.308   0.636
  291    HB2  CYS  19           HB2      CYS  19   2.696  -7.955  -0.528
  292    HB3  CYS  19           HB1      CYS  19   2.552  -9.701  -0.322
  293    H    GLY  20           H        GLY  20   3.665  -8.953  -2.648
  294    HA2  GLY  20           HA2      GLY  20   4.611 -10.180  -4.556
  295    HA3  GLY  20           HA1      GLY  20   5.173 -11.410  -3.422
  296    H    GLU  21           H        GLU  21   4.030 -13.247  -3.794
  297    HA   GLU  21           HA       GLU  21   1.163 -13.026  -4.546
  298    HB2  GLU  21           HB2      GLU  21   3.085 -14.582  -5.621
  299    HB3  GLU  21           HB1      GLU  21   2.503 -15.679  -4.368
  300    HG2  GLU  21           HG2      GLU  21   0.140 -15.134  -5.227
  301    HG3  GLU  21           HG1      GLU  21   0.940 -14.441  -6.638
  302    H    ARG  22           H        ARG  22   2.381 -12.679  -1.756
  303    HA   ARG  22           HA       ARG  22   1.185 -14.970  -0.316
  304    HB2  ARG  22           HB2      ARG  22   3.385 -13.482   0.232
  305    HB3  ARG  22           HB1      ARG  22   2.184 -12.615   1.190
  306    HG2  ARG  22           HG2      ARG  22   3.193 -14.377   2.552
  307    HG3  ARG  22           HG1      ARG  22   1.503 -14.772   2.235
  308    HD2  ARG  22           HD2      ARG  22   2.153 -16.724   1.327
  309    HD3  ARG  22           HD1      ARG  22   3.026 -15.831   0.080
  310    HE   ARG  22           HE       ARG  22   5.010 -15.877   1.604
  311   HH11  ARG  22          HH21      ARG  22   3.376 -16.741   4.041
  312   HH12  ARG  22          HH22      ARG  22   3.830 -18.408   4.166
  313   HH21  ARG  22          HH11      ARG  22   5.159 -18.562   0.968
  314   HH22  ARG  22          HH12      ARG  22   4.839 -19.438   2.427
  315    H    GLY  23           H        GLY  23   0.098 -12.092  -1.609
  316    HA2  GLY  23           HA2      GLY  23  -2.489 -12.053  -0.975
  317    HA3  GLY  23           HA1      GLY  23  -1.825 -11.537   0.577
  318    H    ALA  24           H        ALA  24  -3.513  -9.838  -0.866
  319    HA   ALA  24           HA       ALA  24  -2.095  -7.408  -0.898
  320    HB1  ALA  24           HB1      ALA  24  -1.866  -8.975  -3.387
  321    HB2  ALA  24           HB2      ALA  24  -0.867  -7.646  -2.798
  322    HB3  ALA  24           HB3      ALA  24  -2.390  -7.309  -3.622
  323    H    PHE  25           H        PHE  25  -4.649  -8.376  -0.122
  324    HA   PHE  25           HA       PHE  25  -6.344  -6.445  -1.580
  325    HB2  PHE  25           HB2      PHE  25  -8.193  -8.100  -1.747
  326    HB3  PHE  25           HB1      PHE  25  -6.790  -8.576  -2.703
  327    HD1  PHE  25           HD1      PHE  25  -8.327  -9.031   0.684
  328    HD2  PHE  25           HD2      PHE  25  -5.808 -10.682  -2.382
  329    HE1  PHE  25           HE1      PHE  25  -8.184 -11.160   1.949
  330    HE2  PHE  25           HE2      PHE  25  -5.664 -12.812  -1.116
  331    HZ   PHE  25           HZ       PHE  25  -6.851 -13.051   1.049
  332    H    TYR  26           H        TYR  26  -8.199  -5.770  -0.310
  333    HA   TYR  26           HA       TYR  26  -8.232  -6.713   2.505
  334    HB2  TYR  26           HB2      TYR  26  -8.665  -4.054   2.876
  335    HB3  TYR  26           HB1      TYR  26  -7.093  -4.822   3.075
  336    HD1  TYR  26           HD2      TYR  26  -5.439  -4.794   1.189
  337    HD2  TYR  26           HD1      TYR  26  -9.101  -2.552   1.058
  338    HE1  TYR  26           HE2      TYR  26  -4.528  -3.417  -0.664
  339    HE2  TYR  26           HE1      TYR  26  -8.194  -1.175  -0.795
  340    HH   TYR  26           HH       TYR  26  -6.478  -0.821  -2.151
  341    H    THR  27           H        THR  27  -9.785  -4.414   0.291
  342    HA   THR  27           HA       THR  27 -12.384  -5.705   0.794
  343    HB   THR  27           HB       THR  27 -12.019  -3.927   2.599
  344    HG1  THR  27           HG1      THR  27 -14.168  -3.443   0.822
  345   HG21  THR  27          HG21      THR  27 -12.239  -2.166   0.145
  346   HG22  THR  27          HG22      THR  27 -10.911  -2.221   1.303
  347   HG23  THR  27          HG23      THR  27 -12.479  -1.582   1.791
  348    H    LYS  28           H        LYS  28 -14.050  -4.882  -0.719
  349    HA   LYS  28           HA       LYS  28 -12.921  -3.366  -3.025
  350    HB2  LYS  28           HB2      LYS  28 -13.946  -6.144  -2.979
  351    HB3  LYS  28           HB1      LYS  28 -14.547  -5.136  -4.296
  352    HG2  LYS  28           HG2      LYS  28 -12.228  -4.545  -4.904
  353    HG3  LYS  28           HG1      LYS  28 -11.627  -5.561  -3.592
  354    HD2  LYS  28           HD2      LYS  28 -12.425  -7.550  -4.628
  355    HD3  LYS  28           HD1      LYS  28 -13.424  -6.647  -5.766
  356    HE2  LYS  28           HE2      LYS  28 -11.695  -6.328  -7.192
  357    HE3  LYS  28           HE1      LYS  28 -10.593  -5.896  -5.886
  358    HZ1  LYS  28           HZ1      LYS  28 -11.234  -8.554  -6.968
  359    HZ2  LYS  28           HZ2      LYS  28 -10.707  -8.407  -5.360
  360    HZ3  LYS  28           HZ3      LYS  28  -9.718  -7.869  -6.634
  361    HA   PRO  29           HA       PRO  29 -16.931  -1.535  -1.979
  362    HB2  PRO  29           HB2      PRO  29 -16.242   0.962  -2.900
  363    HB3  PRO  29           HB1      PRO  29 -15.850   0.375  -1.275
  364    HG2  PRO  29           HG2      PRO  29 -14.055   0.706  -3.636
  365    HG3  PRO  29           HG1      PRO  29 -13.659   0.755  -1.909
  366    HD2  PRO  29           HD2      PRO  29 -13.203  -1.429  -3.646
  367    HD3  PRO  29           HD1      PRO  29 -13.143  -1.479  -1.872
  368    H    THR  30           H        THR  30 -18.321  -2.385  -3.540
  369    HA   THR  30           HA       THR  30 -18.413  -0.978  -6.138
  370    HB   THR  30           HB       THR  30 -18.352  -2.972  -7.471
  371    HG1  THR  30           HG1      THR  30 -18.720  -4.163  -4.988
  372   HG21  THR  30          HG21      THR  30 -16.182  -3.319  -5.390
  373   HG22  THR  30          HG22      THR  30 -16.154  -2.053  -6.617
  374   HG23  THR  30          HG23      THR  30 -16.107  -3.749  -7.099
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1 -10.943   4.891   6.118
    2    H2   GLY   1           HT2      GLY   1 -11.183   5.933   4.798
    3    H3   GLY   1           HT3      GLY   1  -9.746   6.018   5.699
    4    HA2  GLY   1           HA1      GLY   1 -10.075   3.442   4.657
    5    HA3  GLY   1           HA2      GLY   1 -10.170   4.618   3.312
    6    H    ILE   2           H        ILE   2  -8.311   3.000   2.899
    7    HA   ILE   2           HA       ILE   2  -6.240   2.712   5.013
    8    HB   ILE   2           HB       ILE   2  -7.244   0.743   3.610
    9   HG12  ILE   2          HG12      ILE   2  -5.429   0.357   5.126
   10   HG13  ILE   2          HG11      ILE   2  -4.945  -0.350   3.585
   11   HG21  ILE   2          HG21      ILE   2  -5.171   1.849   1.691
   12   HG22  ILE   2          HG22      ILE   2  -6.911   1.802   1.407
   13   HG23  ILE   2          HG23      ILE   2  -5.996   0.299   1.528
   14   HD11  ILE   2          HD11      ILE   2  -3.839   1.936   3.104
   15   HD12  ILE   2          HD12      ILE   2  -3.048   0.878   4.271
   16   HD13  ILE   2          HD13      ILE   2  -4.021   2.235   4.832
   17    H    VAL   3           H        VAL   3  -6.636   3.754   1.632
   18    HA   VAL   3           HA       VAL   3  -3.864   4.614   1.401
   19    HB   VAL   3           HB       VAL   3  -4.494   5.468  -0.753
   20   HG11  VAL   3          HG11      VAL   3  -4.451   3.026  -0.612
   21   HG12  VAL   3          HG12      VAL   3  -5.732   3.535  -1.713
   22   HG13  VAL   3          HG13      VAL   3  -6.131   3.007  -0.078
   23   HG21  VAL   3          HG21      VAL   3  -6.449   6.753  -0.196
   24   HG22  VAL   3          HG22      VAL   3  -7.314   5.314   0.341
   25   HG23  VAL   3          HG23      VAL   3  -6.958   5.540  -1.371
   26    H    GLU   4           H        GLU   4  -6.376   5.830   3.171
   27    HA   GLU   4           HA       GLU   4  -6.716   8.503   2.789
   28    HB2  GLU   4           HB2      GLU   4  -6.850   8.806   5.184
   29    HB3  GLU   4           HB1      GLU   4  -7.462   7.195   4.808
   30    HG2  GLU   4           HG2      GLU   4  -5.175   6.280   5.305
   31    HG3  GLU   4           HG1      GLU   4  -4.704   7.892   5.847
   32    H    GLN   5           H        GLN   5  -3.662   6.981   3.652
   33    HA   GLN   5           HA       GLN   5  -2.418   9.686   3.775
   34    HB2  GLN   5           HB2      GLN   5  -0.405   8.016   4.516
   35    HB3  GLN   5           HB1      GLN   5  -1.544   8.730   5.656
   36    HG2  GLN   5           HG2      GLN   5  -2.876   6.759   5.722
   37    HG3  GLN   5           HG1      GLN   5  -2.096   6.090   4.289
   38   HE21  GLN   5          HE21      GLN   5  -0.958   7.386   7.473
   39   HE22  GLN   5          HE22      GLN   5   0.108   6.100   7.773
   40    H    CYS   6           H        CYS   6  -1.134   6.506   2.754
   41    HA   CYS   6           HA       CYS   6   0.781   7.286   0.974
   42    HB2  CYS   6           HB2      CYS   6  -1.245   5.076   0.546
   43    HB3  CYS   6           HB1      CYS   6   0.234   5.260  -0.396
   44    H    CYS   7           H        CYS   7  -2.709   7.342   0.308
   45    HA   CYS   7           HA       CYS   7  -2.370   8.131  -2.455
   46    HB2  CYS   7           HB2      CYS   7  -4.599   7.721  -0.599
   47    HB3  CYS   7           HB1      CYS   7  -4.868   9.021  -1.750
   48    H    THR   8           H        THR   8  -3.085   9.935   0.551
   49    HA   THR   8           HA       THR   8  -2.956  12.480  -0.935
   50    HB   THR   8           HB       THR   8  -4.606  12.104   0.923
   51    HG1  THR   8           HG1      THR   8  -4.443  14.184   0.893
   52   HG21  THR   8          HG21      THR   8  -3.852  12.052   3.205
   53   HG22  THR   8          HG22      THR   8  -2.182  12.345   2.719
   54   HG23  THR   8          HG23      THR   8  -2.955  10.806   2.337
   55    H    SER   9           H        SER   9  -1.131  10.885   1.701
   56    HA   SER   9           HA       SER   9   1.102  12.781   1.107
   57    HB2  SER   9           HB2      SER   9   1.729  11.675   3.533
   58    HB3  SER   9           HB1      SER   9   0.910  13.216   3.319
   59    HG   SER   9           HG       SER   9  -0.290  11.884   4.691
   60    H    ILE  10           H        ILE  10   3.146  11.415   2.376
   61    HA   ILE  10           HA       ILE  10   3.495   9.120   0.525
   62    HB   ILE  10           HB       ILE  10   5.667  10.198   2.296
   63   HG12  ILE  10          HG12      ILE  10   4.400  12.132   1.208
   64   HG13  ILE  10          HG11      ILE  10   6.110  12.022   0.800
   65   HG21  ILE  10          HG21      ILE  10   6.794   9.802  -0.088
   66   HG22  ILE  10          HG22      ILE  10   5.394   8.751  -0.307
   67   HG23  ILE  10          HG23      ILE  10   6.514   8.463   1.026
   68   HD11  ILE  10          HD11      ILE  10   5.480  10.757  -1.271
   69   HD12  ILE  10          HD12      ILE  10   4.856  12.406  -1.244
   70   HD13  ILE  10          HD13      ILE  10   3.785  11.053  -0.884
   71    H    CYS  11           H        CYS  11   4.882   7.281   1.541
   72    HA   CYS  11           HA       CYS  11   4.538   6.846   4.406
   73    HB2  CYS  11           HB2      CYS  11   3.230   4.645   3.887
   74    HB3  CYS  11           HB1      CYS  11   2.338   6.165   3.947
   75    H    SER  12           H        SER  12   5.589   4.819   5.077
   76    HA   SER  12           HA       SER  12   7.886   4.207   3.376
   77    HB2  SER  12           HB2      SER  12   7.996   2.406   5.425
   78    HB3  SER  12           HB1      SER  12   8.654   4.038   5.506
   79    HG   SER  12           HG       SER  12   6.856   4.709   6.560
   80    H    LEU  13           H        LEU  13   8.013   2.518   1.970
   81    HA   LEU  13           HA       LEU  13   5.812   0.936   1.241
   82    HB2  LEU  13           HB2      LEU  13   7.441  -0.518   0.086
   83    HB3  LEU  13           HB1      LEU  13   7.827   1.186  -0.162
   84    HG   LEU  13           HG       LEU  13   9.055  -0.123   2.210
   85   HD11  LEU  13          HD11      LEU  13   9.187  -1.436  -0.249
   86   HD12  LEU  13          HD12      LEU  13  10.296  -1.649   1.107
   87   HD13  LEU  13          HD13      LEU  13  10.682  -0.504  -0.178
   88   HD21  LEU  13          HD21      LEU  13  10.992   1.236   0.834
   89   HD22  LEU  13          HD22      LEU  13   9.938   1.973   2.041
   90   HD23  LEU  13          HD23      LEU  13   9.543   2.104   0.327
   91    H    TYR  14           H        TYR  14   8.104   0.484   3.832
   92    HA   TYR  14           HA       TYR  14   7.357  -2.300   4.267
   93    HB2  TYR  14           HB2      TYR  14   8.600  -2.081   6.417
   94    HB3  TYR  14           HB1      TYR  14   9.557  -1.590   5.024
   95    HD1  TYR  14           HD1      TYR  14   7.403  -0.263   7.773
   96    HD2  TYR  14           HD2      TYR  14  10.484   0.576   4.896
   97    HE1  TYR  14           HE1      TYR  14   7.788   1.948   8.828
   98    HE2  TYR  14           HE2      TYR  14  10.867   2.789   5.948
   99    HH   TYR  14           HH       TYR  14   9.191   3.720   8.929
  100    H    GLN  15           H        GLN  15   6.148   0.795   5.206
  101    HA   GLN  15           HA       GLN  15   4.537  -0.206   7.406
  102    HB2  GLN  15           HB2      GLN  15   3.993   1.993   7.726
  103    HB3  GLN  15           HB1      GLN  15   5.368   2.271   6.674
  104    HG2  GLN  15           HG2      GLN  15   3.945   2.539   4.750
  105    HG3  GLN  15           HG1      GLN  15   2.531   1.993   5.648
  106   HE21  GLN  15          HE21      GLN  15   1.457   4.086   5.208
  107   HE22  GLN  15          HE22      GLN  15   1.911   5.479   6.066
  108    H    LEU  16           H        LEU  16   4.330  -0.008   3.971
  109    HA   LEU  16           HA       LEU  16   1.451  -0.300   3.749
  110    HB2  LEU  16           HB2      LEU  16   3.786  -0.610   1.869
  111    HB3  LEU  16           HB1      LEU  16   2.179  -1.141   1.379
  112    HG   LEU  16           HG       LEU  16   2.878   1.277   0.787
  113   HD11  LEU  16          HD11      LEU  16   0.457   1.944   1.938
  114   HD12  LEU  16          HD12      LEU  16   0.364   0.187   1.828
  115   HD13  LEU  16          HD13      LEU  16   0.658   1.147   0.377
  116   HD21  LEU  16          HD21      LEU  16   2.305   1.541   3.754
  117   HD22  LEU  16          HD22      LEU  16   2.374   2.901   2.634
  118   HD23  LEU  16          HD23      LEU  16   3.814   1.931   2.930
  119    H    GLU  17           H        GLU  17   4.189  -2.453   4.105
  120    HA   GLU  17           HA       GLU  17   3.057  -4.896   3.267
  121    HB2  GLU  17           HB2      GLU  17   5.260  -5.196   3.878
  122    HB3  GLU  17           HB1      GLU  17   5.148  -4.069   5.227
  123    HG2  GLU  17           HG2      GLU  17   4.160  -5.689   6.644
  124    HG3  GLU  17           HG1      GLU  17   3.757  -6.748   5.292
  125    H    ASN  18           H        ASN  18   2.247  -2.863   5.933
  126    HA   ASN  18           HA       ASN  18   1.062  -4.758   7.698
  127    HB2  ASN  18           HB2      ASN  18   1.454  -2.068   7.775
  128    HB3  ASN  18           HB1      ASN  18  -0.279  -2.131   7.456
  129   HD21  ASN  18          HD21      ASN  18  -0.634  -4.725   8.890
  130   HD22  ASN  18          HD22      ASN  18  -0.500  -4.363  10.543
  131    H    TYR  19           H        TYR  19  -0.011  -3.473   4.665
  132    HA   TYR  19           HA       TYR  19  -2.732  -4.607   5.112
  133    HB2  TYR  19           HB2      TYR  19  -2.136  -3.137   2.599
  134    HB3  TYR  19           HB1      TYR  19  -3.559  -3.060   3.636
  135    HD1  TYR  19           HD2      TYR  19  -2.606  -2.351   6.239
  136    HD2  TYR  19           HD1      TYR  19  -1.177  -1.017   2.412
  137    HE1  TYR  19           HE2      TYR  19  -1.729  -0.282   7.288
  138    HE2  TYR  19           HE1      TYR  19  -0.300   1.052   3.462
  139    HH   TYR  19           HH       TYR  19   0.080   2.121   5.380
  140    H    CYS  20           H        CYS  20  -0.253  -6.171   4.554
  141    HA   CYS  20           HA       CYS  20  -0.221  -7.058   1.837
  142    HB2  CYS  20           HB2      CYS  20   0.618  -8.353   4.433
  143    HB3  CYS  20           HB1      CYS  20   0.803  -9.169   2.881
  144    H    ASN  21           H        ASN  21  -2.557  -7.468   4.272
  145    HA   ASN  21           HA       ASN  21  -3.582 -10.000   3.120
  146    HB2  ASN  21           HB2      ASN  21  -4.354  -8.349   5.531
  147    HB3  ASN  21           HB1      ASN  21  -5.318  -9.717   4.976
  148   HD21  ASN  21          HD21      ASN  21  -2.957  -8.976   7.180
  149   HD22  ASN  21          HD22      ASN  21  -2.178 -10.480   7.283
  150    H1   PHE   1           HT1      PHE   1   8.930  -0.598  -2.747
  151    H2   PHE   1           HT2      PHE   1   8.881   0.678  -1.627
  152    H3   PHE   1           HT3      PHE   1  10.374   0.045  -2.136
  153    HA   PHE   1           HA       PHE   1  10.105   0.904  -4.320
  154    HB2  PHE   1           HB2      PHE   1   7.993   2.307  -4.740
  155    HB3  PHE   1           HB1      PHE   1   7.789   0.555  -4.734
  156    HD1  PHE   1           HD2      PHE   1   6.974  -0.583  -2.612
  157    HD2  PHE   1           HD1      PHE   1   6.872   3.680  -3.157
  158    HE1  PHE   1           HE2      PHE   1   5.327  -0.386  -0.767
  159    HE2  PHE   1           HE1      PHE   1   5.226   3.876  -1.310
  160    HZ   PHE   1           HZ       PHE   1   4.454   1.844  -0.115
  161    H    VAL   2           H        VAL   2   9.461   3.515  -4.727
  162    HA   VAL   2           HA       VAL   2  11.211   4.871  -2.818
  163    HB   VAL   2           HB       VAL   2  10.970   6.799  -4.278
  164   HG11  VAL   2          HG11      VAL   2  11.029   4.296  -5.987
  165   HG12  VAL   2          HG12      VAL   2  12.388   4.835  -4.999
  166   HG13  VAL   2          HG13      VAL   2  11.812   5.839  -6.330
  167   HG21  VAL   2          HG21      VAL   2   9.408   6.612  -6.253
  168   HG22  VAL   2          HG22      VAL   2   8.589   6.731  -4.695
  169   HG23  VAL   2          HG23      VAL   2   8.727   5.169  -5.501
  170    H    ASN   3           H        ASN   3  10.177   7.348  -2.445
  171    HA   ASN   3           HA       ASN   3   7.630   6.797  -0.976
  172    HB2  ASN   3           HB2      ASN   3   9.941   8.638  -0.319
  173    HB3  ASN   3           HB1      ASN   3   8.385   8.717   0.508
  174   HD21  ASN   3          HD21      ASN   3  10.038   8.102   2.377
  175   HD22  ASN   3          HD22      ASN   3  10.230   6.439   2.661
  176    H    GLN   4           H        GLN   4   6.222   7.495  -2.647
  177    HA   GLN   4           HA       GLN   4   6.154  10.428  -3.008
  178    HB2  GLN   4           HB2      GLN   4   6.113  10.362  -5.359
  179    HB3  GLN   4           HB1      GLN   4   7.376   9.203  -4.954
  180    HG2  GLN   4           HG2      GLN   4   4.488   8.536  -5.609
  181    HG3  GLN   4           HG1      GLN   4   5.881   8.256  -6.653
  182   HE21  GLN   4          HE21      GLN   4   6.911   6.255  -6.423
  183   HE22  GLN   4          HE22      GLN   4   6.682   5.197  -5.116
  184    H    HIS   5           H        HIS   5   3.998  10.686  -4.614
  185    HA   HIS   5           HA       HIS   5   1.840   9.593  -2.943
  186    HB2  HIS   5           HB2      HIS   5   1.753  11.414  -5.364
  187    HB3  HIS   5           HB1      HIS   5   0.368  11.007  -4.354
  188    HD2  HIS   5           HD2      HIS   5   3.869  12.823  -3.853
  189    HE1  HIS   5           HE1      HIS   5   1.116  14.227  -0.966
  190    HE2  HIS   5           HE2      HIS   5   3.477  14.494  -1.897
  191    H    LEU   6           H        LEU   6   0.451   7.955  -3.567
  192    HA   LEU   6           HA       LEU   6   0.392   7.091  -6.368
  193    HB2  LEU   6           HB2      LEU   6   1.008   4.756  -5.820
  194    HB3  LEU   6           HB1      LEU   6   2.332   5.872  -5.546
  195    HG   LEU   6           HG       LEU   6   2.222   4.278  -3.711
  196   HD11  LEU   6          HD11      LEU   6   2.461   6.928  -3.363
  197   HD12  LEU   6          HD12      LEU   6   2.521   5.787  -2.020
  198   HD13  LEU   6          HD13      LEU   6   1.026   6.649  -2.376
  199   HD21  LEU   6          HD21      LEU   6  -0.368   5.218  -2.661
  200   HD22  LEU   6          HD22      LEU   6   0.314   3.594  -2.694
  201   HD23  LEU   6          HD23      LEU   6  -0.475   4.245  -4.129
  202    H    CYS   7           H        CYS   7  -1.396   5.658  -6.817
  203    HA   CYS   7           HA       CYS   7  -3.229   4.996  -4.608
  204    HB2  CYS   7           HB2      CYS   7  -3.938   6.991  -6.773
  205    HB3  CYS   7           HB1      CYS   7  -5.138   6.187  -5.763
  206    H    GLY   8           H        GLY   8  -5.307   3.987  -5.646
  207    HA2  GLY   8           HA2      GLY   8  -6.149   2.180  -6.874
  208    HA3  GLY   8           HA1      GLY   8  -5.421   2.988  -8.259
  209    H    SER   9           H        SER   9  -4.428   1.368  -9.353
  210    HA   SER   9           HA       SER   9  -3.313  -0.989  -8.279
  211    HB2  SER   9           HB2      SER   9  -3.761  -0.274 -10.764
  212    HB3  SER   9           HB1      SER   9  -2.102   0.315 -10.700
  213    HG   SER   9           HG       SER   9  -3.010  -2.312 -10.102
  214    H    ASP  10           H        ASP  10  -2.131   2.225  -8.128
  215    HA   ASP  10           HA       ASP  10   0.671   1.514  -7.900
  216    HB2  ASP  10           HB2      ASP  10  -0.571   4.009  -6.766
  217    HB3  ASP  10           HB1      ASP  10   1.055   3.796  -7.412
  218    H    LEU  11           H        LEU  11  -1.995   1.992  -5.648
  219    HA   LEU  11           HA       LEU  11  -0.441   1.895  -3.246
  220    HB2  LEU  11           HB2      LEU  11  -3.227   0.759  -3.611
  221    HB3  LEU  11           HB1      LEU  11  -2.494   1.297  -2.103
  222    HG   LEU  11           HG       LEU  11  -2.520   3.322  -4.250
  223   HD11  LEU  11          HD11      LEU  11  -4.934   3.845  -3.825
  224   HD12  LEU  11          HD12      LEU  11  -5.071   2.317  -2.955
  225   HD13  LEU  11          HD13      LEU  11  -4.699   2.319  -4.677
  226   HD21  LEU  11          HD21      LEU  11  -1.959   4.339  -2.284
  227   HD22  LEU  11          HD22      LEU  11  -2.729   3.091  -1.309
  228   HD23  LEU  11          HD23      LEU  11  -3.699   4.380  -2.021
  229    H    VAL  12           H        VAL  12  -1.657  -0.564  -5.421
  230    HA   VAL  12           HA       VAL  12  -0.745  -2.720  -3.648
  231    HB   VAL  12           HB       VAL  12  -1.192  -4.181  -5.697
  232   HG11  VAL  12          HG11      VAL  12  -3.696  -3.939  -5.385
  233   HG12  VAL  12          HG12      VAL  12  -3.351  -2.539  -4.368
  234   HG13  VAL  12          HG13      VAL  12  -2.766  -4.135  -3.900
  235   HG21  VAL  12          HG21      VAL  12  -2.424  -1.589  -6.673
  236   HG22  VAL  12          HG22      VAL  12  -2.681  -3.172  -7.402
  237   HG23  VAL  12          HG23      VAL  12  -1.074  -2.452  -7.411
  238    H    GLU  13           H        GLU  13   0.315  -1.222  -6.720
  239    HA   GLU  13           HA       GLU  13   2.502  -2.802  -7.344
  240    HB2  GLU  13           HB2      GLU  13   2.131  -0.899  -8.732
  241    HB3  GLU  13           HB1      GLU  13   2.212   0.208  -7.360
  242    HG2  GLU  13           HG2      GLU  13   4.440   0.414  -7.587
  243    HG3  GLU  13           HG1      GLU  13   4.647  -1.336  -7.525
  244    H    ALA  14           H        ALA  14   2.092  -0.517  -4.766
  245    HA   ALA  14           HA       ALA  14   4.766  -0.650  -3.692
  246    HB1  ALA  14           HB1      ALA  14   3.235   0.089  -1.577
  247    HB2  ALA  14           HB2      ALA  14   2.132   0.463  -2.902
  248    HB3  ALA  14           HB3      ALA  14   3.726   1.213  -2.845
  249    H    LEU  15           H        LEU  15   1.680  -2.079  -2.676
  250    HA   LEU  15           HA       LEU  15   2.893  -3.809  -0.700
  251    HB2  LEU  15           HB2      LEU  15   0.187  -3.426  -1.882
  252    HB3  LEU  15           HB1      LEU  15   0.519  -5.010  -1.179
  253    HG   LEU  15           HG       LEU  15   1.545  -3.002   0.593
  254   HD11  LEU  15          HD11      LEU  15  -0.957  -2.294  -0.763
  255   HD12  LEU  15          HD12      LEU  15   0.081  -1.304   0.262
  256   HD13  LEU  15          HD13      LEU  15  -1.123  -2.366   0.991
  257   HD21  LEU  15          HD21      LEU  15  -0.715  -4.110   1.760
  258   HD22  LEU  15          HD22      LEU  15   0.907  -4.801   1.814
  259   HD23  LEU  15          HD23      LEU  15  -0.236  -5.331   0.581
  260    H    TYR  16           H        TYR  16   1.262  -4.556  -3.724
  261    HA   TYR  16           HA       TYR  16   1.595  -7.108  -4.303
  262    HB2  TYR  16           HB2      TYR  16   0.923  -5.975  -6.178
  263    HB3  TYR  16           HB1      TYR  16   2.093  -4.682  -5.947
  264    HD1  TYR  16           HD1      TYR  16   2.024  -8.357  -6.705
  265    HD2  TYR  16           HD2      TYR  16   3.882  -4.552  -7.428
  266    HE1  TYR  16           HE1      TYR  16   3.503  -9.405  -8.401
  267    HE2  TYR  16           HE2      TYR  16   5.362  -5.598  -9.126
  268    HH   TYR  16           HH       TYR  16   6.007  -8.680  -9.353
  269    H    LEU  17           H        LEU  17   4.478  -4.927  -4.320
  270    HA   LEU  17           HA       LEU  17   6.119  -7.370  -4.734
  271    HB2  LEU  17           HB2      LEU  17   7.958  -5.357  -4.595
  272    HB3  LEU  17           HB1      LEU  17   7.213  -5.940  -6.076
  273    HG   LEU  17           HG       LEU  17   5.384  -4.230  -5.708
  274   HD11  LEU  17          HD11      LEU  17   5.775  -2.459  -4.123
  275   HD12  LEU  17          HD12      LEU  17   7.392  -3.062  -3.770
  276   HD13  LEU  17          HD13      LEU  17   5.980  -3.976  -3.255
  277   HD21  LEU  17          HD21      LEU  17   7.034  -3.737  -7.360
  278   HD22  LEU  17          HD22      LEU  17   8.266  -3.419  -6.139
  279   HD23  LEU  17          HD23      LEU  17   6.928  -2.291  -6.357
  280    H    VAL  18           H        VAL  18   5.253  -5.218  -2.132
  281    HA   VAL  18           HA       VAL  18   7.596  -5.919  -0.530
  282    HB   VAL  18           HB       VAL  18   6.580  -4.746   1.270
  283   HG11  VAL  18          HG11      VAL  18   6.361  -3.628  -1.439
  284   HG12  VAL  18          HG12      VAL  18   7.092  -2.936   0.009
  285   HG13  VAL  18          HG13      VAL  18   5.352  -2.811  -0.247
  286   HG21  VAL  18          HG21      VAL  18   4.421  -5.750   1.386
  287   HG22  VAL  18          HG22      VAL  18   4.003  -5.200  -0.231
  288   HG23  VAL  18          HG23      VAL  18   4.136  -4.037   1.083
  289    H    CYS  19           H        CYS  19   4.248  -6.955  -0.739
  290    HA   CYS  19           HA       CYS  19   4.674  -9.098   1.242
  291    HB2  CYS  19           HB2      CYS  19   2.238  -8.872  -0.511
  292    HB3  CYS  19           HB1      CYS  19   2.358  -9.453   1.148
  293    H    GLY  20           H        GLY  20   3.842  -8.835  -2.223
  294    HA2  GLY  20           HA2      GLY  20   4.679 -10.207  -3.976
  295    HA3  GLY  20           HA1      GLY  20   5.419 -11.257  -2.768
  296    H    GLU  21           H        GLU  21   4.517 -13.242  -2.769
  297    HA   GLU  21           HA       GLU  21   2.068 -13.890  -4.071
  298    HB2  GLU  21           HB2      GLU  21   4.153 -15.339  -3.080
  299    HB3  GLU  21           HB1      GLU  21   2.911 -15.679  -1.873
  300    HG2  GLU  21           HG2      GLU  21   1.515 -15.880  -4.251
  301    HG3  GLU  21           HG1      GLU  21   3.088 -16.564  -4.664
  302    H    ARG  22           H        ARG  22   2.594 -12.425  -1.037
  303    HA   ARG  22           HA       ARG  22   0.515 -13.480   0.553
  304    HB2  ARG  22           HB2      ARG  22   2.293 -11.390   0.804
  305    HB3  ARG  22           HB1      ARG  22   0.746 -10.551   0.687
  306    HG2  ARG  22           HG2      ARG  22   0.473 -11.017   2.881
  307    HG3  ARG  22           HG1      ARG  22   0.206 -12.690   2.385
  308    HD2  ARG  22           HD2      ARG  22   2.585 -13.183   2.627
  309    HD3  ARG  22           HD1      ARG  22   2.922 -11.495   3.014
  310    HE   ARG  22           HE       ARG  22   1.009 -12.362   4.887
  311   HH11  ARG  22          HH21      ARG  22   3.726 -11.302   5.612
  312   HH12  ARG  22          HH22      ARG  22   4.443 -12.666   6.402
  313   HH21  ARG  22          HH11      ARG  22   2.135 -14.934   5.161
  314   HH22  ARG  22          HH12      ARG  22   3.542 -14.721   6.147
  315    H    GLY  23           H        GLY  23   0.338 -11.684  -2.366
  316    HA2  GLY  23           HA2      GLY  23  -1.483 -10.811  -3.563
  317    HA3  GLY  23           HA1      GLY  23  -2.421 -12.066  -2.752
  318    H    ALA  24           H        ALA  24  -1.774  -8.699  -2.912
  319    HA   ALA  24           HA       ALA  24  -2.909  -8.062  -0.290
  320    HB1  ALA  24           HB1      ALA  24  -2.617  -5.767  -0.920
  321    HB2  ALA  24           HB2      ALA  24  -2.517  -6.185  -2.631
  322    HB3  ALA  24           HB3      ALA  24  -1.210  -6.634  -1.536
  323    H    PHE  25           H        PHE  25  -4.923  -9.339  -0.686
  324    HA   PHE  25           HA       PHE  25  -6.815  -8.137  -2.606
  325    HB2  PHE  25           HB2      PHE  25  -8.333  -9.997  -1.668
  326    HB3  PHE  25           HB1      PHE  25  -6.924 -10.511  -2.596
  327    HD1  PHE  25           HD1      PHE  25  -8.319 -10.122   0.813
  328    HD2  PHE  25           HD2      PHE  25  -5.066 -11.642  -1.550
  329    HE1  PHE  25           HE1      PHE  25  -7.485 -11.390   2.775
  330    HE2  PHE  25           HE2      PHE  25  -4.233 -12.910   0.413
  331    HZ   PHE  25           HZ       PHE  25  -5.443 -12.785   2.576
  332    H    TYR  26           H        TYR  26  -6.176  -6.294  -0.702
  333    HA   TYR  26           HA       TYR  26  -7.961  -6.399   1.586
  334    HB2  TYR  26           HB2      TYR  26  -7.213  -4.154   2.044
  335    HB3  TYR  26           HB1      TYR  26  -5.815  -5.068   1.478
  336    HD1  TYR  26           HD2      TYR  26  -5.037  -4.822  -0.896
  337    HD2  TYR  26           HD1      TYR  26  -8.090  -2.311   0.790
  338    HE1  TYR  26           HE2      TYR  26  -4.728  -3.202  -2.749
  339    HE2  TYR  26           HE1      TYR  26  -7.782  -0.692  -1.063
  340    HH   TYR  26           HH       TYR  26  -5.147  -0.983  -3.339
  341    H    THR  27           H        THR  27  -8.537  -5.950  -1.669
  342    HA   THR  27           HA       THR  27 -10.798  -4.067  -1.212
  343    HB   THR  27           HB       THR  27 -10.920  -4.154  -3.766
  344    HG1  THR  27           HG1      THR  27  -9.798  -5.875  -4.361
  345   HG21  THR  27          HG21      THR  27  -9.927  -2.191  -3.147
  346   HG22  THR  27          HG22      THR  27  -8.491  -2.964  -3.819
  347   HG23  THR  27          HG23      THR  27  -8.776  -2.992  -2.078
  348    H    LYS  28           H        LYS  28 -12.806  -4.919  -0.983
  349    HA   LYS  28           HA       LYS  28 -13.541  -7.362  -2.470
  350    HB2  LYS  28           HB2      LYS  28 -14.477  -8.374  -0.330
  351    HB3  LYS  28           HB1      LYS  28 -12.717  -8.373  -0.455
  352    HG2  LYS  28           HG2      LYS  28 -13.026  -5.989   0.727
  353    HG3  LYS  28           HG1      LYS  28 -14.492  -6.768   1.324
  354    HD2  LYS  28           HD2      LYS  28 -11.655  -7.795   1.615
  355    HD3  LYS  28           HD1      LYS  28 -12.692  -7.187   2.906
  356    HE2  LYS  28           HE2      LYS  28 -14.005  -9.291   1.377
  357    HE3  LYS  28           HE1      LYS  28 -12.482  -9.847   2.074
  358    HZ1  LYS  28           HZ1      LYS  28 -13.968 -10.198   3.777
  359    HZ2  LYS  28           HZ2      LYS  28 -14.874  -8.803   3.434
  360    HZ3  LYS  28           HZ3      LYS  28 -13.353  -8.670   4.180
  361    HA   PRO  29           HA       PRO  29 -16.903  -4.255  -2.126
  362    HB2  PRO  29           HB2      PRO  29 -17.442  -4.228  -4.821
  363    HB3  PRO  29           HB1      PRO  29 -16.238  -3.179  -4.053
  364    HG2  PRO  29           HG2      PRO  29 -15.813  -5.600  -5.742
  365    HG3  PRO  29           HG1      PRO  29 -14.745  -4.211  -5.483
  366    HD2  PRO  29           HD2      PRO  29 -14.485  -6.754  -4.264
  367    HD3  PRO  29           HD1      PRO  29 -13.634  -5.272  -3.781
  368    H    THR  30           H        THR  30 -17.619  -6.560  -1.156
  369    HA   THR  30           HA       THR  30 -20.135  -7.222  -2.382
  370    HB   THR  30           HB       THR  30 -18.820  -8.452  -3.996
  371    HG1  THR  30           HG1      THR  30 -19.604 -10.512  -3.576
  372   HG21  THR  30          HG21      THR  30 -16.977  -9.761  -3.494
  373   HG22  THR  30          HG22      THR  30 -17.548 -10.124  -1.865
  374   HG23  THR  30          HG23      THR  30 -16.852  -8.544  -2.224
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1 -11.165   3.832   5.225
    2    H2   GLY   1           HT2      GLY   1 -10.094   2.633   5.771
    3    H3   GLY   1           HT3      GLY   1 -10.358   2.843   4.107
    4    HA2  GLY   1           HA1      GLY   1  -8.904   4.570   4.046
    5    HA3  GLY   1           HA2      GLY   1  -9.443   5.253   5.611
    6    H    ILE   2           H        ILE   2  -7.995   2.718   3.383
    7    HA   ILE   2           HA       ILE   2  -5.589   2.408   5.067
    8    HB   ILE   2           HB       ILE   2  -6.444   0.372   4.129
    9   HG12  ILE   2          HG12      ILE   2  -3.896   0.917   4.002
   10   HG13  ILE   2          HG11      ILE   2  -4.500  -0.484   3.123
   11   HG21  ILE   2          HG21      ILE   2  -7.753   0.684   2.303
   12   HG22  ILE   2          HG22      ILE   2  -6.258   0.445   1.400
   13   HG23  ILE   2          HG23      ILE   2  -6.821   2.078   1.754
   14   HD11  ILE   2          HD11      ILE   2  -3.048   1.678   2.059
   15   HD12  ILE   2          HD12      ILE   2  -4.699   1.901   1.485
   16   HD13  ILE   2          HD13      ILE   2  -3.849   0.394   1.154
   17    H    VAL   3           H        VAL   3  -6.594   3.980   2.102
   18    HA   VAL   3           HA       VAL   3  -3.769   4.783   1.574
   19    HB   VAL   3           HB       VAL   3  -4.556   5.429  -0.651
   20   HG11  VAL   3          HG11      VAL   3  -4.848   3.268  -1.493
   21   HG12  VAL   3          HG12      VAL   3  -5.848   2.766  -0.131
   22   HG13  VAL   3          HG13      VAL   3  -4.107   2.955   0.074
   23   HG21  VAL   3          HG21      VAL   3  -6.706   6.114  -0.798
   24   HG22  VAL   3          HG22      VAL   3  -7.136   5.304   0.709
   25   HG23  VAL   3          HG23      VAL   3  -7.149   4.408  -0.810
   26    H    GLU   4           H        GLU   4  -6.692   5.909   2.894
   27    HA   GLU   4           HA       GLU   4  -7.089   8.518   2.257
   28    HB2  GLU   4           HB2      GLU   4  -7.467   8.992   4.695
   29    HB3  GLU   4           HB1      GLU   4  -8.261   7.522   4.128
   30    HG2  GLU   4           HG2      GLU   4  -6.246   6.227   4.935
   31    HG3  GLU   4           HG1      GLU   4  -5.669   7.718   5.682
   32    H    GLN   5           H        GLN   5  -4.185   7.290   3.843
   33    HA   GLN   5           HA       GLN   5  -3.137  10.081   3.927
   34    HB2  GLN   5           HB2      GLN   5  -1.237   8.742   5.249
   35    HB3  GLN   5           HB1      GLN   5  -2.708   9.290   6.051
   36    HG2  GLN   5           HG2      GLN   5  -3.748   7.084   5.646
   37    HG3  GLN   5           HG1      GLN   5  -2.266   6.534   4.865
   38   HE21  GLN   5          HE21      GLN   5  -3.857   6.759   7.883
   39   HE22  GLN   5          HE22      GLN   5  -2.526   6.412   8.877
   40    H    CYS   6           H        CYS   6  -2.089   6.773   3.018
   41    HA   CYS   6           HA       CYS   6   0.324   7.548   1.742
   42    HB2  CYS   6           HB2      CYS   6  -1.448   5.302   0.777
   43    HB3  CYS   6           HB1      CYS   6   0.312   5.395   0.722
   44    H    CYS   7           H        CYS   7  -3.007   7.698   0.672
   45    HA   CYS   7           HA       CYS   7  -2.319   8.196  -2.119
   46    HB2  CYS   7           HB2      CYS   7  -4.766   7.908  -0.525
   47    HB3  CYS   7           HB1      CYS   7  -4.885   9.110  -1.805
   48    H    THR   8           H        THR   8  -3.541  10.204   0.580
   49    HA   THR   8           HA       THR   8  -3.497  12.654  -0.922
   50    HB   THR   8           HB       THR   8  -4.818  12.439   1.131
   51    HG1  THR   8           HG1      THR   8  -4.490  14.479   1.389
   52   HG21  THR   8          HG21      THR   8  -3.799  12.190   3.295
   53   HG22  THR   8          HG22      THR   8  -2.182  12.361   2.614
   54   HG23  THR   8          HG23      THR   8  -3.139  10.922   2.262
   55    H    SER   9           H        SER   9  -1.168  11.259   1.412
   56    HA   SER   9           HA       SER   9   0.835  13.203   0.340
   57    HB2  SER   9           HB2      SER   9   2.023  12.765   2.554
   58    HB3  SER   9           HB1      SER   9   0.511  13.660   2.661
   59    HG   SER   9           HG       SER   9  -0.520  11.693   3.186
   60    H    ILE  10           H        ILE  10   2.367  10.949   2.290
   61    HA   ILE  10           HA       ILE  10   2.915   9.159  -0.036
   62    HB   ILE  10           HB       ILE  10   5.086   9.749   1.933
   63   HG12  ILE  10          HG12      ILE  10   4.053  11.969   1.250
   64   HG13  ILE  10          HG11      ILE  10   5.747  11.774   0.802
   65   HG21  ILE  10          HG21      ILE  10   4.736   8.653  -0.769
   66   HG22  ILE  10          HG22      ILE  10   6.030   8.376   0.397
   67   HG23  ILE  10          HG23      ILE  10   6.075   9.794  -0.650
   68   HD11  ILE  10          HD11      ILE  10   5.228  11.382  -1.467
   69   HD12  ILE  10          HD12      ILE  10   4.120  12.674  -1.004
   70   HD13  ILE  10          HD13      ILE  10   3.542  11.011  -1.107
   71    H    CYS  11           H        CYS  11   4.552   7.333   1.165
   72    HA   CYS  11           HA       CYS  11   3.640   6.528   3.788
   73    HB2  CYS  11           HB2      CYS  11   2.057   5.729   1.485
   74    HB3  CYS  11           HB1      CYS  11   2.711   4.324   2.328
   75    H    SER  12           H        SER  12   4.544   4.380   4.382
   76    HA   SER  12           HA       SER  12   7.094   3.905   2.931
   77    HB2  SER  12           HB2      SER  12   7.149   2.295   5.142
   78    HB3  SER  12           HB1      SER  12   7.761   3.946   5.104
   79    HG   SER  12           HG       SER  12   6.106   3.314   6.768
   80    H    LEU  13           H        LEU  13   7.142   2.212   1.503
   81    HA   LEU  13           HA       LEU  13   4.993   0.444   1.103
   82    HB2  LEU  13           HB2      LEU  13   6.433  -0.884  -0.305
   83    HB3  LEU  13           HB1      LEU  13   6.836   0.806  -0.548
   84    HG   LEU  13           HG       LEU  13   8.884  -0.472  -0.421
   85   HD11  LEU  13          HD11      LEU  13   8.768   1.774   0.708
   86   HD12  LEU  13          HD12      LEU  13  10.042   0.713   1.306
   87   HD13  LEU  13          HD13      LEU  13   8.561   0.923   2.236
   88   HD21  LEU  13          HD21      LEU  13   7.532  -2.149   1.277
   89   HD22  LEU  13          HD22      LEU  13   8.622  -1.314   2.383
   90   HD23  LEU  13          HD23      LEU  13   9.272  -2.189   0.998
   91    H    TYR  14           H        TYR  14   7.420   0.378   3.545
   92    HA   TYR  14           HA       TYR  14   7.073  -2.460   4.129
   93    HB2  TYR  14           HB2      TYR  14   8.395  -2.020   6.151
   94    HB3  TYR  14           HB1      TYR  14   9.177  -1.307   4.744
   95    HD1  TYR  14           HD1      TYR  14   6.683  -0.416   7.410
   96    HD2  TYR  14           HD2      TYR  14   9.886   0.906   4.867
   97    HE1  TYR  14           HE1      TYR  14   6.659   1.798   8.528
   98    HE2  TYR  14           HE2      TYR  14   9.860   3.122   5.985
   99    HH   TYR  14           HH       TYR  14   9.133   4.197   7.912
  100    H    GLN  15           H        GLN  15   5.652   0.557   5.098
  101    HA   GLN  15           HA       GLN  15   4.135  -0.584   7.290
  102    HB2  GLN  15           HB2      GLN  15   3.339   1.579   7.597
  103    HB3  GLN  15           HB1      GLN  15   4.861   1.905   6.786
  104    HG2  GLN  15           HG2      GLN  15   3.570   3.141   5.379
  105    HG3  GLN  15           HG1      GLN  15   3.208   1.579   4.650
  106   HE21  GLN  15          HE21      GLN  15   1.793   4.292   6.190
  107   HE22  GLN  15          HE22      GLN  15   0.256   3.625   6.465
  108    H    LEU  16           H        LEU  16   3.830  -0.272   3.857
  109    HA   LEU  16           HA       LEU  16   0.970  -0.673   3.679
  110    HB2  LEU  16           HB2      LEU  16   3.294  -0.801   1.788
  111    HB3  LEU  16           HB1      LEU  16   1.768  -1.529   1.295
  112    HG   LEU  16           HG       LEU  16   2.153   0.929   0.663
  113   HD11  LEU  16          HD11      LEU  16  -0.046   0.425   0.310
  114   HD12  LEU  16          HD12      LEU  16  -0.297   1.404   1.755
  115   HD13  LEU  16          HD13      LEU  16  -0.219  -0.353   1.883
  116   HD21  LEU  16          HD21      LEU  16   3.057   1.725   2.770
  117   HD22  LEU  16          HD22      LEU  16   1.610   1.197   3.630
  118   HD23  LEU  16          HD23      LEU  16   1.515   2.530   2.480
  119    H    GLU  17           H        GLU  17   3.779  -2.776   3.882
  120    HA   GLU  17           HA       GLU  17   2.548  -5.212   3.068
  121    HB2  GLU  17           HB2      GLU  17   4.405  -5.317   5.402
  122    HB3  GLU  17           HB1      GLU  17   4.400  -6.287   3.928
  123    HG2  GLU  17           HG2      GLU  17   4.937  -3.832   2.902
  124    HG3  GLU  17           HG1      GLU  17   5.710  -3.698   4.481
  125    H    ASN  18           H        ASN  18   2.111  -3.204   5.801
  126    HA   ASN  18           HA       ASN  18   1.135  -5.053   7.727
  127    HB2  ASN  18           HB2      ASN  18   1.556  -2.490   7.930
  128    HB3  ASN  18           HB1      ASN  18  -0.099  -2.330   7.339
  129   HD21  ASN  18          HD21      ASN  18  -0.313  -1.374   9.676
  130   HD22  ASN  18          HD22      ASN  18  -0.691  -2.477  10.909
  131    H    TYR  19           H        TYR  19  -0.180  -4.057   4.716
  132    HA   TYR  19           HA       TYR  19  -2.898  -5.007   5.460
  133    HB2  TYR  19           HB2      TYR  19  -2.126  -3.934   2.755
  134    HB3  TYR  19           HB1      TYR  19  -3.698  -3.893   3.554
  135    HD1  TYR  19           HD2      TYR  19  -2.901  -2.970   6.275
  136    HD2  TYR  19           HD1      TYR  19  -1.649  -1.640   2.384
  137    HE1  TYR  19           HE2      TYR  19  -2.369  -0.735   7.211
  138    HE2  TYR  19           HE1      TYR  19  -1.118   0.596   3.320
  139    HH   TYR  19           HH       TYR  19  -1.839   1.981   5.298
  140    H    CYS  20           H        CYS  20  -0.179  -6.495   4.659
  141    HA   CYS  20           HA       CYS  20  -1.050  -8.091   2.378
  142    HB2  CYS  20           HB2      CYS  20   1.266  -8.323   4.302
  143    HB3  CYS  20           HB1      CYS  20   0.979  -9.490   3.011
  144    H    ASN  21           H        ASN  21   0.225  -9.715   5.183
  145    HA   ASN  21           HA       ASN  21  -1.949 -11.648   5.111
  146    HB2  ASN  21           HB2      ASN  21   0.614 -11.323   6.579
  147    HB3  ASN  21           HB1      ASN  21  -0.639 -12.255   7.400
  148   HD21  ASN  21          HD21      ASN  21  -1.729 -13.986   5.886
  149   HD22  ASN  21          HD22      ASN  21  -0.687 -14.827   4.843
  150    H1   PHE   1           HT1      PHE   1  11.410   1.386  -1.653
  151    H2   PHE   1           HT2      PHE   1  12.085   2.184  -2.993
  152    H3   PHE   1           HT3      PHE   1  11.154   0.779  -3.216
  153    HA   PHE   1           HA       PHE   1   9.621   2.366  -3.761
  154    HB2  PHE   1           HB2      PHE   1   9.236   1.021  -1.419
  155    HB3  PHE   1           HB1      PHE   1   9.033   2.688  -0.888
  156    HD1  PHE   1           HD1      PHE   1   7.937   0.284  -3.545
  157    HD2  PHE   1           HD2      PHE   1   7.019   3.825  -1.288
  158    HE1  PHE   1           HE1      PHE   1   5.674   0.349  -4.562
  159    HE2  PHE   1           HE2      PHE   1   4.758   3.888  -2.305
  160    HZ   PHE   1           HZ       PHE   1   4.085   2.151  -3.942
  161    H    VAL   2           H        VAL   2   9.772   4.472  -4.343
  162    HA   VAL   2           HA       VAL   2  11.398   6.334  -2.773
  163    HB   VAL   2           HB       VAL   2  10.581   7.969  -4.579
  164   HG11  VAL   2          HG11      VAL   2  12.580   7.379  -5.428
  165   HG12  VAL   2          HG12      VAL   2  11.797   6.045  -6.274
  166   HG13  VAL   2          HG13      VAL   2  12.466   5.794  -4.662
  167   HG21  VAL   2          HG21      VAL   2   9.253   7.207  -6.312
  168   HG22  VAL   2          HG22      VAL   2   8.614   6.213  -5.003
  169   HG23  VAL   2          HG23      VAL   2   9.792   5.538  -6.129
  170    H    ASN   3           H        ASN   3  10.341   8.627  -2.447
  171    HA   ASN   3           HA       ASN   3   7.794   8.159  -0.980
  172    HB2  ASN   3           HB2      ASN   3   9.818  10.415  -0.851
  173    HB3  ASN   3           HB1      ASN   3   8.326  10.368   0.088
  174   HD21  ASN   3          HD21      ASN   3   8.116   7.901   1.121
  175   HD22  ASN   3          HD22      ASN   3   9.501   7.436   1.985
  176    H    GLN   4           H        GLN   4   6.108   8.476  -2.402
  177    HA   GLN   4           HA       GLN   4   5.717  11.165  -3.470
  178    HB2  GLN   4           HB2      GLN   4   5.303  10.181  -5.821
  179    HB3  GLN   4           HB1      GLN   4   6.980  10.412  -5.327
  180    HG2  GLN   4           HG2      GLN   4   7.132   8.051  -4.666
  181    HG3  GLN   4           HG1      GLN   4   5.441   7.808  -5.108
  182   HE21  GLN   4          HE21      GLN   4   6.676   6.128  -6.594
  183   HE22  GLN   4          HE22      GLN   4   7.124   6.696  -8.129
  184    H    HIS   5           H        HIS   5   3.524  11.387  -4.368
  185    HA   HIS   5           HA       HIS   5   1.575   9.918  -2.849
  186    HB2  HIS   5           HB2      HIS   5   0.964  11.488  -5.353
  187    HB3  HIS   5           HB1      HIS   5  -0.051  11.266  -3.928
  188    HD2  HIS   5           HD2      HIS   5   3.049  13.407  -5.050
  189    HE1  HIS   5           HE1      HIS   5   1.708  14.828  -1.302
  190    HE2  HIS   5           HE2      HIS   5   3.312  15.255  -3.238
  191    H    LEU   6           H        LEU   6   0.343   8.144  -3.434
  192    HA   LEU   6           HA       LEU   6   0.384   7.216  -6.225
  193    HB2  LEU   6           HB2      LEU   6   1.130   4.946  -5.616
  194    HB3  LEU   6           HB1      LEU   6   2.375   6.139  -5.290
  195    HG   LEU   6           HG       LEU   6   2.285   4.581  -3.442
  196   HD11  LEU   6          HD11      LEU   6   0.808   6.849  -2.209
  197   HD12  LEU   6          HD12      LEU   6   2.285   7.231  -3.093
  198   HD13  LEU   6          HD13      LEU   6   2.336   6.106  -1.738
  199   HD21  LEU   6          HD21      LEU   6   0.394   3.696  -2.582
  200   HD22  LEU   6          HD22      LEU   6  -0.396   4.354  -4.012
  201   HD23  LEU   6          HD23      LEU   6  -0.409   5.261  -2.498
  202    H    CYS   7           H        CYS   7  -1.353   5.767  -6.697
  203    HA   CYS   7           HA       CYS   7  -3.159   4.971  -4.513
  204    HB2  CYS   7           HB2      CYS   7  -4.002   6.962  -6.640
  205    HB3  CYS   7           HB1      CYS   7  -5.119   6.125  -5.565
  206    H    GLY   8           H        GLY   8  -5.255   4.021  -5.648
  207    HA2  GLY   8           HA2      GLY   8  -6.028   2.193  -6.895
  208    HA3  GLY   8           HA1      GLY   8  -5.366   3.090  -8.257
  209    H    SER   9           H        SER   9  -4.283   1.637  -9.459
  210    HA   SER   9           HA       SER   9  -3.121  -0.773  -8.579
  211    HB2  SER   9           HB2      SER   9  -1.943   0.755 -10.882
  212    HB3  SER   9           HB1      SER   9  -2.227  -0.978 -10.729
  213    HG   SER   9           HG       SER   9  -4.395  -0.632 -11.003
  214    H    ASP  10           H        ASP  10  -2.007   2.441  -8.148
  215    HA   ASP  10           HA       ASP  10   0.812   1.831  -8.017
  216    HB2  ASP  10           HB2      ASP  10  -0.526   4.094  -6.548
  217    HB3  ASP  10           HB1      ASP  10   1.102   4.044  -7.228
  218    H    LEU  11           H        LEU  11  -1.725   2.141  -5.557
  219    HA   LEU  11           HA       LEU  11  -0.050   1.641  -3.306
  220    HB2  LEU  11           HB2      LEU  11  -2.907   0.680  -3.598
  221    HB3  LEU  11           HB1      LEU  11  -2.057   1.056  -2.101
  222    HG   LEU  11           HG       LEU  11  -2.003   3.306  -3.945
  223   HD11  LEU  11          HD11      LEU  11  -4.700   2.249  -3.041
  224   HD12  LEU  11          HD12      LEU  11  -4.148   2.393  -4.708
  225   HD13  LEU  11          HD13      LEU  11  -4.425   3.843  -3.743
  226   HD21  LEU  11          HD21      LEU  11  -2.702   2.696  -1.099
  227   HD22  LEU  11          HD22      LEU  11  -3.268   4.219  -1.783
  228   HD23  LEU  11          HD23      LEU  11  -1.543   3.858  -1.738
  229    H    VAL  12           H        VAL  12  -1.525  -0.505  -5.668
  230    HA   VAL  12           HA       VAL  12  -0.654  -2.878  -4.182
  231    HB   VAL  12           HB       VAL  12  -1.174  -4.105  -6.304
  232   HG11  VAL  12          HG11      VAL  12  -3.606  -2.518  -5.709
  233   HG12  VAL  12          HG12      VAL  12  -2.800  -3.262  -4.327
  234   HG13  VAL  12          HG13      VAL  12  -3.360  -4.264  -5.667
  235   HG21  VAL  12          HG21      VAL  12  -2.073  -1.360  -7.181
  236   HG22  VAL  12          HG22      VAL  12  -2.459  -2.858  -8.024
  237   HG23  VAL  12          HG23      VAL  12  -0.783  -2.324  -7.896
  238    H    GLU  13           H        GLU  13   0.470  -0.978  -6.971
  239    HA   GLU  13           HA       GLU  13   2.569  -2.551  -7.871
  240    HB2  GLU  13           HB2      GLU  13   2.377  -0.454  -8.947
  241    HB3  GLU  13           HB1      GLU  13   2.362   0.425  -7.419
  242    HG2  GLU  13           HG2      GLU  13   4.624   0.529  -7.327
  243    HG3  GLU  13           HG1      GLU  13   4.806  -1.150  -7.839
  244    H    ALA  14           H        ALA  14   2.187  -0.858  -4.881
  245    HA   ALA  14           HA       ALA  14   4.889  -1.370  -3.895
  246    HB1  ALA  14           HB1      ALA  14   4.305   0.218  -2.397
  247    HB2  ALA  14           HB2      ALA  14   2.901  -0.715  -1.885
  248    HB3  ALA  14           HB3      ALA  14   2.780   0.373  -3.267
  249    H    LEU  15           H        LEU  15   1.806  -2.118  -2.364
  250    HA   LEU  15           HA       LEU  15   2.575  -4.276  -0.792
  251    HB2  LEU  15           HB2      LEU  15   0.049  -3.392  -2.052
  252    HB3  LEU  15           HB1      LEU  15   0.096  -5.114  -1.669
  253    HG   LEU  15           HG       LEU  15   1.157  -3.369   0.461
  254   HD11  LEU  15          HD11      LEU  15  -1.385  -2.752  -0.799
  255   HD12  LEU  15          HD12      LEU  15  -0.555  -1.902   0.504
  256   HD13  LEU  15          HD13      LEU  15  -1.620  -3.258   0.875
  257   HD21  LEU  15          HD21      LEU  15  -1.098  -5.336   0.714
  258   HD22  LEU  15          HD22      LEU  15   0.224  -5.006   1.835
  259   HD23  LEU  15          HD23      LEU  15   0.524  -5.935   0.366
  260    H    TYR  16           H        TYR  16   2.071  -4.119  -4.163
  261    HA   TYR  16           HA       TYR  16   1.771  -6.727  -5.048
  262    HB2  TYR  16           HB2      TYR  16   1.691  -5.042  -6.695
  263    HB3  TYR  16           HB1      TYR  16   3.200  -4.316  -6.155
  264    HD1  TYR  16           HD1      TYR  16   2.189  -7.789  -7.154
  265    HD2  TYR  16           HD2      TYR  16   4.838  -4.466  -7.756
  266    HE1  TYR  16           HE1      TYR  16   3.456  -9.107  -8.838
  267    HE2  TYR  16           HE2      TYR  16   6.109  -5.775  -9.440
  268    HH   TYR  16           HH       TYR  16   4.994  -8.955 -10.512
  269    H    LEU  17           H        LEU  17   4.910  -5.164  -5.394
  270    HA   LEU  17           HA       LEU  17   6.199  -7.769  -5.087
  271    HB2  LEU  17           HB2      LEU  17   8.085  -6.823  -6.071
  272    HB3  LEU  17           HB1      LEU  17   6.733  -6.013  -6.856
  273    HG   LEU  17           HG       LEU  17   8.349  -4.946  -4.550
  274   HD11  LEU  17          HD11      LEU  17   8.047  -3.829  -7.338
  275   HD12  LEU  17          HD12      LEU  17   9.320  -4.982  -6.934
  276   HD13  LEU  17          HD13      LEU  17   9.265  -3.411  -6.133
  277   HD21  LEU  17          HD21      LEU  17   7.031  -2.847  -5.016
  278   HD22  LEU  17          HD22      LEU  17   6.077  -4.167  -4.335
  279   HD23  LEU  17          HD23      LEU  17   6.000  -3.819  -6.062
  280    H    VAL  18           H        VAL  18   5.492  -5.233  -2.916
  281    HA   VAL  18           HA       VAL  18   7.878  -5.431  -1.294
  282    HB   VAL  18           HB       VAL  18   6.642  -4.321   0.435
  283   HG11  VAL  18          HG11      VAL  18   6.266  -3.481  -2.358
  284   HG12  VAL  18          HG12      VAL  18   6.849  -2.560  -0.974
  285   HG13  VAL  18          HG13      VAL  18   5.116  -2.765  -1.228
  286   HG21  VAL  18          HG21      VAL  18   4.153  -4.102   0.275
  287   HG22  VAL  18          HG22      VAL  18   4.695  -5.764   0.515
  288   HG23  VAL  18          HG23      VAL  18   4.185  -5.225  -1.085
  289    H    CYS  19           H        CYS  19   4.755  -7.037  -1.307
  290    HA   CYS  19           HA       CYS  19   5.721  -8.998   0.712
  291    HB2  CYS  19           HB2      CYS  19   3.021  -8.188  -0.329
  292    HB3  CYS  19           HB1      CYS  19   3.226  -9.787   0.383
  293    H    GLY  20           H        GLY  20   3.894  -9.048  -2.368
  294    HA2  GLY  20           HA2      GLY  20   4.295 -10.396  -4.274
  295    HA3  GLY  20           HA1      GLY  20   5.660 -11.129  -3.434
  296    H    GLU  21           H        GLU  21   2.426 -11.561  -4.381
  297    HA   GLU  21           HA       GLU  21   0.799 -13.181  -3.829
  298    HB2  GLU  21           HB2      GLU  21   2.911 -14.303  -4.997
  299    HB3  GLU  21           HB1      GLU  21   3.037 -15.117  -3.440
  300    HG2  GLU  21           HG2      GLU  21   1.457 -16.556  -4.155
  301    HG3  GLU  21           HG1      GLU  21   0.309 -15.218  -4.086
  302    H    ARG  22           H        ARG  22   2.020 -11.737  -1.486
  303    HA   ARG  22           HA       ARG  22   1.867 -13.874   0.582
  304    HB2  ARG  22           HB2      ARG  22   3.619 -11.794   0.367
  305    HB3  ARG  22           HB1      ARG  22   2.395 -11.086   1.423
  306    HG2  ARG  22           HG2      ARG  22   2.738 -12.657   3.108
  307    HG3  ARG  22           HG1      ARG  22   3.386 -13.861   1.992
  308    HD2  ARG  22           HD2      ARG  22   5.420 -13.204   2.746
  309    HD3  ARG  22           HD1      ARG  22   5.183 -11.785   1.725
  310    HE   ARG  22           HE       ARG  22   4.069 -10.802   3.880
  311   HH11  ARG  22          HH21      ARG  22   7.171 -10.927   3.542
  312   HH12  ARG  22          HH22      ARG  22   7.623 -11.393   5.147
  313   HH21  ARG  22          HH11      ARG  22   4.416 -12.341   6.064
  314   HH22  ARG  22          HH12      ARG  22   6.065 -12.195   6.574
  315    H    GLY  23           H        GLY  23  -0.450 -12.682  -0.956
  316    HA2  GLY  23           HA2      GLY  23  -2.710 -12.360  -0.326
  317    HA3  GLY  23           HA1      GLY  23  -2.200 -12.314   1.362
  318    H    ALA  24           H        ALA  24  -2.746 -10.400  -1.513
  319    HA   ALA  24           HA       ALA  24  -2.556  -7.956   0.187
  320    HB1  ALA  24           HB1      ALA  24  -1.046  -8.593  -2.279
  321    HB2  ALA  24           HB2      ALA  24  -0.650  -7.474  -0.975
  322    HB3  ALA  24           HB3      ALA  24  -1.780  -6.990  -2.241
  323    H    PHE  25           H        PHE  25  -4.720  -7.446   0.266
  324    HA   PHE  25           HA       PHE  25  -6.017  -6.659  -2.241
  325    HB2  PHE  25           HB2      PHE  25  -7.996  -8.078  -1.917
  326    HB3  PHE  25           HB1      PHE  25  -6.553  -9.077  -2.094
  327    HD1  PHE  25           HD2      PHE  25  -5.311  -9.711   0.130
  328    HD2  PHE  25           HD1      PHE  25  -9.400  -8.403  -0.071
  329    HE1  PHE  25           HE2      PHE  25  -5.750 -10.740   2.345
  330    HE2  PHE  25           HE1      PHE  25  -9.838  -9.433   2.144
  331    HZ   PHE  25           HZ       PHE  25  -8.013 -10.601   3.352
  332    H    TYR  26           H        TYR  26  -6.314  -4.583  -1.447
  333    HA   TYR  26           HA       TYR  26  -7.431  -4.191   1.253
  334    HB2  TYR  26           HB2      TYR  26  -7.302  -1.743   0.576
  335    HB3  TYR  26           HB1      TYR  26  -5.759  -2.596   0.594
  336    HD1  TYR  26           HD1      TYR  26  -8.615  -1.899  -1.745
  337    HD2  TYR  26           HD2      TYR  26  -4.374  -2.410  -1.271
  338    HE1  TYR  26           HE1      TYR  26  -8.280  -1.354  -4.143
  339    HE2  TYR  26           HE2      TYR  26  -4.040  -1.864  -3.668
  340    HH   TYR  26           HH       TYR  26  -6.730  -0.799  -5.702
  341    H    THR  27           H        THR  27  -8.657  -4.800  -1.822
  342    HA   THR  27           HA       THR  27 -11.096  -3.169  -1.451
  343    HB   THR  27           HB       THR  27 -10.174  -3.340  -3.715
  344    HG1  THR  27           HG1      THR  27 -12.422  -3.242  -3.536
  345   HG21  THR  27          HG21      THR  27 -10.861  -6.135  -4.173
  346   HG22  THR  27          HG22      THR  27  -9.594  -5.960  -2.959
  347   HG23  THR  27          HG23      THR  27  -9.376  -5.269  -4.568
  348    H    LYS  28           H        LYS  28 -11.610  -4.414   0.583
  349    HA   LYS  28           HA       LYS  28 -12.459  -7.190   0.187
  350    HB2  LYS  28           HB2      LYS  28 -12.798  -7.299   2.527
  351    HB3  LYS  28           HB1      LYS  28 -11.366  -6.299   2.313
  352    HG2  LYS  28           HG2      LYS  28 -12.486  -4.335   2.888
  353    HG3  LYS  28           HG1      LYS  28 -14.067  -4.990   2.468
  354    HD2  LYS  28           HD2      LYS  28 -12.974  -6.644   4.513
  355    HD3  LYS  28           HD1      LYS  28 -12.787  -4.967   5.026
  356    HE2  LYS  28           HE2      LYS  28 -15.394  -5.950   3.876
  357    HE3  LYS  28           HE1      LYS  28 -15.020  -6.161   5.587
  358    HZ1  LYS  28           HZ1      LYS  28 -14.478  -3.517   4.587
  359    HZ2  LYS  28           HZ2      LYS  28 -15.301  -4.000   5.992
  360    HZ3  LYS  28           HZ3      LYS  28 -16.115  -3.949   4.502
  361    HA   PRO  29           HA       PRO  29 -16.714  -5.079   0.747
  362    HB2  PRO  29           HB2      PRO  29 -16.905  -2.475  -0.111
  363    HB3  PRO  29           HB1      PRO  29 -16.555  -2.930   1.566
  364    HG2  PRO  29           HG2      PRO  29 -14.719  -1.821  -0.496
  365    HG3  PRO  29           HG1      PRO  29 -14.599  -1.747   1.268
  366    HD2  PRO  29           HD2      PRO  29 -13.163  -3.497  -0.451
  367    HD3  PRO  29           HD1      PRO  29 -13.230  -3.579   1.320
  368    H    THR  30           H        THR  30 -18.264  -3.833  -1.074
  369    HA   THR  30           HA       THR  30 -19.089  -4.018  -3.263
  370    HB   THR  30           HB       THR  30 -17.665  -3.271  -4.949
  371    HG1  THR  30           HG1      THR  30 -15.249  -3.722  -4.443
  372   HG21  THR  30          HG21      THR  30 -16.182  -2.552  -2.405
  373   HG22  THR  30          HG22      THR  30 -17.590  -1.702  -3.043
  374   HG23  THR  30          HG23      THR  30 -16.071  -1.691  -3.940
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1  -9.871   5.826   5.400
    2    H2   GLY   1           HT2      GLY   1 -10.928   4.497   5.466
    3    H3   GLY   1           HT3      GLY   1 -11.137   5.691   4.276
    4    HA2  GLY   1           HA1      GLY   1  -9.822   3.463   3.780
    5    HA3  GLY   1           HA2      GLY   1  -9.478   4.977   2.888
    6    H    ILE   2           H        ILE   2  -7.885   2.869   2.699
    7    HA   ILE   2           HA       ILE   2  -6.374   2.269   5.191
    8    HB   ILE   2           HB       ILE   2  -6.989   0.275   4.064
    9   HG12  ILE   2          HG12      ILE   2  -4.480   0.637   4.672
   10   HG13  ILE   2          HG11      ILE   2  -4.908  -0.743   3.665
   11   HG21  ILE   2          HG21      ILE   2  -6.366   1.875   1.621
   12   HG22  ILE   2          HG22      ILE   2  -7.731   0.808   1.948
   13   HG23  ILE   2          HG23      ILE   2  -6.158   0.126   1.536
   14   HD11  ILE   2          HD11      ILE   2  -3.654   0.034   1.961
   15   HD12  ILE   2          HD12      ILE   2  -3.058   1.285   3.051
   16   HD13  ILE   2          HD13      ILE   2  -4.453   1.606   2.025
   17    H    VAL   3           H        VAL   3  -6.066   3.784   2.041
   18    HA   VAL   3           HA       VAL   3  -3.186   4.343   2.605
   19    HB   VAL   3           HB       VAL   3  -3.135   5.096   0.206
   20   HG11  VAL   3          HG11      VAL   3  -2.570   2.985  -0.349
   21   HG12  VAL   3          HG12      VAL   3  -4.193   2.374  -0.022
   22   HG13  VAL   3          HG13      VAL   3  -3.039   2.572   1.299
   23   HG21  VAL   3          HG21      VAL   3  -5.934   3.919   0.218
   24   HG22  VAL   3          HG22      VAL   3  -5.046   4.421  -1.217
   25   HG23  VAL   3          HG23      VAL   3  -5.533   5.620  -0.020
   26    H    GLU   4           H        GLU   4  -5.641   5.633   3.757
   27    HA   GLU   4           HA       GLU   4  -6.297   8.141   2.843
   28    HB2  GLU   4           HB2      GLU   4  -6.519   8.860   5.170
   29    HB3  GLU   4           HB1      GLU   4  -7.052   7.186   5.019
   30    HG2  GLU   4           HG2      GLU   4  -4.437   6.767   5.538
   31    HG3  GLU   4           HG1      GLU   4  -4.660   8.292   6.393
   32    H    GLN   5           H        GLN   5  -3.145   7.116   3.990
   33    HA   GLN   5           HA       GLN   5  -2.184   9.924   3.758
   34    HB2  GLN   5           HB2      GLN   5  -0.160   9.121   4.950
   35    HB3  GLN   5           HB1      GLN   5  -1.630   8.833   5.881
   36    HG2  GLN   5           HG2      GLN   5  -1.672   6.495   4.896
   37    HG3  GLN   5           HG1      GLN   5  -0.064   6.820   4.248
   38   HE21  GLN   5          HE21      GLN   5  -1.771   5.791   7.053
   39   HE22  GLN   5          HE22      GLN   5  -0.462   5.821   8.134
   40    H    CYS   6           H        CYS   6  -1.183   6.603   2.790
   41    HA   CYS   6           HA       CYS   6   0.911   7.406   1.060
   42    HB2  CYS   6           HB2      CYS   6  -0.995   5.068   0.718
   43    HB3  CYS   6           HB1      CYS   6   0.560   5.249  -0.093
   44    H    CYS   7           H        CYS   7  -2.567   7.276   0.588
   45    HA   CYS   7           HA       CYS   7  -2.400   7.962  -2.247
   46    HB2  CYS   7           HB2      CYS   7  -4.489   7.254  -0.319
   47    HB3  CYS   7           HB1      CYS   7  -4.979   8.500  -1.460
   48    H    THR   8           H        THR   8  -1.686   9.725   0.406
   49    HA   THR   8           HA       THR   8  -2.860  12.226  -0.744
   50    HB   THR   8           HB       THR   8  -2.547  13.191   1.549
   51    HG1  THR   8           HG1      THR   8  -1.691  12.015   3.076
   52   HG21  THR   8          HG21      THR   8  -4.252  10.702   1.281
   53   HG22  THR   8          HG22      THR   8  -4.738  12.363   0.940
   54   HG23  THR   8          HG23      THR   8  -4.406  11.864   2.598
   55    H    SER   9           H        SER   9  -0.126  11.549   1.467
   56    HA   SER   9           HA       SER   9   1.549  13.250  -0.329
   57    HB2  SER   9           HB2      SER   9   3.023  13.396   1.781
   58    HB3  SER   9           HB1      SER   9   1.491  14.265   1.810
   59    HG   SER   9           HG       SER   9   0.624  12.690   3.069
   60    H    ILE  10           H        ILE  10   3.192  11.385   2.068
   61    HA   ILE  10           HA       ILE  10   3.762   9.194   0.155
   62    HB   ILE  10           HB       ILE  10   6.096  10.550   1.466
   63   HG12  ILE  10          HG12      ILE  10   4.677  12.283   0.229
   64   HG13  ILE  10          HG11      ILE  10   6.342  12.115  -0.329
   65   HG21  ILE  10          HG21      ILE  10   5.568   8.542  -0.604
   66   HG22  ILE  10          HG22      ILE  10   7.024   8.813   0.353
   67   HG23  ILE  10          HG23      ILE  10   6.741   9.759  -1.107
   68   HD11  ILE  10          HD11      ILE  10   4.063  11.933  -1.919
   69   HD12  ILE  10          HD12      ILE  10   4.544  10.254  -1.679
   70   HD13  ILE  10          HD13      ILE  10   5.685  11.407  -2.370
   71    H    CYS  11           H        CYS  11   4.478   7.289   1.207
   72    HA   CYS  11           HA       CYS  11   4.744   7.444   4.175
   73    HB2  CYS  11           HB2      CYS  11   3.400   5.299   4.282
   74    HB3  CYS  11           HB1      CYS  11   2.471   6.726   3.824
   75    H    SER  12           H        SER  12   5.211   4.827   4.749
   76    HA   SER  12           HA       SER  12   7.726   4.311   3.246
   77    HB2  SER  12           HB2      SER  12   7.806   2.564   5.309
   78    HB3  SER  12           HB1      SER  12   8.382   4.224   5.434
   79    HG   SER  12           HG       SER  12   6.909   3.698   7.104
   80    H    LEU  13           H        LEU  13   8.062   2.344   2.184
   81    HA   LEU  13           HA       LEU  13   5.744   0.925   1.291
   82    HB2  LEU  13           HB2      LEU  13   7.234  -0.461   0.050
   83    HB3  LEU  13           HB1      LEU  13   7.972   1.137   0.074
   84    HG   LEU  13           HG       LEU  13   8.668  -0.981   2.116
   85   HD11  LEU  13          HD11      LEU  13   9.088  -1.616  -0.365
   86   HD12  LEU  13          HD12      LEU  13  10.438  -1.743   0.762
   87   HD13  LEU  13          HD13      LEU  13  10.323  -0.357  -0.323
   88   HD21  LEU  13          HD21      LEU  13   9.639   1.733   1.337
   89   HD22  LEU  13          HD22      LEU  13  10.851   0.556   1.840
   90   HD23  LEU  13          HD23      LEU  13   9.542   0.995   2.935
   91    H    TYR  14           H        TYR  14   8.110   0.208   3.817
   92    HA   TYR  14           HA       TYR  14   7.175  -2.453   4.308
   93    HB2  TYR  14           HB2      TYR  14   8.158  -2.082   6.639
   94    HB3  TYR  14           HB1      TYR  14   9.272  -1.909   5.288
   95    HD1  TYR  14           HD1      TYR  14   7.186  -0.032   7.729
   96    HD2  TYR  14           HD2      TYR  14  10.329   0.178   4.804
   97    HE1  TYR  14           HE1      TYR  14   7.735   2.267   8.483
   98    HE2  TYR  14           HE2      TYR  14  10.876   2.477   5.557
   99    HH   TYR  14           HH       TYR  14  10.327   4.148   6.907
  100    H    GLN  15           H        GLN  15   5.965   0.675   5.130
  101    HA   GLN  15           HA       GLN  15   4.163  -0.242   7.201
  102    HB2  GLN  15           HB2      GLN  15   3.595   1.974   7.398
  103    HB3  GLN  15           HB1      GLN  15   5.105   2.186   6.528
  104    HG2  GLN  15           HG2      GLN  15   3.777   3.441   5.145
  105    HG3  GLN  15           HG1      GLN  15   3.434   1.865   4.433
  106   HE21  GLN  15          HE21      GLN  15   1.898   1.082   6.965
  107   HE22  GLN  15          HE22      GLN  15   0.404   1.874   6.811
  108    H    LEU  16           H        LEU  16   4.136  -0.019   3.732
  109    HA   LEU  16           HA       LEU  16   1.308  -0.232   3.308
  110    HB2  LEU  16           HB2      LEU  16   3.771  -0.735   1.686
  111    HB3  LEU  16           HB1      LEU  16   2.253  -1.416   1.109
  112    HG   LEU  16           HG       LEU  16   2.900   0.952   0.301
  113   HD11  LEU  16          HD11      LEU  16   0.299  -0.053   1.327
  114   HD12  LEU  16          HD12      LEU  16   0.743   0.463  -0.300
  115   HD13  LEU  16          HD13      LEU  16   0.375   1.666   0.936
  116   HD21  LEU  16          HD21      LEU  16   1.822   1.638   3.050
  117   HD22  LEU  16          HD22      LEU  16   2.312   2.777   1.796
  118   HD23  LEU  16          HD23      LEU  16   3.517   1.762   2.583
  119    H    GLU  17           H        GLU  17   3.846  -2.568   3.970
  120    HA   GLU  17           HA       GLU  17   2.561  -4.964   3.260
  121    HB2  GLU  17           HB2      GLU  17   4.705  -5.364   4.024
  122    HB3  GLU  17           HB1      GLU  17   4.582  -4.168   5.312
  123    HG2  GLU  17           HG2      GLU  17   3.510  -5.642   6.765
  124    HG3  GLU  17           HG1      GLU  17   2.902  -6.652   5.453
  125    H    ASN  18           H        ASN  18   1.762  -2.683   5.727
  126    HA   ASN  18           HA       ASN  18   0.353  -4.340   7.555
  127    HB2  ASN  18           HB2      ASN  18   0.876  -1.656   7.376
  128    HB3  ASN  18           HB1      ASN  18  -0.858  -1.702   7.058
  129   HD21  ASN  18          HD21      ASN  18  -1.059  -0.631   9.258
  130   HD22  ASN  18          HD22      ASN  18  -1.012  -1.608  10.645
  131    H    TYR  19           H        TYR  19  -0.479  -3.304   4.356
  132    HA   TYR  19           HA       TYR  19  -3.296  -4.179   4.762
  133    HB2  TYR  19           HB2      TYR  19  -2.371  -3.109   2.134
  134    HB3  TYR  19           HB1      TYR  19  -3.897  -2.856   2.975
  135    HD1  TYR  19           HD2      TYR  19  -3.441  -1.729   5.466
  136    HD2  TYR  19           HD1      TYR  19  -1.079  -1.186   1.916
  137    HE1  TYR  19           HE2      TYR  19  -2.602   0.432   6.352
  138    HE2  TYR  19           HE1      TYR  19  -0.241   0.974   2.805
  139    HH   TYR  19           HH       TYR  19  -1.337   2.211   5.967
  140    H    CYS  20           H        CYS  20  -1.880  -6.365   4.935
  141    HA   CYS  20           HA       CYS  20  -2.057  -7.607   2.240
  142    HB2  CYS  20           HB2      CYS  20   0.206  -7.580   4.155
  143    HB3  CYS  20           HB1      CYS  20  -0.143  -9.129   3.386
  144    H    ASN  21           H        ASN  21  -2.041  -8.145   5.728
  145    HA   ASN  21           HA       ASN  21  -4.110 -10.236   5.352
  146    HB2  ASN  21           HB2      ASN  21  -1.365 -10.636   6.473
  147    HB3  ASN  21           HB1      ASN  21  -2.704 -11.490   7.241
  148   HD21  ASN  21          HD21      ASN  21  -0.604 -12.816   5.709
  149   HD22  ASN  21          HD22      ASN  21  -1.339 -13.526   4.353
  150    H1   PHE   1           HT1      PHE   1   8.777   1.444  -1.762
  151    H2   PHE   1           HT2      PHE   1  10.248   0.804  -2.321
  152    H3   PHE   1           HT3      PHE   1   8.779   0.066  -2.749
  153    HA   PHE   1           HA       PHE   1   9.733   1.389  -4.571
  154    HB2  PHE   1           HB2      PHE   1   7.579   2.921  -4.726
  155    HB3  PHE   1           HB1      PHE   1   7.438   1.167  -4.849
  156    HD1  PHE   1           HD2      PHE   1   6.592  -0.171  -2.967
  157    HD2  PHE   1           HD1      PHE   1   6.846   4.112  -2.734
  158    HE1  PHE   1           HE2      PHE   1   5.122  -0.193  -0.969
  159    HE2  PHE   1           HE1      PHE   1   5.376   4.091  -0.735
  160    HZ   PHE   1           HZ       PHE   1   4.513   1.938   0.147
  161    H    VAL   2           H        VAL   2   9.152   3.954  -5.196
  162    HA   VAL   2           HA       VAL   2  11.095   5.437  -3.578
  163    HB   VAL   2           HB       VAL   2  10.640   7.255  -5.267
  164   HG11  VAL   2          HG11      VAL   2  12.413   6.164  -6.155
  165   HG12  VAL   2          HG12      VAL   2  11.248   5.377  -7.220
  166   HG13  VAL   2          HG13      VAL   2  11.751   4.586  -5.726
  167   HG21  VAL   2          HG21      VAL   2   8.869   7.116  -6.663
  168   HG22  VAL   2          HG22      VAL   2   8.302   5.775  -5.666
  169   HG23  VAL   2          HG23      VAL   2   9.270   5.456  -7.106
  170    H    ASN   3           H        ASN   3  10.203   7.998  -3.523
  171    HA   ASN   3           HA       ASN   3   7.817   7.805  -1.739
  172    HB2  ASN   3           HB2      ASN   3  10.126   9.752  -1.869
  173    HB3  ASN   3           HB1      ASN   3   8.661  10.098  -0.950
  174   HD21  ASN   3          HD21      ASN   3  11.361   9.637   0.182
  175   HD22  ASN   3          HD22      ASN   3  11.230   8.277   1.188
  176    H    GLN   4           H        GLN   4   6.085   8.143  -3.117
  177    HA   GLN   4           HA       GLN   4   5.748  10.834  -4.185
  178    HB2  GLN   4           HB2      GLN   4   5.130   9.761  -6.503
  179    HB3  GLN   4           HB1      GLN   4   6.817  10.119  -6.139
  180    HG2  GLN   4           HG2      GLN   4   6.926   7.915  -6.937
  181    HG3  GLN   4           HG1      GLN   4   6.877   7.681  -5.192
  182   HE21  GLN   4          HE21      GLN   4   5.998   5.498  -6.494
  183   HE22  GLN   4          HE22      GLN   4   4.304   5.395  -6.512
  184    H    HIS   5           H        HIS   5   3.506  11.033  -5.150
  185    HA   HIS   5           HA       HIS   5   1.585   9.745  -3.423
  186    HB2  HIS   5           HB2      HIS   5   0.980  11.235  -5.984
  187    HB3  HIS   5           HB1      HIS   5  -0.067  11.041  -4.577
  188    HD2  HIS   5           HD2      HIS   5   3.232  13.003  -5.538
  189    HE1  HIS   5           HE1      HIS   5   1.572  14.702  -2.040
  190    HE2  HIS   5           HE2      HIS   5   3.407  14.930  -3.797
  191    H    LEU   6           H        LEU   6   0.255   7.988  -3.847
  192    HA   LEU   6           HA       LEU   6   0.107   6.899  -6.569
  193    HB2  LEU   6           HB2      LEU   6   0.906   4.669  -5.909
  194    HB3  LEU   6           HB1      LEU   6   2.166   5.875  -5.727
  195    HG   LEU   6           HG       LEU   6   2.221   4.413  -3.807
  196   HD11  LEU   6          HD11      LEU   6   2.229   7.064  -3.569
  197   HD12  LEU   6          HD12      LEU   6   2.340   6.007  -2.163
  198   HD13  LEU   6          HD13      LEU   6   0.793   6.732  -2.601
  199   HD21  LEU   6          HD21      LEU   6  -0.494   4.145  -4.185
  200   HD22  LEU   6          HD22      LEU   6  -0.404   5.099  -2.702
  201   HD23  LEU   6          HD23      LEU   6   0.407   3.538  -2.798
  202    H    CYS   7           H        CYS   7  -1.663   5.457  -6.844
  203    HA   CYS   7           HA       CYS   7  -3.295   4.698  -4.520
  204    HB2  CYS   7           HB2      CYS   7  -4.251   6.736  -6.547
  205    HB3  CYS   7           HB1      CYS   7  -5.338   5.849  -5.481
  206    H    GLY   8           H        GLY   8  -5.374   3.592  -5.351
  207    HA2  GLY   8           HA2      GLY   8  -6.268   1.793  -6.556
  208    HA3  GLY   8           HA1      GLY   8  -5.803   2.728  -7.972
  209    H    SER   9           H        SER   9  -4.781   1.375  -9.336
  210    HA   SER   9           HA       SER   9  -3.534  -1.055  -8.729
  211    HB2  SER   9           HB2      SER   9  -3.739   0.669 -11.022
  212    HB3  SER   9           HB1      SER   9  -2.087   0.074 -10.893
  213    HG   SER   9           HG       SER   9  -3.560  -1.328 -12.050
  214    H    ASP  10           H        ASP  10  -2.387   2.150  -8.203
  215    HA   ASP  10           HA       ASP  10   0.423   1.396  -8.041
  216    HB2  ASP  10           HB2      ASP  10  -0.783   3.819  -6.723
  217    HB3  ASP  10           HB1      ASP  10   0.831   3.630  -7.412
  218    H    LEU  11           H        LEU  11  -2.308   1.572  -5.874
  219    HA   LEU  11           HA       LEU  11  -0.918   1.404  -3.392
  220    HB2  LEU  11           HB2      LEU  11  -3.655   0.804  -4.349
  221    HB3  LEU  11           HB1      LEU  11  -3.144  -0.129  -2.951
  222    HG   LEU  11           HG       LEU  11  -3.093   1.698  -1.569
  223   HD11  LEU  11          HD11      LEU  11  -2.011   3.079  -3.965
  224   HD12  LEU  11          HD12      LEU  11  -1.481   3.149  -2.284
  225   HD13  LEU  11          HD13      LEU  11  -2.875   4.091  -2.807
  226   HD21  LEU  11          HD21      LEU  11  -4.733   3.414  -3.223
  227   HD22  LEU  11          HD22      LEU  11  -5.190   2.476  -1.801
  228   HD23  LEU  11          HD23      LEU  11  -5.231   1.732  -3.399
  229    H    VAL  12           H        VAL  12  -1.753  -1.020  -5.805
  230    HA   VAL  12           HA       VAL  12  -0.707  -3.168  -4.102
  231    HB   VAL  12           HB       VAL  12  -0.828  -4.530  -6.257
  232   HG11  VAL  12          HG11      VAL  12  -2.640  -4.000  -4.319
  233   HG12  VAL  12          HG12      VAL  12  -2.930  -5.132  -5.639
  234   HG13  VAL  12          HG13      VAL  12  -3.544  -3.482  -5.741
  235   HG21  VAL  12          HG21      VAL  12  -2.366  -2.090  -7.179
  236   HG22  VAL  12          HG22      VAL  12  -2.191  -3.610  -8.056
  237   HG23  VAL  12          HG23      VAL  12  -0.786  -2.581  -7.787
  238    H    GLU  13           H        GLU  13   0.400  -1.376  -7.004
  239    HA   GLU  13           HA       GLU  13   2.787  -2.679  -7.533
  240    HB2  GLU  13           HB2      GLU  13   2.363  -0.761  -8.858
  241    HB3  GLU  13           HB1      GLU  13   2.128   0.265  -7.444
  242    HG2  GLU  13           HG2      GLU  13   4.334   0.725  -7.289
  243    HG3  GLU  13           HG1      GLU  13   4.776  -0.971  -7.490
  244    H    ALA  14           H        ALA  14   1.896  -0.731  -4.831
  245    HA   ALA  14           HA       ALA  14   4.530  -0.673  -3.586
  246    HB1  ALA  14           HB1      ALA  14   1.833   0.387  -3.078
  247    HB2  ALA  14           HB2      ALA  14   3.401   1.097  -2.696
  248    HB3  ALA  14           HB3      ALA  14   2.687  -0.100  -1.615
  249    H    LEU  15           H        LEU  15   1.429  -2.168  -2.751
  250    HA   LEU  15           HA       LEU  15   2.581  -3.953  -0.777
  251    HB2  LEU  15           HB2      LEU  15  -0.109  -3.704  -2.119
  252    HB3  LEU  15           HB1      LEU  15   0.243  -5.040  -1.023
  253    HG   LEU  15           HG       LEU  15   1.100  -2.505   0.112
  254   HD11  LEU  15          HD11      LEU  15  -1.846  -2.578   0.115
  255   HD12  LEU  15          HD12      LEU  15  -1.145  -2.186  -1.456
  256   HD13  LEU  15          HD13      LEU  15  -0.755  -1.200  -0.045
  257   HD21  LEU  15          HD21      LEU  15  -0.756  -4.769   0.862
  258   HD22  LEU  15          HD22      LEU  15  -0.555  -3.358   1.899
  259   HD23  LEU  15          HD23      LEU  15   0.829  -4.387   1.535
  260    H    TYR  16           H        TYR  16   2.801  -3.987  -4.059
  261    HA   TYR  16           HA       TYR  16   2.385  -6.857  -4.494
  262    HB2  TYR  16           HB2      TYR  16   1.738  -5.806  -6.425
  263    HB3  TYR  16           HB1      TYR  16   2.802  -4.434  -6.155
  264    HD1  TYR  16           HD1      TYR  16   2.971  -8.084  -6.978
  265    HD2  TYR  16           HD2      TYR  16   4.664  -4.172  -7.499
  266    HE1  TYR  16           HE1      TYR  16   4.606  -9.010  -8.605
  267    HE2  TYR  16           HE2      TYR  16   6.301  -5.092  -9.126
  268    HH   TYR  16           HH       TYR  16   6.317  -7.199 -10.723
  269    H    LEU  17           H        LEU  17   5.101  -4.550  -4.458
  270    HA   LEU  17           HA       LEU  17   6.968  -6.826  -4.760
  271    HB2  LEU  17           HB2      LEU  17   8.576  -4.630  -4.415
  272    HB3  LEU  17           HB1      LEU  17   8.051  -5.274  -5.961
  273    HG   LEU  17           HG       LEU  17   6.021  -3.772  -5.795
  274   HD11  LEU  17          HD11      LEU  17   5.656  -2.612  -3.905
  275   HD12  LEU  17          HD12      LEU  17   7.235  -1.840  -4.049
  276   HD13  LEU  17          HD13      LEU  17   7.078  -3.372  -3.190
  277   HD21  LEU  17          HD21      LEU  17   7.156  -2.220  -7.002
  278   HD22  LEU  17          HD22      LEU  17   8.534  -3.295  -6.766
  279   HD23  LEU  17          HD23      LEU  17   8.304  -1.908  -5.701
  280    H    VAL  18           H        VAL  18   5.457  -5.162  -2.275
  281    HA   VAL  18           HA       VAL  18   7.673  -5.555  -0.358
  282    HB   VAL  18           HB       VAL  18   6.317  -4.445   1.256
  283   HG11  VAL  18          HG11      VAL  18   6.266  -3.349  -1.509
  284   HG12  VAL  18          HG12      VAL  18   6.986  -2.676  -0.047
  285   HG13  VAL  18          HG13      VAL  18   5.247  -2.547  -0.314
  286   HG21  VAL  18          HG21      VAL  18   4.244  -5.632   1.009
  287   HG22  VAL  18          HG22      VAL  18   4.038  -5.038  -0.638
  288   HG23  VAL  18          HG23      VAL  18   3.895  -3.926   0.723
  289    H    CYS  19           H        CYS  19   4.431  -6.786  -1.011
  290    HA   CYS  19           HA       CYS  19   4.799  -8.922   1.006
  291    HB2  CYS  19           HB2      CYS  19   2.511  -7.734  -0.449
  292    HB3  CYS  19           HB1      CYS  19   2.409  -9.475  -0.188
  293    H    GLY  20           H        GLY  20   4.089  -8.647  -2.492
  294    HA2  GLY  20           HA2      GLY  20   4.567 -10.127  -4.247
  295    HA3  GLY  20           HA1      GLY  20   5.884 -10.729  -3.240
  296    H    GLU  21           H        GLU  21   2.820 -11.455  -4.533
  297    HA   GLU  21           HA       GLU  21   1.313 -13.229  -4.154
  298    HB2  GLU  21           HB2      GLU  21   3.644 -14.200  -4.955
  299    HB3  GLU  21           HB1      GLU  21   3.666 -14.883  -3.330
  300    HG2  GLU  21           HG2      GLU  21   1.737 -16.166  -3.701
  301    HG3  GLU  21           HG1      GLU  21   1.216 -15.162  -5.054
  302    H    ARG  22           H        ARG  22   2.082 -11.552  -1.759
  303    HA   ARG  22           HA       ARG  22   1.841 -13.566   0.413
  304    HB2  ARG  22           HB2      ARG  22   3.284 -11.212   0.243
  305    HB3  ARG  22           HB1      ARG  22   1.877 -10.737   1.196
  306    HG2  ARG  22           HG2      ARG  22   2.362 -12.232   2.913
  307    HG3  ARG  22           HG1      ARG  22   3.285 -13.303   1.856
  308    HD2  ARG  22           HD2      ARG  22   4.525 -10.705   1.894
  309    HD3  ARG  22           HD1      ARG  22   4.293 -11.265   3.549
  310    HE   ARG  22           HE       ARG  22   6.320 -12.225   1.885
  311   HH11  ARG  22          HH21      ARG  22   4.879 -13.102   4.675
  312   HH12  ARG  22          HH22      ARG  22   5.035 -14.815   4.479
  313   HH21  ARG  22          HH11      ARG  22   5.984 -14.614   1.150
  314   HH22  ARG  22          HH12      ARG  22   5.664 -15.671   2.485
  315    H    GLY  23           H        GLY  23  -0.344 -12.690  -1.536
  316    HA2  GLY  23           HA2      GLY  23  -2.692 -12.594  -1.279
  317    HA3  GLY  23           HA1      GLY  23  -2.461 -12.525   0.468
  318    H    ALA  24           H        ALA  24  -3.749 -10.781  -1.929
  319    HA   ALA  24           HA       ALA  24  -2.872  -8.170  -0.760
  320    HB1  ALA  24           HB1      ALA  24  -4.117  -7.476  -3.083
  321    HB2  ALA  24           HB2      ALA  24  -3.452  -9.048  -3.529
  322    HB3  ALA  24           HB3      ALA  24  -2.383  -7.768  -2.955
  323    H    PHE  25           H        PHE  25  -5.678  -8.684  -2.816
  324    HA   PHE  25           HA       PHE  25  -7.895  -7.964  -2.425
  325    HB2  PHE  25           HB2      PHE  25  -8.812  -9.271  -0.342
  326    HB3  PHE  25           HB1      PHE  25  -8.287 -10.167  -1.765
  327    HD1  PHE  25           HD1      PHE  25  -7.466  -9.234   1.704
  328    HD2  PHE  25           HD2      PHE  25  -6.190 -11.426  -1.767
  329    HE1  PHE  25           HE1      PHE  25  -5.778 -10.429   3.077
  330    HE2  PHE  25           HE2      PHE  25  -4.503 -12.620  -0.394
  331    HZ   PHE  25           HZ       PHE  25  -4.298 -12.121   2.029
  332    H    TYR  26           H        TYR  26  -6.465  -5.858  -1.674
  333    HA   TYR  26           HA       TYR  26  -6.748  -5.190   1.144
  334    HB2  TYR  26           HB2      TYR  26  -5.933  -2.998   0.504
  335    HB3  TYR  26           HB1      TYR  26  -4.998  -4.210  -0.371
  336    HD1  TYR  26           HD2      TYR  26  -5.492  -4.687  -2.773
  337    HD2  TYR  26           HD1      TYR  26  -7.396  -1.475  -0.646
  338    HE1  TYR  26           HE2      TYR  26  -6.194  -3.677  -4.928
  339    HE2  TYR  26           HE1      TYR  26  -8.099  -0.465  -2.801
  340    HH   TYR  26           HH       TYR  26  -7.132  -0.601  -5.296
  341    H    THR  27           H        THR  27  -8.997  -5.484  -1.283
  342    HA   THR  27           HA       THR  27 -10.652  -3.190  -0.385
  343    HB   THR  27           HB       THR  27 -10.434  -3.734  -2.831
  344    HG1  THR  27           HG1      THR  27 -12.239  -2.625  -2.236
  345   HG21  THR  27          HG21      THR  27 -12.336  -5.984  -2.554
  346   HG22  THR  27          HG22      THR  27 -10.681  -6.324  -2.047
  347   HG23  THR  27          HG23      THR  27 -11.004  -5.767  -3.689
  348    H    LYS  28           H        LYS  28 -11.898  -3.564   1.382
  349    HA   LYS  28           HA       LYS  28 -13.505  -6.044   1.487
  350    HB2  LYS  28           HB2      LYS  28 -12.852  -6.404   3.889
  351    HB3  LYS  28           HB1      LYS  28 -11.539  -6.697   2.750
  352    HG2  LYS  28           HG2      LYS  28 -11.318  -3.983   3.291
  353    HG3  LYS  28           HG1      LYS  28 -11.753  -4.675   4.853
  354    HD2  LYS  28           HD2      LYS  28  -9.934  -6.405   4.468
  355    HD3  LYS  28           HD1      LYS  28  -9.414  -5.435   3.089
  356    HE2  LYS  28           HE2      LYS  28  -8.073  -4.696   4.915
  357    HE3  LYS  28           HE1      LYS  28  -9.311  -3.455   4.714
  358    HZ1  LYS  28           HZ1      LYS  28 -10.604  -4.898   6.401
  359    HZ2  LYS  28           HZ2      LYS  28  -9.381  -3.859   6.960
  360    HZ3  LYS  28           HZ3      LYS  28  -9.076  -5.522   6.794
  361    HA   PRO  29           HA       PRO  29 -15.656  -2.201   2.895
  362    HB2  PRO  29           HB2      PRO  29 -17.691  -2.376   1.053
  363    HB3  PRO  29           HB1      PRO  29 -16.171  -1.513   0.757
  364    HG2  PRO  29           HG2      PRO  29 -17.072  -4.147  -0.311
  365    HG3  PRO  29           HG1      PRO  29 -15.931  -2.985  -1.007
  366    HD2  PRO  29           HD2      PRO  29 -15.244  -5.371   0.353
  367    HD3  PRO  29           HD1      PRO  29 -14.135  -4.045  -0.057
  368    H    THR  30           H        THR  30 -18.308  -2.182   3.165
  369    HA   THR  30           HA       THR  30 -20.130  -3.141   4.290
  370    HB   THR  30           HB       THR  30 -20.772  -5.277   3.645
  371    HG1  THR  30           HG1      THR  30 -18.128  -6.137   3.260
  372   HG21  THR  30          HG21      THR  30 -18.571  -4.929   1.614
  373   HG22  THR  30          HG22      THR  30 -19.945  -3.823   1.668
  374   HG23  THR  30          HG23      THR  30 -20.207  -5.541   1.371
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1 -11.191   4.950   5.665
    2    H2   GLY   1           HT2      GLY   1 -11.380   5.725   4.166
    3    H3   GLY   1           HT3      GLY   1  -9.957   5.950   5.065
    4    HA2  GLY   1           HA1      GLY   1 -10.411   3.228   4.461
    5    HA3  GLY   1           HA2      GLY   1 -10.267   4.196   2.963
    6    H    ILE   2           H        ILE   2  -8.348   2.731   2.824
    7    HA   ILE   2           HA       ILE   2  -6.643   2.329   5.237
    8    HB   ILE   2           HB       ILE   2  -7.183   0.241   4.249
    9   HG12  ILE   2          HG12      ILE   2  -4.667   0.829   4.643
   10   HG13  ILE   2          HG11      ILE   2  -5.063  -0.639   3.755
   11   HG21  ILE   2          HG21      ILE   2  -6.400   0.175   1.624
   12   HG22  ILE   2          HG22      ILE   2  -7.047   1.810   1.759
   13   HG23  ILE   2          HG23      ILE   2  -8.059   0.425   2.166
   14   HD11  ILE   2          HD11      ILE   2  -3.404   1.441   2.878
   15   HD12  ILE   2          HD12      ILE   2  -4.899   1.657   1.972
   16   HD13  ILE   2          HD13      ILE   2  -4.037   0.122   1.895
   17    H    VAL   3           H        VAL   3  -6.681   3.685   1.997
   18    HA   VAL   3           HA       VAL   3  -3.797   4.365   2.198
   19    HB   VAL   3           HB       VAL   3  -4.047   5.131  -0.131
   20   HG11  VAL   3          HG11      VAL   3  -4.524   2.955  -1.124
   21   HG12  VAL   3          HG12      VAL   3  -5.358   2.440   0.339
   22   HG13  VAL   3          HG13      VAL   3  -3.619   2.731   0.371
   23   HG21  VAL   3          HG21      VAL   3  -6.111   5.897  -0.676
   24   HG22  VAL   3          HG22      VAL   3  -6.876   4.989   0.628
   25   HG23  VAL   3          HG23      VAL   3  -6.539   4.202  -0.915
   26    H    GLU   4           H        GLU   4  -6.466   5.631   3.463
   27    HA   GLU   4           HA       GLU   4  -6.917   8.221   2.714
   28    HB2  GLU   4           HB2      GLU   4  -7.306   8.784   5.047
   29    HB3  GLU   4           HB1      GLU   4  -7.851   7.131   4.765
   30    HG2  GLU   4           HG2      GLU   4  -5.570   6.358   5.568
   31    HG3  GLU   4           HG1      GLU   4  -5.273   8.020   6.079
   32    H    GLN   5           H        GLN   5  -3.895   6.985   4.011
   33    HA   GLN   5           HA       GLN   5  -2.813   9.761   4.007
   34    HB2  GLN   5           HB2      GLN   5  -0.789   8.289   5.058
   35    HB3  GLN   5           HB1      GLN   5  -2.069   9.005   6.032
   36    HG2  GLN   5           HG2      GLN   5  -3.367   6.891   5.839
   37    HG3  GLN   5           HG1      GLN   5  -2.030   6.176   4.937
   38   HE21  GLN   5          HE21      GLN   5  -0.910   4.801   6.328
   39   HE22  GLN   5          HE22      GLN   5  -0.498   5.167   7.934
   40    H    CYS   6           H        CYS   6  -1.573   6.488   3.167
   41    HA   CYS   6           HA       CYS   6   0.563   7.279   1.569
   42    HB2  CYS   6           HB2      CYS   6  -1.292   5.000   0.861
   43    HB3  CYS   6           HB1      CYS   6   0.428   5.129   0.502
   44    H    CYS   7           H        CYS   7  -2.850   7.465   0.851
   45    HA   CYS   7           HA       CYS   7  -2.338   8.045  -1.994
   46    HB2  CYS   7           HB2      CYS   7  -4.675   7.383  -0.344
   47    HB3  CYS   7           HB1      CYS   7  -4.984   8.620  -1.555
   48    H    THR   8           H        THR   8  -1.980   9.804   0.752
   49    HA   THR   8           HA       THR   8  -3.117  12.295  -0.433
   50    HB   THR   8           HB       THR   8  -2.699  13.266   1.843
   51    HG1  THR   8           HG1      THR   8  -2.176  11.785   3.482
   52   HG21  THR   8          HG21      THR   8  -4.445  11.780   2.995
   53   HG22  THR   8          HG22      THR   8  -4.421  10.807   1.524
   54   HG23  THR   8          HG23      THR   8  -4.912  12.501   1.456
   55    H    SER   9           H        SER   9  -0.262  11.674   1.635
   56    HA   SER   9           HA       SER   9   1.272  13.464  -0.196
   57    HB2  SER   9           HB2      SER   9   2.871  13.268   1.965
   58    HB3  SER   9           HB1      SER   9   1.580  14.461   1.846
   59    HG   SER   9           HG       SER   9   1.277  13.396   3.754
   60    H    ILE  10           H        ILE  10   2.861  11.344   2.081
   61    HA   ILE  10           HA       ILE  10   3.738   9.617  -0.196
   62    HB   ILE  10           HB       ILE  10   5.557  10.428   2.077
   63   HG12  ILE  10          HG12      ILE  10   4.875  12.498   0.976
   64   HG13  ILE  10          HG11      ILE  10   6.518  12.097   0.474
   65   HG21  ILE  10          HG21      ILE  10   7.191   9.955   0.061
   66   HG22  ILE  10          HG22      ILE  10   5.816   9.058  -0.581
   67   HG23  ILE  10          HG23      ILE  10   6.512   8.610   0.976
   68   HD11  ILE  10          HD11      ILE  10   4.744  10.776  -1.317
   69   HD12  ILE  10          HD12      ILE  10   5.850  12.103  -1.673
   70   HD13  ILE  10          HD13      ILE  10   4.195  12.445  -1.170
   71    H    CYS  11           H        CYS  11   4.911   7.580   0.806
   72    HA   CYS  11           HA       CYS  11   3.979   6.759   3.443
   73    HB2  CYS  11           HB2      CYS  11   2.222   6.358   1.264
   74    HB3  CYS  11           HB1      CYS  11   2.928   4.781   1.623
   75    H    SER  12           H        SER  12   4.991   4.795   4.109
   76    HA   SER  12           HA       SER  12   7.313   4.046   2.422
   77    HB2  SER  12           HB2      SER  12   7.573   2.608   4.720
   78    HB3  SER  12           HB1      SER  12   8.220   4.231   4.497
   79    HG   SER  12           HG       SER  12   6.746   3.745   6.379
   80    H    LEU  13           H        LEU  13   7.368   2.118   1.339
   81    HA   LEU  13           HA       LEU  13   5.069   0.489   1.124
   82    HB2  LEU  13           HB2      LEU  13   6.391  -1.067  -0.159
   83    HB3  LEU  13           HB1      LEU  13   6.884   0.561  -0.582
   84    HG   LEU  13           HG       LEU  13   8.863  -0.793  -0.369
   85   HD11  LEU  13          HD11      LEU  13  10.109   0.408   1.327
   86   HD12  LEU  13          HD12      LEU  13   8.620   0.860   2.151
   87   HD13  LEU  13          HD13      LEU  13   8.973   1.513   0.554
   88   HD21  LEU  13          HD21      LEU  13   8.609  -1.405   2.495
   89   HD22  LEU  13          HD22      LEU  13   9.163  -2.428   1.169
   90   HD23  LEU  13          HD23      LEU  13   7.437  -2.245   1.481
   91    H    TYR  14           H        TYR  14   7.543   0.456   3.540
   92    HA   TYR  14           HA       TYR  14   6.993  -2.286   4.350
   93    HB2  TYR  14           HB2      TYR  14   8.086  -1.313   6.597
   94    HB3  TYR  14           HB1      TYR  14   9.058  -1.808   5.217
   95    HD1  TYR  14           HD2      TYR  14   9.873  -0.061   3.584
   96    HD2  TYR  14           HD1      TYR  14   7.991   0.955   7.312
   97    HE1  TYR  14           HE2      TYR  14  10.824   2.226   3.441
   98    HE2  TYR  14           HE1      TYR  14   8.951   3.239   7.174
   99    HH   TYR  14           HH       TYR  14   9.842   4.762   5.598
  100    H    GLN  15           H        GLN  15   5.725   0.858   5.035
  101    HA   GLN  15           HA       GLN  15   4.148  -0.018   7.312
  102    HB2  GLN  15           HB2      GLN  15   3.332   2.207   7.327
  103    HB3  GLN  15           HB1      GLN  15   4.997   2.350   6.791
  104    HG2  GLN  15           HG2      GLN  15   4.361   3.226   4.825
  105    HG3  GLN  15           HG1      GLN  15   3.220   1.921   4.537
  106   HE21  GLN  15          HE21      GLN  15   3.487   4.817   6.685
  107   HE22  GLN  15          HE22      GLN  15   1.855   5.258   6.532
  108    H    LEU  16           H        LEU  16   3.920  -0.060   3.880
  109    HA   LEU  16           HA       LEU  16   1.034  -0.261   3.674
  110    HB2  LEU  16           HB2      LEU  16   3.379  -0.731   1.862
  111    HB3  LEU  16           HB1      LEU  16   1.821  -1.416   1.410
  112    HG   LEU  16           HG       LEU  16   2.431   0.970   0.569
  113   HD11  LEU  16          HD11      LEU  16  -0.106  -0.101   1.665
  114   HD12  LEU  16          HD12      LEU  16   0.268   0.461   0.037
  115   HD13  LEU  16          HD13      LEU  16  -0.085   1.625   1.313
  116   HD21  LEU  16          HD21      LEU  16   1.609   1.514   3.435
  117   HD22  LEU  16          HD22      LEU  16   1.657   2.743   2.172
  118   HD23  LEU  16          HD23      LEU  16   3.143   1.936   2.675
  119    H    GLU  17           H        GLU  17   3.654  -2.451   4.365
  120    HA   GLU  17           HA       GLU  17   2.502  -4.933   3.684
  121    HB2  GLU  17           HB2      GLU  17   4.678  -5.160   4.473
  122    HB3  GLU  17           HB1      GLU  17   4.435  -4.003   5.779
  123    HG2  GLU  17           HG2      GLU  17   3.626  -5.588   7.215
  124    HG3  GLU  17           HG1      GLU  17   2.810  -6.482   5.930
  125    H    ASN  18           H        ASN  18   1.626  -2.645   6.128
  126    HA   ASN  18           HA       ASN  18   0.244  -4.309   7.968
  127    HB2  ASN  18           HB2      ASN  18   0.287  -1.453   7.268
  128    HB3  ASN  18           HB1      ASN  18  -1.268  -2.001   7.897
  129   HD21  ASN  18          HD21      ASN  18   1.137  -0.396   9.124
  130   HD22  ASN  18          HD22      ASN  18   1.387  -1.170  10.614
  131    H    TYR  19           H        TYR  19  -0.491  -3.486   4.719
  132    HA   TYR  19           HA       TYR  19  -3.319  -4.354   5.054
  133    HB2  TYR  19           HB2      TYR  19  -2.235  -3.350   2.450
  134    HB3  TYR  19           HB1      TYR  19  -3.842  -3.146   3.146
  135    HD1  TYR  19           HD2      TYR  19  -2.996  -2.260   5.923
  136    HD2  TYR  19           HD1      TYR  19  -1.671  -1.063   2.014
  137    HE1  TYR  19           HE2      TYR  19  -2.316  -0.053   6.829
  138    HE2  TYR  19           HE1      TYR  19  -0.992   1.145   2.921
  139    HH   TYR  19           HH       TYR  19  -1.712   2.594   4.954
  140    H    CYS  20           H        CYS  20  -1.086  -6.242   5.155
  141    HA   CYS  20           HA       CYS  20  -1.597  -7.756   2.642
  142    HB2  CYS  20           HB2      CYS  20   0.828  -7.457   4.362
  143    HB3  CYS  20           HB1      CYS  20   0.575  -8.997   3.538
  144    H    ASN  21           H        ASN  21  -1.577  -7.844   6.126
  145    HA   ASN  21           HA       ASN  21  -2.696 -10.613   6.008
  146    HB2  ASN  21           HB2      ASN  21  -1.152  -9.247   8.227
  147    HB3  ASN  21           HB1      ASN  21  -1.884 -10.845   8.351
  148   HD21  ASN  21          HD21      ASN  21   0.891  -9.106   7.200
  149   HD22  ASN  21          HD22      ASN  21   1.668 -10.421   6.458
  150    H1   PHE   1           HT1      PHE   1  11.846   1.029  -3.737
  151    H2   PHE   1           HT2      PHE   1  10.922  -0.017  -2.768
  152    H3   PHE   1           HT3      PHE   1  11.795   1.257  -2.058
  153    HA   PHE   1           HA       PHE   1   9.502   1.563  -3.920
  154    HB2  PHE   1           HB2      PHE   1   9.284   0.775  -1.370
  155    HB3  PHE   1           HB1      PHE   1   9.478   2.505  -1.088
  156    HD1  PHE   1           HD1      PHE   1   7.738   0.463  -3.723
  157    HD2  PHE   1           HD2      PHE   1   7.424   3.550  -0.747
  158    HE1  PHE   1           HE1      PHE   1   5.368   0.825  -4.348
  159    HE2  PHE   1           HE2      PHE   1   5.054   3.912  -1.374
  160    HZ   PHE   1           HZ       PHE   1   4.024   2.550  -3.176
  161    H    VAL   2           H        VAL   2   8.691   3.949  -3.534
  162    HA   VAL   2           HA       VAL   2  11.065   5.755  -3.362
  163    HB   VAL   2           HB       VAL   2   9.816   7.131  -5.154
  164   HG11  VAL   2          HG11      VAL   2  11.876   6.050  -5.729
  165   HG12  VAL   2          HG12      VAL   2  10.722   5.606  -6.986
  166   HG13  VAL   2          HG13      VAL   2  11.121   4.456  -5.710
  167   HG21  VAL   2          HG21      VAL   2   7.830   5.343  -4.758
  168   HG22  VAL   2          HG22      VAL   2   8.670   4.550  -6.091
  169   HG23  VAL   2          HG23      VAL   2   8.054   6.192  -6.287
  170    H    ASN   3           H        ASN   3  10.292   8.106  -3.057
  171    HA   ASN   3           HA       ASN   3   8.072   8.076  -1.068
  172    HB2  ASN   3           HB2      ASN   3  10.358  10.010  -1.537
  173    HB3  ASN   3           HB1      ASN   3   9.056  10.305  -0.386
  174   HD21  ASN   3          HD21      ASN   3   9.695   9.747   1.692
  175   HD22  ASN   3          HD22      ASN   3  10.694   8.433   2.090
  176    H    GLN   4           H        GLN   4   6.282   8.296  -2.488
  177    HA   GLN   4           HA       GLN   4   5.830  11.011  -3.466
  178    HB2  GLN   4           HB2      GLN   4   5.232  10.094  -5.796
  179    HB3  GLN   4           HB1      GLN   4   6.948  10.262  -5.425
  180    HG2  GLN   4           HG2      GLN   4   7.294   7.997  -5.344
  181    HG3  GLN   4           HG1      GLN   4   5.689   7.674  -4.686
  182   HE21  GLN   4          HE21      GLN   4   7.397   8.484  -7.729
  183   HE22  GLN   4          HE22      GLN   4   6.195   7.863  -8.754
  184    H    HIS   5           H        HIS   5   3.583  10.935  -4.703
  185    HA   HIS   5           HA       HIS   5   1.710   9.636  -2.866
  186    HB2  HIS   5           HB2      HIS   5   1.155  11.247  -5.373
  187    HB3  HIS   5           HB1      HIS   5  -0.015  10.830  -4.123
  188    HD2  HIS   5           HD2      HIS   5   3.591  12.245  -3.316
  189    HE1  HIS   5           HE1      HIS   5   0.683  15.010  -1.986
  190    HE2  HIS   5           HE2      HIS   5   3.176  14.465  -2.029
  191    H    LEU   6           H        LEU   6   0.435   7.842  -3.351
  192    HA   LEU   6           HA       LEU   6   0.446   6.827  -6.118
  193    HB2  LEU   6           HB2      LEU   6   1.108   4.550  -5.403
  194    HB3  LEU   6           HB1      LEU   6   2.391   5.723  -5.166
  195    HG   LEU   6           HG       LEU   6   2.279   4.256  -3.244
  196   HD11  LEU   6          HD11      LEU   6   2.498   5.869  -1.650
  197   HD12  LEU   6          HD12      LEU   6   0.968   6.639  -2.063
  198   HD13  LEU   6          HD13      LEU   6   2.400   6.933  -3.052
  199   HD21  LEU   6          HD21      LEU   6  -0.347   5.133  -2.268
  200   HD22  LEU   6          HD22      LEU   6   0.386   3.531  -2.265
  201   HD23  LEU   6          HD23      LEU   6  -0.418   4.124  -3.715
  202    H    CYS   7           H        CYS   7  -1.323   5.508  -6.598
  203    HA   CYS   7           HA       CYS   7  -3.193   4.695  -4.482
  204    HB2  CYS   7           HB2      CYS   7  -3.929   6.821  -6.520
  205    HB3  CYS   7           HB1      CYS   7  -5.097   5.968  -5.514
  206    H    GLY   8           H        GLY   8  -5.157   3.618  -5.527
  207    HA2  GLY   8           HA2      GLY   8  -5.998   1.968  -6.954
  208    HA3  GLY   8           HA1      GLY   8  -5.294   2.921  -8.256
  209    H    SER   9           H        SER   9  -4.382   1.349  -9.499
  210    HA   SER   9           HA       SER   9  -3.190  -1.052  -8.673
  211    HB2  SER   9           HB2      SER   9  -1.952   0.363 -10.983
  212    HB3  SER   9           HB1      SER   9  -2.530  -1.295 -10.863
  213    HG   SER   9           HG       SER   9  -4.681  -0.364 -10.809
  214    H    ASP  10           H        ASP  10  -2.006   2.164  -8.369
  215    HA   ASP  10           HA       ASP  10   0.801   1.464  -8.236
  216    HB2  ASP  10           HB2      ASP  10  -0.752   3.872  -7.278
  217    HB3  ASP  10           HB1      ASP  10   0.996   3.730  -7.093
  218    H    LEU  11           H        LEU  11  -1.825   1.664  -5.922
  219    HA   LEU  11           HA       LEU  11  -0.220   1.425  -3.558
  220    HB2  LEU  11           HB2      LEU  11  -3.053   0.512  -4.126
  221    HB3  LEU  11           HB1      LEU  11  -2.309   0.463  -2.530
  222    HG   LEU  11           HG       LEU  11  -2.112   3.050  -3.963
  223   HD11  LEU  11          HD11      LEU  11  -4.432   2.267  -4.478
  224   HD12  LEU  11          HD12      LEU  11  -4.406   3.693  -3.441
  225   HD13  LEU  11          HD13      LEU  11  -4.726   2.102  -2.749
  226   HD21  LEU  11          HD21      LEU  11  -2.728   3.811  -1.617
  227   HD22  LEU  11          HD22      LEU  11  -1.245   2.866  -1.722
  228   HD23  LEU  11          HD23      LEU  11  -2.729   2.111  -1.149
  229    H    VAL  12           H        VAL  12  -1.480  -0.882  -5.881
  230    HA   VAL  12           HA       VAL  12  -0.501  -3.147  -4.303
  231    HB   VAL  12           HB       VAL  12  -0.941  -4.464  -6.414
  232   HG11  VAL  12          HG11      VAL  12  -2.863  -3.071  -4.668
  233   HG12  VAL  12          HG12      VAL  12  -2.693  -4.791  -5.015
  234   HG13  VAL  12          HG13      VAL  12  -3.556  -3.746  -6.142
  235   HG21  VAL  12          HG21      VAL  12  -0.753  -2.630  -8.014
  236   HG22  VAL  12          HG22      VAL  12  -2.148  -1.830  -7.288
  237   HG23  VAL  12          HG23      VAL  12  -2.348  -3.371  -8.117
  238    H    GLU  13           H        GLU  13   0.540  -1.357  -7.222
  239    HA   GLU  13           HA       GLU  13   2.733  -2.897  -7.968
  240    HB2  GLU  13           HB2      GLU  13   2.365  -0.913  -9.231
  241    HB3  GLU  13           HB1      GLU  13   2.404   0.103  -7.791
  242    HG2  GLU  13           HG2      GLU  13   4.638   0.344  -7.936
  243    HG3  GLU  13           HG1      GLU  13   4.871  -1.400  -8.056
  244    H    ALA  14           H        ALA  14   2.284  -0.827  -5.226
  245    HA   ALA  14           HA       ALA  14   4.985  -1.083  -4.177
  246    HB1  ALA  14           HB1      ALA  14   2.455  -0.228  -2.750
  247    HB2  ALA  14           HB2      ALA  14   3.424   0.860  -3.744
  248    HB3  ALA  14           HB3      ALA  14   4.114   0.150  -2.284
  249    H    LEU  15           H        LEU  15   1.830  -2.145  -2.968
  250    HA   LEU  15           HA       LEU  15   2.888  -4.038  -1.081
  251    HB2  LEU  15           HB2      LEU  15   0.200  -3.410  -2.243
  252    HB3  LEU  15           HB1      LEU  15   0.397  -4.930  -1.370
  253    HG   LEU  15           HG       LEU  15   1.504  -2.473  -0.093
  254   HD11  LEU  15          HD11      LEU  15  -0.505  -1.498   0.445
  255   HD12  LEU  15          HD12      LEU  15  -1.370  -3.035   0.429
  256   HD13  LEU  15          HD13      LEU  15  -0.996  -2.218  -1.089
  257   HD21  LEU  15          HD21      LEU  15   0.409  -5.139   0.665
  258   HD22  LEU  15          HD22      LEU  15   0.173  -3.825   1.818
  259   HD23  LEU  15          HD23      LEU  15   1.802  -4.272   1.311
  260    H    TYR  16           H        TYR  16   2.815  -4.157  -4.403
  261    HA   TYR  16           HA       TYR  16   2.161  -6.970  -4.771
  262    HB2  TYR  16           HB2      TYR  16   1.573  -5.777  -6.662
  263    HB3  TYR  16           HB1      TYR  16   2.909  -4.646  -6.491
  264    HD1  TYR  16           HD1      TYR  16   2.726  -8.379  -6.788
  265    HD2  TYR  16           HD2      TYR  16   4.269  -4.686  -8.342
  266    HE1  TYR  16           HE1      TYR  16   4.058  -9.642  -8.464
  267    HE2  TYR  16           HE2      TYR  16   5.603  -5.942 -10.018
  268    HH   TYR  16           HH       TYR  16   5.412  -9.504 -10.219
  269    H    LEU  17           H        LEU  17   5.139  -4.994  -4.931
  270    HA   LEU  17           HA       LEU  17   6.686  -7.511  -5.170
  271    HB2  LEU  17           HB2      LEU  17   8.576  -5.524  -5.102
  272    HB3  LEU  17           HB1      LEU  17   7.865  -6.202  -6.558
  273    HG   LEU  17           HG       LEU  17   6.055  -4.444  -6.382
  274   HD11  LEU  17          HD11      LEU  17   7.995  -3.224  -4.396
  275   HD12  LEU  17          HD12      LEU  17   6.451  -3.958  -3.963
  276   HD13  LEU  17          HD13      LEU  17   6.487  -2.508  -4.966
  277   HD21  LEU  17          HD21      LEU  17   8.502  -2.842  -6.591
  278   HD22  LEU  17          HD22      LEU  17   7.285  -3.203  -7.817
  279   HD23  LEU  17          HD23      LEU  17   8.582  -4.354  -7.494
  280    H    VAL  18           H        VAL  18   5.602  -5.456  -2.735
  281    HA   VAL  18           HA       VAL  18   7.891  -5.942  -0.950
  282    HB   VAL  18           HB       VAL  18   6.730  -4.655   0.683
  283   HG11  VAL  18          HG11      VAL  18   5.593  -2.845  -1.024
  284   HG12  VAL  18          HG12      VAL  18   6.657  -3.731  -2.117
  285   HG13  VAL  18          HG13      VAL  18   7.321  -2.940  -0.688
  286   HG21  VAL  18          HG21      VAL  18   4.305  -4.028   0.308
  287   HG22  VAL  18          HG22      VAL  18   4.582  -5.735   0.658
  288   HG23  VAL  18          HG23      VAL  18   4.279  -5.213  -0.998
  289    H    CYS  19           H        CYS  19   4.544  -6.998  -1.298
  290    HA   CYS  19           HA       CYS  19   4.991  -9.089   0.764
  291    HB2  CYS  19           HB2      CYS  19   2.566  -7.873  -0.522
  292    HB3  CYS  19           HB1      CYS  19   2.447  -9.489   0.176
  293    H    GLY  20           H        GLY  20   4.563  -8.657  -2.678
  294    HA2  GLY  20           HA2      GLY  20   5.049 -10.217  -4.390
  295    HA3  GLY  20           HA1      GLY  20   5.385 -11.422  -3.145
  296    H    GLU  21           H        GLU  21   4.052 -13.123  -3.597
  297    HA   GLU  21           HA       GLU  21   1.212 -12.526  -4.296
  298    HB2  GLU  21           HB2      GLU  21   2.941 -14.144  -5.604
  299    HB3  GLU  21           HB1      GLU  21   2.243 -15.305  -4.474
  300    HG2  GLU  21           HG2      GLU  21   0.139 -13.665  -5.540
  301    HG3  GLU  21           HG1      GLU  21   1.092 -14.314  -6.877
  302    H    ARG  22           H        ARG  22   2.367 -12.466  -1.552
  303    HA   ARG  22           HA       ARG  22   1.279 -14.877  -0.258
  304    HB2  ARG  22           HB2      ARG  22   3.088 -12.740   0.464
  305    HB3  ARG  22           HB1      ARG  22   1.827 -12.905   1.687
  306    HG2  ARG  22           HG2      ARG  22   2.556 -15.538   1.015
  307    HG3  ARG  22           HG1      ARG  22   4.076 -14.650   1.143
  308    HD2  ARG  22           HD2      ARG  22   3.898 -14.530   3.387
  309    HD3  ARG  22           HD1      ARG  22   2.255 -13.899   3.277
  310    HE   ARG  22           HE       ARG  22   1.545 -16.050   3.888
  311   HH11  ARG  22          HH21      ARG  22   4.759 -16.462   3.909
  312   HH12  ARG  22          HH22      ARG  22   4.795 -18.051   3.222
  313   HH21  ARG  22          HH11      ARG  22   1.469 -17.992   2.243
  314   HH22  ARG  22          HH12      ARG  22   2.933 -18.918   2.279
  315    H    GLY  23           H        GLY  23  -0.294 -12.547  -1.710
  316    HA2  GLY  23           HA2      GLY  23  -2.632 -12.082  -1.439
  317    HA3  GLY  23           HA1      GLY  23  -2.512 -12.591   0.246
  318    H    ALA  24           H        ALA  24  -3.246  -9.959  -1.405
  319    HA   ALA  24           HA       ALA  24  -2.360  -8.168   0.741
  320    HB1  ALA  24           HB1      ALA  24  -1.268  -6.566  -0.812
  321    HB2  ALA  24           HB2      ALA  24  -1.444  -7.738  -2.117
  322    HB3  ALA  24           HB3      ALA  24  -0.407  -8.104  -0.738
  323    H    PHE  25           H        PHE  25  -4.791  -8.309   0.795
  324    HA   PHE  25           HA       PHE  25  -6.206  -6.904  -1.367
  325    HB2  PHE  25           HB2      PHE  25  -8.230  -7.394  -0.062
  326    HB3  PHE  25           HB1      PHE  25  -7.255  -8.853  -0.242
  327    HD1  PHE  25           HD2      PHE  25  -5.918  -9.723   1.648
  328    HD2  PHE  25           HD1      PHE  25  -8.495  -6.312   2.089
  329    HE1  PHE  25           HE2      PHE  25  -5.779  -9.937   4.116
  330    HE2  PHE  25           HE1      PHE  25  -8.357  -6.527   4.558
  331    HZ   PHE  25           HZ       PHE  25  -6.998  -8.340   5.571
  332    H    TYR  26           H        TYR  26  -7.096  -4.821  -1.161
  333    HA   TYR  26           HA       TYR  26  -6.367  -3.358   1.343
  334    HB2  TYR  26           HB2      TYR  26  -6.336  -1.339  -0.396
  335    HB3  TYR  26           HB1      TYR  26  -4.908  -2.341  -0.133
  336    HD1  TYR  26           HD2      TYR  26  -4.505  -4.326  -1.679
  337    HD2  TYR  26           HD1      TYR  26  -7.406  -1.267  -2.512
  338    HE1  TYR  26           HE2      TYR  26  -4.545  -5.014  -4.063
  339    HE2  TYR  26           HE1      TYR  26  -7.446  -1.955  -4.896
  340    HH   TYR  26           HH       TYR  26  -5.510  -4.721  -6.043
  341    H    THR  27           H        THR  27  -8.746  -3.949  -1.130
  342    HA   THR  27           HA       THR  27 -10.755  -2.573   0.548
  343    HB   THR  27           HB       THR  27 -11.677  -1.357  -1.427
  344    HG1  THR  27           HG1      THR  27 -10.860  -1.730  -3.309
  345   HG21  THR  27          HG21      THR  27  -9.779   0.324  -1.570
  346   HG22  THR  27          HG22      THR  27  -8.824  -0.792  -0.594
  347   HG23  THR  27          HG23      THR  27 -10.298  -0.084   0.065
  348    H    LYS  28           H        LYS  28 -12.959  -3.205  -0.030
  349    HA   LYS  28           HA       LYS  28 -13.088  -5.973  -0.928
  350    HB2  LYS  28           HB2      LYS  28 -14.755  -4.160   0.548
  351    HB3  LYS  28           HB1      LYS  28 -15.697  -4.855  -0.772
  352    HG2  LYS  28           HG2      LYS  28 -14.614  -7.115  -0.008
  353    HG3  LYS  28           HG1      LYS  28 -14.317  -6.256   1.504
  354    HD2  LYS  28           HD2      LYS  28 -16.431  -6.803   2.082
  355    HD3  LYS  28           HD1      LYS  28 -16.955  -5.612   0.891
  356    HE2  LYS  28           HE2      LYS  28 -18.009  -7.364  -0.098
  357    HE3  LYS  28           HE1      LYS  28 -16.404  -7.780  -0.700
  358    HZ1  LYS  28           HZ1      LYS  28 -16.186  -9.460   0.769
  359    HZ2  LYS  28           HZ2      LYS  28 -17.884  -9.448   0.715
  360    HZ3  LYS  28           HZ3      LYS  28 -17.066  -8.678   1.989
  361    HA   PRO  29           HA       PRO  29 -15.469  -4.025  -4.582
  362    HB2  PRO  29           HB2      PRO  29 -15.536  -1.281  -4.739
  363    HB3  PRO  29           HB1      PRO  29 -16.758  -2.243  -3.889
  364    HG2  PRO  29           HG2      PRO  29 -14.564  -0.572  -2.757
  365    HG3  PRO  29           HG1      PRO  29 -16.118  -1.024  -2.034
  366    HD2  PRO  29           HD2      PRO  29 -13.607  -2.193  -1.447
  367    HD3  PRO  29           HD1      PRO  29 -15.196  -2.835  -0.977
  368    H    THR  30           H        THR  30 -13.829  -4.675  -5.991
  369    HA   THR  30           HA       THR  30 -11.819  -2.587  -6.719
  370    HB   THR  30           HB       THR  30 -10.074  -4.207  -6.842
  371    HG1  THR  30           HG1      THR  30 -10.469  -6.254  -7.136
  372   HG21  THR  30          HG21      THR  30 -11.245  -3.579  -4.479
  373   HG22  THR  30          HG22      THR  30  -9.787  -4.563  -4.605
  374   HG23  THR  30          HG23      THR  30 -11.361  -5.338  -4.424
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1  -9.319   3.368   2.569
    2    H2   GLY   1           HT2      GLY   1 -10.555   4.486   2.895
    3    H3   GLY   1           HT3      GLY   1 -10.349   3.132   3.897
    4    HA2  GLY   1           HA1      GLY   1  -8.371   5.269   3.678
    5    HA3  GLY   1           HA2      GLY   1  -9.553   5.172   5.018
    6    H    ILE   2           H        ILE   2  -7.999   2.347   3.659
    7    HA   ILE   2           HA       ILE   2  -5.888   2.158   5.556
    8    HB   ILE   2           HB       ILE   2  -6.810   0.236   4.246
    9   HG12  ILE   2          HG12      ILE   2  -4.741  -0.946   4.090
   10   HG13  ILE   2          HG11      ILE   2  -3.840   0.528   3.738
   11   HG21  ILE   2          HG21      ILE   2  -5.034   0.783   1.955
   12   HG22  ILE   2          HG22      ILE   2  -6.417   1.870   2.079
   13   HG23  ILE   2          HG23      ILE   2  -6.671   0.127   1.978
   14   HD11  ILE   2          HD11      ILE   2  -4.019   1.311   5.960
   15   HD12  ILE   2          HD12      ILE   2  -3.705  -0.415   6.146
   16   HD13  ILE   2          HD13      ILE   2  -5.345   0.209   6.332
   17    H    VAL   3           H        VAL   3  -6.076   3.746   2.448
   18    HA   VAL   3           HA       VAL   3  -3.150   4.315   2.551
   19    HB   VAL   3           HB       VAL   3  -3.372   4.983   0.217
   20   HG11  VAL   3          HG11      VAL   3  -3.038   2.760  -0.012
   21   HG12  VAL   3          HG12      VAL   3  -4.748   2.693  -0.434
   22   HG13  VAL   3          HG13      VAL   3  -4.232   2.363   1.219
   23   HG21  VAL   3          HG21      VAL   3  -5.636   4.657  -0.878
   24   HG22  VAL   3          HG22      VAL   3  -5.542   6.023   0.234
   25   HG23  VAL   3          HG23      VAL   3  -6.317   4.525   0.744
   26    H    GLU   4           H        GLU   4  -5.591   5.598   4.005
   27    HA   GLU   4           HA       GLU   4  -6.229   8.143   3.232
   28    HB2  GLU   4           HB2      GLU   4  -5.860   8.791   5.728
   29    HB3  GLU   4           HB1      GLU   4  -7.035   7.532   5.350
   30    HG2  GLU   4           HG2      GLU   4  -5.897   6.139   6.701
   31    HG3  GLU   4           HG1      GLU   4  -4.542   6.220   5.577
   32    H    GLN   5           H        GLN   5  -3.013   7.043   4.059
   33    HA   GLN   5           HA       GLN   5  -2.021   9.836   3.971
   34    HB2  GLN   5           HB2      GLN   5   0.207   8.561   4.562
   35    HB3  GLN   5           HB1      GLN   5  -1.015   8.816   5.806
   36    HG2  GLN   5           HG2      GLN   5  -1.386   6.359   4.197
   37    HG3  GLN   5           HG1      GLN   5   0.061   6.377   5.198
   38   HE21  GLN   5          HE21      GLN   5  -0.824   7.837   7.441
   39   HE22  GLN   5          HE22      GLN   5  -2.071   6.982   8.212
   40    H    CYS   6           H        CYS   6  -0.213   6.974   2.893
   41    HA   CYS   6           HA       CYS   6   1.223   8.009   0.854
   42    HB2  CYS   6           HB2      CYS   6   0.018   5.363   1.298
   43    HB3  CYS   6           HB1      CYS   6   0.430   5.702  -0.382
   44    H    CYS   7           H        CYS   7  -2.257   7.353   0.621
   45    HA   CYS   7           HA       CYS   7  -2.378   7.941  -2.209
   46    HB2  CYS   7           HB2      CYS   7  -4.281   7.334  -0.074
   47    HB3  CYS   7           HB1      CYS   7  -4.892   8.494  -1.243
   48    H    THR   8           H        THR   8  -3.432   9.817   0.665
   49    HA   THR   8           HA       THR   8  -3.871  12.238  -0.838
   50    HB   THR   8           HB       THR   8  -4.909  11.809   1.382
   51    HG1  THR   8           HG1      THR   8  -4.077  14.005   0.464
   52   HG21  THR   8          HG21      THR   8  -2.841  10.729   2.346
   53   HG22  THR   8          HG22      THR   8  -3.600  11.920   3.403
   54   HG23  THR   8          HG23      THR   8  -2.146  12.341   2.498
   55    H    SER   9           H        SER   9  -1.173  11.134   1.225
   56    HA   SER   9           HA       SER   9   0.547  13.104  -0.212
   57    HB2  SER   9           HB2      SER   9   1.793  13.185   2.100
   58    HB3  SER   9           HB1      SER   9   0.361  14.178   1.850
   59    HG   SER   9           HG       SER   9  -0.590  13.066   3.349
   60    H    ILE  10           H        ILE  10   1.986  11.307   2.355
   61    HA   ILE  10           HA       ILE  10   2.778   9.097   0.549
   62    HB   ILE  10           HB       ILE  10   4.950  10.531   2.042
   63   HG12  ILE  10          HG12      ILE  10   3.615  12.205   0.638
   64   HG13  ILE  10          HG11      ILE  10   5.328  12.068   0.246
   65   HG21  ILE  10          HG21      ILE  10   6.055   8.837   1.040
   66   HG22  ILE  10          HG22      ILE  10   5.799   9.693  -0.480
   67   HG23  ILE  10          HG23      ILE  10   4.665   8.442   0.028
   68   HD11  ILE  10          HD11      ILE  10   3.730  10.131  -1.232
   69   HD12  ILE  10          HD12      ILE  10   4.882  11.323  -1.835
   70   HD13  ILE  10          HD13      ILE  10   3.205  11.785  -1.544
   71    H    CYS  11           H        CYS  11   4.025   7.407   1.806
   72    HA   CYS  11           HA       CYS  11   3.797   7.565   4.736
   73    HB2  CYS  11           HB2      CYS  11   2.323   5.705   5.010
   74    HB3  CYS  11           HB1      CYS  11   1.544   6.762   3.836
   75    H    SER  12           H        SER  12   4.385   5.065   5.498
   76    HA   SER  12           HA       SER  12   7.021   4.624   4.237
   77    HB2  SER  12           HB2      SER  12   6.826   2.757   6.226
   78    HB3  SER  12           HB1      SER  12   7.462   4.384   6.445
   79    HG   SER  12           HG       SER  12   4.717   3.708   6.677
   80    H    LEU  13           H        LEU  13   7.462   2.924   2.900
   81    HA   LEU  13           HA       LEU  13   5.361   1.366   1.785
   82    HB2  LEU  13           HB2      LEU  13   7.177   0.038   0.727
   83    HB3  LEU  13           HB1      LEU  13   7.430   1.775   0.556
   84    HG   LEU  13           HG       LEU  13   8.598   0.525   2.982
   85   HD11  LEU  13          HD11      LEU  13  10.218   0.264   0.496
   86   HD12  LEU  13          HD12      LEU  13   8.955  -0.940   0.756
   87   HD13  LEU  13          HD13      LEU  13  10.230  -0.725   1.956
   88   HD21  LEU  13          HD21      LEU  13   9.797   2.437   2.917
   89   HD22  LEU  13          HD22      LEU  13   8.790   2.938   1.560
   90   HD23  LEU  13          HD23      LEU  13  10.322   2.114   1.265
   91    H    TYR  14           H        TYR  14   7.532   0.713   4.478
   92    HA   TYR  14           HA       TYR  14   6.871  -2.088   4.637
   93    HB2  TYR  14           HB2      TYR  14   7.662  -1.830   7.069
   94    HB3  TYR  14           HB1      TYR  14   8.840  -1.504   5.803
   95    HD1  TYR  14           HD1      TYR  14   6.553   0.056   8.274
   96    HD2  TYR  14           HD2      TYR  14   9.745   0.691   5.467
   97    HE1  TYR  14           HE1      TYR  14   6.921   2.326   9.207
   98    HE2  TYR  14           HE2      TYR  14  10.111   2.962   6.398
   99    HH   TYR  14           HH       TYR  14   9.617   4.066   8.790
  100    H    GLN  15           H        GLN  15   5.301   0.819   5.637
  101    HA   GLN  15           HA       GLN  15   3.506  -0.454   7.518
  102    HB2  GLN  15           HB2      GLN  15   2.571   1.667   7.752
  103    HB3  GLN  15           HB1      GLN  15   4.199   2.060   7.238
  104    HG2  GLN  15           HG2      GLN  15   3.276   3.254   5.568
  105    HG3  GLN  15           HG1      GLN  15   2.774   1.727   4.851
  106   HE21  GLN  15          HE21      GLN  15   0.702   0.854   6.425
  107   HE22  GLN  15          HE22      GLN  15  -0.544   2.004   6.493
  108    H    LEU  16           H        LEU  16   3.701  -0.083   4.090
  109    HA   LEU  16           HA       LEU  16   0.901  -0.543   3.509
  110    HB2  LEU  16           HB2      LEU  16   3.453  -0.677   1.913
  111    HB3  LEU  16           HB1      LEU  16   1.951  -1.304   1.231
  112    HG   LEU  16           HG       LEU  16   0.888   0.921   1.798
  113   HD11  LEU  16          HD11      LEU  16   2.094   2.217   3.194
  114   HD12  LEU  16          HD12      LEU  16   3.094   2.597   1.793
  115   HD13  LEU  16          HD13      LEU  16   3.566   1.299   2.885
  116   HD21  LEU  16          HD21      LEU  16   1.264   1.213  -0.408
  117   HD22  LEU  16          HD22      LEU  16   2.720   0.221  -0.323
  118   HD23  LEU  16          HD23      LEU  16   2.813   1.953  -0.003
  119    H    GLU  17           H        GLU  17   3.759  -2.570   3.937
  120    HA   GLU  17           HA       GLU  17   2.793  -5.047   3.054
  121    HB2  GLU  17           HB2      GLU  17   4.982  -5.176   3.844
  122    HB3  GLU  17           HB1      GLU  17   4.636  -4.192   5.265
  123    HG2  GLU  17           HG2      GLU  17   3.838  -5.981   6.484
  124    HG3  GLU  17           HG1      GLU  17   3.278  -6.844   5.050
  125    H    ASN  18           H        ASN  18   1.785  -3.086   5.729
  126    HA   ASN  18           HA       ASN  18   0.478  -5.037   7.333
  127    HB2  ASN  18           HB2      ASN  18   0.880  -2.374   7.573
  128    HB3  ASN  18           HB1      ASN  18  -0.810  -2.375   7.064
  129   HD21  ASN  18          HD21      ASN  18  -1.085  -1.547   9.421
  130   HD22  ASN  18          HD22      ASN  18  -1.250  -2.720  10.637
  131    H    TYR  19           H        TYR  19  -0.583  -3.257   4.490
  132    HA   TYR  19           HA       TYR  19  -3.323  -4.028   4.543
  133    HB2  TYR  19           HB2      TYR  19  -1.732  -3.693   1.999
  134    HB3  TYR  19           HB1      TYR  19  -3.431  -3.323   2.276
  135    HD1  TYR  19           HD2      TYR  19  -2.488  -2.155   5.191
  136    HD2  TYR  19           HD1      TYR  19  -1.578  -1.332   1.071
  137    HE1  TYR  19           HE2      TYR  19  -1.876   0.173   5.790
  138    HE2  TYR  19           HE1      TYR  19  -0.968   0.997   1.672
  139    HH   TYR  19           HH       TYR  19  -1.672   2.342   4.760
  140    H    CYS  20           H        CYS  20  -0.496  -5.867   4.014
  141    HA   CYS  20           HA       CYS  20  -1.658  -7.904   2.300
  142    HB2  CYS  20           HB2      CYS  20   0.740  -8.072   4.146
  143    HB3  CYS  20           HB1      CYS  20   0.351  -9.201   2.850
  144    H    ASN  21           H        ASN  21  -0.895 -10.255   3.771
  145    HA   ASN  21           HA       ASN  21  -3.284 -10.529   5.436
  146    HB2  ASN  21           HB2      ASN  21  -1.035 -12.445   4.766
  147    HB3  ASN  21           HB1      ASN  21  -2.437 -12.880   5.743
  148   HD21  ASN  21          HD21      ASN  21  -4.456 -11.442   4.304
  149   HD22  ASN  21          HD22      ASN  21  -4.614 -12.139   2.764
  150    H1   PHE   1           HT1      PHE   1  10.457   1.246  -1.467
  151    H2   PHE   1           HT2      PHE   1   8.949   0.582  -1.881
  152    H3   PHE   1           HT3      PHE   1   9.031   1.982  -0.920
  153    HA   PHE   1           HA       PHE   1  10.095   1.892  -3.679
  154    HB2  PHE   1           HB2      PHE   1   7.894   3.212  -4.130
  155    HB3  PHE   1           HB1      PHE   1   7.813   1.451  -4.052
  156    HD1  PHE   1           HD1      PHE   1   7.636   4.434  -1.777
  157    HD2  PHE   1           HD2      PHE   1   6.212   0.477  -2.662
  158    HE1  PHE   1           HE1      PHE   1   6.031   4.590   0.108
  159    HE2  PHE   1           HE2      PHE   1   4.608   0.633  -0.777
  160    HZ   PHE   1           HZ       PHE   1   4.518   2.690   0.608
  161    H    VAL   2           H        VAL   2   9.394   4.408  -4.390
  162    HA   VAL   2           HA       VAL   2  11.026   6.035  -2.552
  163    HB   VAL   2           HB       VAL   2  10.659   7.785  -4.405
  164   HG11  VAL   2          HG11      VAL   2  12.765   6.879  -4.561
  165   HG12  VAL   2          HG12      VAL   2  12.082   6.175  -6.027
  166   HG13  VAL   2          HG13      VAL   2  12.166   5.220  -4.546
  167   HG21  VAL   2          HG21      VAL   2   9.420   7.252  -6.235
  168   HG22  VAL   2          HG22      VAL   2   8.701   6.025  -5.193
  169   HG23  VAL   2          HG23      VAL   2  10.026   5.597  -6.274
  170    H    ASN   3           H        ASN   3  10.206   8.365  -2.182
  171    HA   ASN   3           HA       ASN   3   7.592   8.194  -0.902
  172    HB2  ASN   3           HB2      ASN   3   9.786  10.209  -1.086
  173    HB3  ASN   3           HB1      ASN   3   8.173  10.804  -0.695
  174   HD21  ASN   3          HD21      ASN   3  10.932   9.095   0.563
  175   HD22  ASN   3          HD22      ASN   3  10.284   8.758   2.095
  176    H    GLN   4           H        GLN   4   5.829   8.218  -2.247
  177    HA   GLN   4           HA       GLN   4   5.357  10.588  -3.884
  178    HB2  GLN   4           HB2      GLN   4   4.847   9.077  -5.925
  179    HB3  GLN   4           HB1      GLN   4   6.536   9.457  -5.591
  180    HG2  GLN   4           HG2      GLN   4   7.038   7.298  -5.145
  181    HG3  GLN   4           HG1      GLN   4   5.606   7.095  -4.133
  182   HE21  GLN   4          HE21      GLN   4   6.946   6.442  -7.265
  183   HE22  GLN   4          HE22      GLN   4   5.550   5.768  -7.956
  184    H    HIS   5           H        HIS   5   3.126  10.609  -4.694
  185    HA   HIS   5           HA       HIS   5   1.316   9.203  -2.852
  186    HB2  HIS   5           HB2      HIS   5   0.341  10.892  -5.130
  187    HB3  HIS   5           HB1      HIS   5  -0.306  10.742  -3.497
  188    HD2  HIS   5           HD2      HIS   5   2.662  12.585  -5.338
  189    HE1  HIS   5           HE1      HIS   5   2.143  14.291  -1.505
  190    HE2  HIS   5           HE2      HIS   5   3.399  14.483  -3.717
  191    H    LEU   6           H        LEU   6   0.099   7.423  -3.401
  192    HA   LEU   6           HA       LEU   6  -0.258   6.788  -6.262
  193    HB2  LEU   6           HB2      LEU   6   0.448   4.412  -5.872
  194    HB3  LEU   6           HB1      LEU   6   1.761   5.574  -5.779
  195    HG   LEU   6           HG       LEU   6   1.937   3.912  -3.985
  196   HD11  LEU   6          HD11      LEU   6   1.080   6.229  -2.379
  197   HD12  LEU   6          HD12      LEU   6   2.200   6.604  -3.690
  198   HD13  LEU   6          HD13      LEU   6   2.647   5.425  -2.459
  199   HD21  LEU   6          HD21      LEU   6  -0.776   3.899  -3.904
  200   HD22  LEU   6          HD22      LEU   6  -0.420   4.923  -2.511
  201   HD23  LEU   6          HD23      LEU   6   0.241   3.294  -2.601
  202    H    CYS   7           H        CYS   7  -2.040   5.424  -6.677
  203    HA   CYS   7           HA       CYS   7  -3.616   4.366  -4.441
  204    HB2  CYS   7           HB2      CYS   7  -4.789   6.523  -6.230
  205    HB3  CYS   7           HB1      CYS   7  -5.643   5.647  -4.964
  206    H    GLY   8           H        GLY   8  -5.322   2.948  -5.223
  207    HA2  GLY   8           HA2      GLY   8  -6.324   1.473  -6.744
  208    HA3  GLY   8           HA1      GLY   8  -5.921   2.626  -8.012
  209    H    SER   9           H        SER   9  -4.807   1.593  -9.565
  210    HA   SER   9           HA       SER   9  -3.418  -0.857  -9.266
  211    HB2  SER   9           HB2      SER   9  -2.353  -0.229 -11.475
  212    HB3  SER   9           HB1      SER   9  -4.114  -0.166 -11.458
  213    HG   SER   9           HG       SER   9  -2.251   1.852 -11.702
  214    H    ASP  10           H        ASP  10  -2.416   2.353  -8.499
  215    HA   ASP  10           HA       ASP  10   0.437   1.691  -8.612
  216    HB2  ASP  10           HB2      ASP  10  -0.922   4.055  -7.288
  217    HB3  ASP  10           HB1      ASP  10   0.792   3.917  -7.674
  218    H    LEU  11           H        LEU  11  -2.152   1.580  -6.309
  219    HA   LEU  11           HA       LEU  11  -0.519   1.397  -3.947
  220    HB2  LEU  11           HB2      LEU  11  -3.354   0.772  -4.644
  221    HB3  LEU  11           HB1      LEU  11  -2.689   0.018  -3.196
  222    HG   LEU  11           HG       LEU  11  -2.490   2.985  -3.759
  223   HD11  LEU  11          HD11      LEU  11  -4.863   2.266  -3.538
  224   HD12  LEU  11          HD12      LEU  11  -4.342   3.269  -2.184
  225   HD13  LEU  11          HD13      LEU  11  -4.470   1.521  -1.988
  226   HD21  LEU  11          HD21      LEU  11  -2.262   1.477  -1.144
  227   HD22  LEU  11          HD22      LEU  11  -1.785   3.141  -1.478
  228   HD23  LEU  11          HD23      LEU  11  -0.867   1.806  -2.169
  229    H    VAL  12           H        VAL  12  -1.468  -0.842  -6.448
  230    HA   VAL  12           HA       VAL  12  -0.572  -3.171  -4.914
  231    HB   VAL  12           HB       VAL  12  -0.687  -4.328  -7.172
  232   HG11  VAL  12          HG11      VAL  12  -3.371  -3.237  -6.937
  233   HG12  VAL  12          HG12      VAL  12  -2.673  -3.574  -5.353
  234   HG13  VAL  12          HG13      VAL  12  -2.788  -4.858  -6.555
  235   HG21  VAL  12          HG21      VAL  12  -0.394  -2.241  -8.505
  236   HG22  VAL  12          HG22      VAL  12  -2.001  -1.731  -7.992
  237   HG23  VAL  12          HG23      VAL  12  -1.809  -3.176  -8.982
  238    H    GLU  13           H        GLU  13   0.717  -1.110  -7.533
  239    HA   GLU  13           HA       GLU  13   3.081  -2.447  -8.114
  240    HB2  GLU  13           HB2      GLU  13   2.741  -0.373  -9.235
  241    HB3  GLU  13           HB1      GLU  13   2.540   0.502  -7.717
  242    HG2  GLU  13           HG2      GLU  13   4.753   0.880  -7.566
  243    HG3  GLU  13           HG1      GLU  13   5.110  -0.833  -7.788
  244    H    ALA  14           H        ALA  14   2.164  -0.672  -5.278
  245    HA   ALA  14           HA       ALA  14   4.724  -0.908  -3.915
  246    HB1  ALA  14           HB1      ALA  14   2.590  -0.483  -2.082
  247    HB2  ALA  14           HB2      ALA  14   2.221   0.448  -3.533
  248    HB3  ALA  14           HB3      ALA  14   3.743   0.710  -2.681
  249    H    LEU  15           H        LEU  15   1.530  -2.098  -2.961
  250    HA   LEU  15           HA       LEU  15   2.334  -4.125  -1.224
  251    HB2  LEU  15           HB2      LEU  15  -0.039  -3.676  -2.946
  252    HB3  LEU  15           HB1      LEU  15   0.209  -5.341  -2.416
  253    HG   LEU  15           HG       LEU  15   0.684  -3.579  -0.198
  254   HD11  LEU  15          HD11      LEU  15  -0.750  -1.896  -0.790
  255   HD12  LEU  15          HD12      LEU  15  -1.974  -3.036  -0.233
  256   HD13  LEU  15          HD13      LEU  15  -1.612  -2.902  -1.954
  257   HD21  LEU  15          HD21      LEU  15  -0.668  -5.117   0.898
  258   HD22  LEU  15          HD22      LEU  15  -0.192  -6.071  -0.506
  259   HD23  LEU  15          HD23      LEU  15  -1.767  -5.281  -0.470
  260    H    TYR  16           H        TYR  16   1.575  -4.516  -4.618
  261    HA   TYR  16           HA       TYR  16   2.124  -6.999  -5.376
  262    HB2  TYR  16           HB2      TYR  16   1.804  -5.355  -7.071
  263    HB3  TYR  16           HB1      TYR  16   3.251  -4.472  -6.586
  264    HD1  TYR  16           HD1      TYR  16   2.880  -8.152  -6.966
  265    HD2  TYR  16           HD2      TYR  16   4.559  -4.528  -8.546
  266    HE1  TYR  16           HE1      TYR  16   4.250  -9.482  -8.555
  267    HE2  TYR  16           HE2      TYR  16   5.930  -5.855 -10.138
  268    HH   TYR  16           HH       TYR  16   6.037  -7.983 -11.142
  269    H    LEU  17           H        LEU  17   4.923  -4.744  -4.875
  270    HA   LEU  17           HA       LEU  17   6.591  -7.203  -4.744
  271    HB2  LEU  17           HB2      LEU  17   8.400  -5.155  -4.626
  272    HB3  LEU  17           HB1      LEU  17   7.890  -5.972  -6.099
  273    HG   LEU  17           HG       LEU  17   5.992  -4.249  -6.213
  274   HD11  LEU  17          HD11      LEU  17   7.265  -3.500  -3.741
  275   HD12  LEU  17          HD12      LEU  17   5.805  -2.838  -4.469
  276   HD13  LEU  17          HD13      LEU  17   7.377  -2.164  -4.885
  277   HD21  LEU  17          HD21      LEU  17   7.588  -3.854  -7.829
  278   HD22  LEU  17          HD22      LEU  17   8.907  -3.789  -6.660
  279   HD23  LEU  17          HD23      LEU  17   7.827  -2.409  -6.848
  280    H    VAL  18           H        VAL  18   5.644  -4.476  -2.674
  281    HA   VAL  18           HA       VAL  18   7.592  -4.807  -0.655
  282    HB   VAL  18           HB       VAL  18   6.092  -3.758   0.854
  283   HG11  VAL  18          HG11      VAL  18   4.661  -2.423  -1.188
  284   HG12  VAL  18          HG12      VAL  18   6.218  -2.875  -1.883
  285   HG13  VAL  18          HG13      VAL  18   6.156  -1.903  -0.412
  286   HG21  VAL  18          HG21      VAL  18   3.604  -3.659   0.293
  287   HG22  VAL  18          HG22      VAL  18   4.217  -5.228   0.817
  288   HG23  VAL  18          HG23      VAL  18   3.927  -4.921  -0.893
  289    H    CYS  19           H        CYS  19   4.620  -6.566  -1.250
  290    HA   CYS  19           HA       CYS  19   5.365  -8.547   0.852
  291    HB2  CYS  19           HB2      CYS  19   2.779  -7.698  -0.398
  292    HB3  CYS  19           HB1      CYS  19   2.920  -9.359   0.179
  293    H    GLY  20           H        GLY  20   3.594  -8.788  -2.245
  294    HA2  GLY  20           HA2      GLY  20   4.674  -9.941  -4.175
  295    HA3  GLY  20           HA1      GLY  20   5.463 -10.998  -3.004
  296    H    GLU  21           H        GLU  21   4.574 -12.997  -3.240
  297    HA   GLU  21           HA       GLU  21   1.723 -13.280  -3.940
  298    HB2  GLU  21           HB2      GLU  21   3.892 -14.734  -4.648
  299    HB3  GLU  21           HB1      GLU  21   3.347 -15.672  -3.257
  300    HG2  GLU  21           HG2      GLU  21   1.411 -16.332  -4.288
  301    HG3  GLU  21           HG1      GLU  21   1.239 -14.813  -5.168
  302    H    ARG  22           H        ARG  22   2.578 -12.224  -1.259
  303    HA   ARG  22           HA       ARG  22   1.843 -14.386   0.600
  304    HB2  ARG  22           HB2      ARG  22   3.455 -12.222   0.891
  305    HB3  ARG  22           HB1      ARG  22   1.955 -11.581   1.561
  306    HG2  ARG  22           HG2      ARG  22   1.949 -13.983   2.768
  307    HG3  ARG  22           HG1      ARG  22   3.690 -13.781   2.568
  308    HD2  ARG  22           HD2      ARG  22   2.105 -11.470   3.621
  309    HD3  ARG  22           HD1      ARG  22   2.454 -12.815   4.708
  310    HE   ARG  22           HE       ARG  22   4.571 -11.221   3.317
  311   HH11  ARG  22          HH21      ARG  22   4.778 -14.059   4.747
  312   HH12  ARG  22          HH22      ARG  22   5.597 -13.565   6.191
  313   HH21  ARG  22          HH11      ARG  22   5.023 -10.184   5.678
  314   HH22  ARG  22          HH12      ARG  22   5.734 -11.372   6.719
  315    H    GLY  23           H        GLY  23   0.002 -12.932  -1.500
  316    HA2  GLY  23           HA2      GLY  23  -2.315 -12.546  -1.585
  317    HA3  GLY  23           HA1      GLY  23  -2.413 -13.164   0.065
  318    H    ALA  24           H        ALA  24  -3.470 -10.636  -1.397
  319    HA   ALA  24           HA       ALA  24  -3.283  -8.888   0.896
  320    HB1  ALA  24           HB1      ALA  24  -1.170  -8.683  -0.980
  321    HB2  ALA  24           HB2      ALA  24  -1.529  -7.586   0.354
  322    HB3  ALA  24           HB3      ALA  24  -2.211  -7.285  -1.245
  323    H    PHE  25           H        PHE  25  -5.445  -8.409   0.830
  324    HA   PHE  25           HA       PHE  25  -6.487  -7.229  -1.699
  325    HB2  PHE  25           HB2      PHE  25  -8.750  -8.204  -0.842
  326    HB3  PHE  25           HB1      PHE  25  -7.610  -9.290  -1.637
  327    HD1  PHE  25           HD2      PHE  25  -6.270 -10.894  -0.335
  328    HD2  PHE  25           HD1      PHE  25  -9.150  -8.322   1.554
  329    HE1  PHE  25           HE2      PHE  25  -6.171 -12.289   1.714
  330    HE2  PHE  25           HE1      PHE  25  -9.050  -9.718   3.604
  331    HZ   PHE  25           HZ       PHE  25  -7.561 -11.702   3.683
  332    H    TYR  26           H        TYR  26  -8.202  -5.624  -1.358
  333    HA   TYR  26           HA       TYR  26  -8.158  -4.474   1.402
  334    HB2  TYR  26           HB2      TYR  26  -8.586  -2.260   0.005
  335    HB3  TYR  26           HB1      TYR  26  -6.947  -2.864   0.252
  336    HD1  TYR  26           HD2      TYR  26  -5.849  -4.257  -1.537
  337    HD2  TYR  26           HD1      TYR  26  -9.576  -2.210  -2.169
  338    HE1  TYR  26           HE2      TYR  26  -5.566  -4.498  -3.991
  339    HE2  TYR  26           HE1      TYR  26  -9.293  -2.452  -4.623
  340    HH   TYR  26           HH       TYR  26  -7.935  -3.103  -6.259
  341    H    THR  27           H        THR  27 -10.050  -5.435  -1.327
  342    HA   THR  27           HA       THR  27 -12.493  -4.538   0.142
  343    HB   THR  27           HB       THR  27 -13.572  -4.091  -2.047
  344    HG1  THR  27           HG1      THR  27 -10.959  -4.598  -3.024
  345   HG21  THR  27          HG21      THR  27 -11.340  -2.606  -0.902
  346   HG22  THR  27          HG22      THR  27 -12.886  -2.013  -1.506
  347   HG23  THR  27          HG23      THR  27 -11.545  -2.271  -2.621
  348    H    LYS  28           H        LYS  28 -14.473  -5.805  -0.711
  349    HA   LYS  28           HA       LYS  28 -13.887  -8.445  -1.846
  350    HB2  LYS  28           HB2      LYS  28 -15.035  -9.529   0.225
  351    HB3  LYS  28           HB1      LYS  28 -13.334  -9.081   0.356
  352    HG2  LYS  28           HG2      LYS  28 -13.893  -7.029   1.507
  353    HG3  LYS  28           HG1      LYS  28 -15.614  -7.284   1.222
  354    HD2  LYS  28           HD2      LYS  28 -15.534  -8.167   3.333
  355    HD3  LYS  28           HD1      LYS  28 -15.017  -9.611   2.461
  356    HE2  LYS  28           HE2      LYS  28 -12.706  -8.001   2.837
  357    HE3  LYS  28           HE1      LYS  28 -13.546  -8.067   4.386
  358    HZ1  LYS  28           HZ1      LYS  28 -13.045 -10.485   2.757
  359    HZ2  LYS  28           HZ2      LYS  28 -13.481 -10.394   4.396
  360    HZ3  LYS  28           HZ3      LYS  28 -11.926  -9.921   3.899
  361    HA   PRO  29           HA       PRO  29 -18.120  -6.774  -2.620
  362    HB2  PRO  29           HB2      PRO  29 -17.906  -6.871  -5.361
  363    HB3  PRO  29           HB1      PRO  29 -17.440  -5.464  -4.389
  364    HG2  PRO  29           HG2      PRO  29 -15.699  -7.478  -5.735
  365    HG3  PRO  29           HG1      PRO  29 -15.349  -5.792  -5.317
  366    HD2  PRO  29           HD2      PRO  29 -14.460  -8.068  -3.889
  367    HD3  PRO  29           HD1      PRO  29 -14.411  -6.389  -3.312
  368    H    THR  30           H        THR  30 -18.534  -9.024  -1.710
  369    HA   THR  30           HA       THR  30 -19.726 -10.711  -3.787
  370    HB   THR  30           HB       THR  30 -17.570 -11.700  -3.929
  371    HG1  THR  30           HG1      THR  30 -18.588 -13.508  -3.677
  372   HG21  THR  30          HG21      THR  30 -17.310 -10.683  -1.277
  373   HG22  THR  30          HG22      THR  30 -16.051 -11.362  -2.310
  374   HG23  THR  30          HG23      THR  30 -16.966 -12.413  -1.228
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1 -10.596   4.222   5.971
    2    H2   GLY   1           HT2      GLY   1  -9.509   2.943   6.234
    3    H3   GLY   1           HT3      GLY   1 -10.270   3.116   4.726
    4    HA2  GLY   1           HA1      GLY   1  -8.569   4.414   4.093
    5    HA3  GLY   1           HA2      GLY   1  -8.964   5.603   5.371
    6    H    ILE   2           H        ILE   2  -7.851   2.179   4.569
    7    HA   ILE   2           HA       ILE   2  -5.387   2.194   5.942
    8    HB   ILE   2           HB       ILE   2  -6.341   0.133   5.042
    9   HG12  ILE   2          HG12      ILE   2  -4.085  -0.196   3.392
   10   HG13  ILE   2          HG11      ILE   2  -3.610   1.008   4.590
   11   HG21  ILE   2          HG21      ILE   2  -5.758   1.404   2.351
   12   HG22  ILE   2          HG22      ILE   2  -7.349   1.017   3.008
   13   HG23  ILE   2          HG23      ILE   2  -6.233  -0.279   2.577
   14   HD11  ILE   2          HD11      ILE   2  -5.105  -1.066   5.899
   15   HD12  ILE   2          HD12      ILE   2  -3.427  -0.589   6.163
   16   HD13  ILE   2          HD13      ILE   2  -3.818  -1.804   4.945
   17    H    VAL   3           H        VAL   3  -6.246   3.523   2.809
   18    HA   VAL   3           HA       VAL   3  -3.391   4.272   2.354
   19    HB   VAL   3           HB       VAL   3  -4.187   4.859   0.049
   20   HG11  VAL   3          HG11      VAL   3  -4.892   2.352  -0.447
   21   HG12  VAL   3          HG12      VAL   3  -4.419   2.121   1.236
   22   HG13  VAL   3          HG13      VAL   3  -3.251   2.740   0.069
   23   HG21  VAL   3          HG21      VAL   3  -6.684   3.333   0.398
   24   HG22  VAL   3          HG22      VAL   3  -6.389   4.813  -0.515
   25   HG23  VAL   3          HG23      VAL   3  -6.673   4.891   1.224
   26    H    GLU   4           H        GLU   4  -6.193   5.518   3.671
   27    HA   GLU   4           HA       GLU   4  -6.661   8.049   2.749
   28    HB2  GLU   4           HB2      GLU   4  -7.126   8.752   5.033
   29    HB3  GLU   4           HB1      GLU   4  -7.645   7.078   4.832
   30    HG2  GLU   4           HG2      GLU   4  -6.371   6.580   6.624
   31    HG3  GLU   4           HG1      GLU   4  -4.967   6.879   5.598
   32    H    GLN   5           H        GLN   5  -3.655   6.952   4.191
   33    HA   GLN   5           HA       GLN   5  -2.625   9.748   4.078
   34    HB2  GLN   5           HB2      GLN   5  -0.592   8.345   5.220
   35    HB3  GLN   5           HB1      GLN   5  -1.889   9.105   6.141
   36    HG2  GLN   5           HG2      GLN   5  -3.169   6.983   6.069
   37    HG3  GLN   5           HG1      GLN   5  -1.847   6.224   5.184
   38   HE21  GLN   5          HE21      GLN   5   0.051   5.610   6.369
   39   HE22  GLN   5          HE22      GLN   5   0.160   5.749   8.058
   40    H    CYS   6           H        CYS   6  -1.292   6.469   3.432
   41    HA   CYS   6           HA       CYS   6   0.844   7.204   1.817
   42    HB2  CYS   6           HB2      CYS   6  -1.002   4.869   1.249
   43    HB3  CYS   6           HB1      CYS   6   0.688   5.015   0.770
   44    H    CYS   7           H        CYS   7  -2.577   7.204   0.982
   45    HA   CYS   7           HA       CYS   7  -2.069   7.635  -1.860
   46    HB2  CYS   7           HB2      CYS   7  -4.419   7.322  -0.118
   47    HB3  CYS   7           HB1      CYS   7  -4.649   8.448  -1.448
   48    H    THR   8           H        THR   8  -3.618   9.687   0.646
   49    HA   THR   8           HA       THR   8  -3.384  12.092  -0.915
   50    HB   THR   8           HB       THR   8  -4.989  11.762   0.992
   51    HG1  THR   8           HG1      THR   8  -3.356  13.942   1.632
   52   HG21  THR   8          HG21      THR   8  -2.608  12.328   2.764
   53   HG22  THR   8          HG22      THR   8  -3.180  10.690   2.450
   54   HG23  THR   8          HG23      THR   8  -4.237  11.854   3.248
   55    H    SER   9           H        SER   9  -1.440  10.795   1.788
   56    HA   SER   9           HA       SER   9   0.687  12.750   1.019
   57    HB2  SER   9           HB2      SER   9   1.377  11.905   3.532
   58    HB3  SER   9           HB1      SER   9   0.493  13.383   3.182
   59    HG   SER   9           HG       SER   9  -0.703  10.840   3.595
   60    H    ILE  10           H        ILE  10   2.796  11.582   2.411
   61    HA   ILE  10           HA       ILE  10   3.105   9.012   0.918
   62    HB   ILE  10           HB       ILE  10   5.496  10.478   1.920
   63   HG12  ILE  10          HG12      ILE  10   3.896  12.233   0.972
   64   HG13  ILE  10          HG11      ILE  10   5.462  12.124   0.172
   65   HG21  ILE  10          HG21      ILE  10   4.824   9.175  -0.734
   66   HG22  ILE  10          HG22      ILE  10   5.587   8.346   0.623
   67   HG23  ILE  10          HG23      ILE  10   6.424   9.671  -0.185
   68   HD11  ILE  10          HD11      ILE  10   3.488  12.234  -1.406
   69   HD12  ILE  10          HD12      ILE  10   2.997  10.654  -0.795
   70   HD13  ILE  10          HD13      ILE  10   4.535  10.834  -1.640
   71    H    CYS  11           H        CYS  11   3.430   7.206   2.123
   72    HA   CYS  11           HA       CYS  11   4.127   7.577   5.011
   73    HB2  CYS  11           HB2      CYS  11   2.929   5.466   5.422
   74    HB3  CYS  11           HB1      CYS  11   1.866   6.629   4.631
   75    H    SER  12           H        SER  12   4.862   4.998   5.652
   76    HA   SER  12           HA       SER  12   7.399   4.762   4.151
   77    HB2  SER  12           HB2      SER  12   7.464   2.800   6.058
   78    HB3  SER  12           HB1      SER  12   8.037   4.446   6.302
   79    HG   SER  12           HG       SER  12   6.524   3.789   7.901
   80    H    LEU  13           H        LEU  13   7.670   3.249   2.578
   81    HA   LEU  13           HA       LEU  13   5.540   1.611   1.685
   82    HB2  LEU  13           HB2      LEU  13   7.046   0.704   0.110
   83    HB3  LEU  13           HB1      LEU  13   7.648   2.332   0.405
   84    HG   LEU  13           HG       LEU  13   8.672  -0.127   1.844
   85   HD11  LEU  13          HD11      LEU  13   9.677   1.329  -0.614
   86   HD12  LEU  13          HD12      LEU  13   9.271  -0.381  -0.468
   87   HD13  LEU  13          HD13      LEU  13  10.697   0.259   0.347
   88   HD21  LEU  13          HD21      LEU  13   9.277   1.669   3.190
   89   HD22  LEU  13          HD22      LEU  13   9.319   2.800   1.838
   90   HD23  LEU  13          HD23      LEU  13  10.637   1.652   2.069
   91    H    TYR  14           H        TYR  14   7.837   1.087   4.222
   92    HA   TYR  14           HA       TYR  14   7.383  -1.811   4.238
   93    HB2  TYR  14           HB2      TYR  14   8.610  -1.646   6.493
   94    HB3  TYR  14           HB1      TYR  14   9.534  -1.232   5.052
   95    HD1  TYR  14           HD1      TYR  14   7.734   0.143   7.985
   96    HD2  TYR  14           HD2      TYR  14  10.293   1.015   4.643
   97    HE1  TYR  14           HE1      TYR  14   8.211   2.385   8.935
   98    HE2  TYR  14           HE2      TYR  14  10.767   3.258   5.593
   99    HH   TYR  14           HH       TYR  14   8.987   4.531   8.280
  100    H    GLN  15           H        GLN  15   6.126   1.040   5.782
  101    HA   GLN  15           HA       GLN  15   4.595  -0.405   7.782
  102    HB2  GLN  15           HB2      GLN  15   4.057   1.683   8.549
  103    HB3  GLN  15           HB1      GLN  15   5.385   2.175   7.522
  104    HG2  GLN  15           HG2      GLN  15   3.864   2.752   5.725
  105    HG3  GLN  15           HG1      GLN  15   2.495   2.083   6.615
  106   HE21  GLN  15          HE21      GLN  15   1.400   4.182   6.698
  107   HE22  GLN  15          HE22      GLN  15   1.968   5.430   7.699
  108    H    LEU  16           H        LEU  16   4.249   0.498   4.478
  109    HA   LEU  16           HA       LEU  16   1.371   0.122   4.383
  110    HB2  LEU  16           HB2      LEU  16   1.572   1.060   2.335
  111    HB3  LEU  16           HB1      LEU  16   3.270   1.300   2.727
  112    HG   LEU  16           HG       LEU  16   3.655  -1.067   1.817
  113   HD11  LEU  16          HD11      LEU  16   0.764  -0.689   1.370
  114   HD12  LEU  16          HD12      LEU  16   1.702  -2.176   1.484
  115   HD13  LEU  16          HD13      LEU  16   1.647  -1.286  -0.035
  116   HD21  LEU  16          HD21      LEU  16   3.798   1.358   0.635
  117   HD22  LEU  16          HD22      LEU  16   2.598   0.597  -0.409
  118   HD23  LEU  16          HD23      LEU  16   4.189  -0.138  -0.212
  119    H    GLU  17           H        GLU  17   4.192  -1.902   4.032
  120    HA   GLU  17           HA       GLU  17   3.102  -4.099   2.638
  121    HB2  GLU  17           HB2      GLU  17   4.797  -5.426   3.679
  122    HB3  GLU  17           HB1      GLU  17   5.484  -3.810   3.516
  123    HG2  GLU  17           HG2      GLU  17   5.967  -4.039   5.726
  124    HG3  GLU  17           HG1      GLU  17   4.268  -3.623   5.955
  125    H    ASN  18           H        ASN  18   2.443  -2.860   5.779
  126    HA   ASN  18           HA       ASN  18   1.294  -5.210   6.973
  127    HB2  ASN  18           HB2      ASN  18   1.917  -2.747   7.908
  128    HB3  ASN  18           HB1      ASN  18   0.173  -2.565   7.720
  129   HD21  ASN  18          HD21      ASN  18   2.087  -5.472   8.648
  130   HD22  ASN  18          HD22      ASN  18   1.299  -5.699  10.135
  131    H    TYR  19           H        TYR  19   0.235  -3.413   4.341
  132    HA   TYR  19           HA       TYR  19  -2.632  -3.613   4.875
  133    HB2  TYR  19           HB2      TYR  19  -1.248  -3.069   2.238
  134    HB3  TYR  19           HB1      TYR  19  -2.922  -2.707   2.652
  135    HD1  TYR  19           HD2      TYR  19  -1.543  -2.041   5.642
  136    HD2  TYR  19           HD1      TYR  19  -1.341  -0.518   1.627
  137    HE1  TYR  19           HE2      TYR  19  -0.847   0.170   6.515
  138    HE2  TYR  19           HE1      TYR  19  -0.642   1.693   2.503
  139    HH   TYR  19           HH       TYR  19   0.640   2.335   5.070
  140    H    CYS  20           H        CYS  20  -0.283  -5.830   4.017
  141    HA   CYS  20           HA       CYS  20  -1.832  -7.380   2.096
  142    HB2  CYS  20           HB2      CYS  20   0.461  -8.389   3.785
  143    HB3  CYS  20           HB1      CYS  20  -0.056  -8.967   2.202
  144    H    ASN  21           H        ASN  21  -2.001  -6.920   5.443
  145    HA   ASN  21           HA       ASN  21  -3.080  -9.629   5.973
  146    HB2  ASN  21           HB2      ASN  21  -2.271  -7.288   7.672
  147    HB3  ASN  21           HB1      ASN  21  -3.385  -8.488   8.330
  148   HD21  ASN  21          HD21      ASN  21  -0.760  -9.193   6.011
  149   HD22  ASN  21          HD22      ASN  21   0.138 -10.165   7.075
  150    H1   PHE   1           HT1      PHE   1  10.929   2.708  -5.919
  151    H2   PHE   1           HT2      PHE   1  10.234   1.168  -5.735
  152    H3   PHE   1           HT3      PHE   1  11.428   1.700  -4.650
  153    HA   PHE   1           HA       PHE   1   8.647   2.686  -4.917
  154    HB2  PHE   1           HB2      PHE   1   9.502   0.623  -3.467
  155    HB3  PHE   1           HB1      PHE   1   9.977   1.910  -2.360
  156    HD1  PHE   1           HD2      PHE   1   7.886   3.935  -2.782
  157    HD2  PHE   1           HD1      PHE   1   7.568  -0.345  -2.540
  158    HE1  PHE   1           HE2      PHE   1   5.540   4.151  -2.010
  159    HE2  PHE   1           HE1      PHE   1   5.224  -0.128  -1.769
  160    HZ   PHE   1           HZ       PHE   1   4.207   2.121  -1.504
  161    H    VAL   2           H        VAL   2   9.279   4.865  -5.435
  162    HA   VAL   2           HA       VAL   2  11.111   6.272  -3.619
  163    HB   VAL   2           HB       VAL   2  10.493   8.261  -5.034
  164   HG11  VAL   2          HG11      VAL   2  11.902   7.602  -6.773
  165   HG12  VAL   2          HG12      VAL   2  11.200   5.987  -6.864
  166   HG13  VAL   2          HG13      VAL   2  12.291   6.401  -5.542
  167   HG21  VAL   2          HG21      VAL   2   9.301   6.841  -7.199
  168   HG22  VAL   2          HG22      VAL   2   8.604   8.156  -6.253
  169   HG23  VAL   2          HG23      VAL   2   8.360   6.484  -5.750
  170    H    ASN   3           H        ASN   3   9.987   8.697  -3.192
  171    HA   ASN   3           HA       ASN   3   7.670   8.023  -1.443
  172    HB2  ASN   3           HB2      ASN   3   9.477  10.459  -1.405
  173    HB3  ASN   3           HB1      ASN   3   8.247  10.057  -0.208
  174   HD21  ASN   3          HD21      ASN   3   8.959   8.835   1.554
  175   HD22  ASN   3          HD22      ASN   3  10.405   7.946   1.595
  176    H    GLN   4           H        GLN   4   5.845   8.308  -2.719
  177    HA   GLN   4           HA       GLN   4   5.190  11.040  -3.507
  178    HB2  GLN   4           HB2      GLN   4   4.664  10.296  -5.891
  179    HB3  GLN   4           HB1      GLN   4   6.376  10.474  -5.506
  180    HG2  GLN   4           HG2      GLN   4   6.604   8.080  -5.167
  181    HG3  GLN   4           HG1      GLN   4   4.867   7.849  -5.373
  182   HE21  GLN   4          HE21      GLN   4   4.336   9.448  -7.618
  183   HE22  GLN   4          HE22      GLN   4   5.192   8.854  -8.959
  184    H    HIS   5           H        HIS   5   2.913  11.107  -4.369
  185    HA   HIS   5           HA       HIS   5   1.183   9.467  -2.748
  186    HB2  HIS   5           HB2      HIS   5   0.352  11.106  -5.151
  187    HB3  HIS   5           HB1      HIS   5  -0.625  10.680  -3.747
  188    HD2  HIS   5           HD2      HIS   5   2.164  13.242  -4.746
  189    HE1  HIS   5           HE1      HIS   5   0.856  14.144  -0.828
  190    HE2  HIS   5           HE2      HIS   5   2.299  14.937  -2.776
  191    H    LEU   6           H        LEU   6   0.011   7.639  -3.322
  192    HA   LEU   6           HA       LEU   6  -0.071   6.800  -6.131
  193    HB2  LEU   6           HB2      LEU   6   0.921   4.594  -5.692
  194    HB3  LEU   6           HB1      LEU   6   2.075   5.883  -5.400
  195    HG   LEU   6           HG       LEU   6   2.283   4.269  -3.633
  196   HD11  LEU   6          HD11      LEU   6   2.275   5.700  -1.837
  197   HD12  LEU   6          HD12      LEU   6   0.668   6.323  -2.204
  198   HD13  LEU   6          HD13      LEU   6   2.061   6.871  -3.138
  199   HD21  LEU   6          HD21      LEU   6  -0.411   3.798  -4.009
  200   HD22  LEU   6          HD22      LEU   6  -0.358   4.579  -2.427
  201   HD23  LEU   6          HD23      LEU   6   0.582   3.119  -2.722
  202    H    CYS   7           H        CYS   7  -1.751   5.377  -6.562
  203    HA   CYS   7           HA       CYS   7  -3.294   4.174  -4.366
  204    HB2  CYS   7           HB2      CYS   7  -4.606   6.210  -6.192
  205    HB3  CYS   7           HB1      CYS   7  -5.374   5.320  -4.879
  206    H    GLY   8           H        GLY   8  -5.365   3.135  -5.408
  207    HA2  GLY   8           HA2      GLY   8  -6.155   1.490  -6.875
  208    HA3  GLY   8           HA1      GLY   8  -5.633   2.596  -8.143
  209    H    SER   9           H        SER   9  -4.639   1.278  -9.585
  210    HA   SER   9           HA       SER   9  -3.242  -1.105  -9.074
  211    HB2  SER   9           HB2      SER   9  -1.939  -0.044 -11.274
  212    HB3  SER   9           HB1      SER   9  -3.422  -0.991 -11.326
  213    HG   SER   9           HG       SER   9  -3.322   1.268 -12.288
  214    H    ASP  10           H        ASP  10  -2.280   2.136  -8.457
  215    HA   ASP  10           HA       ASP  10   0.584   1.548  -8.468
  216    HB2  ASP  10           HB2      ASP  10  -0.842   3.896  -7.196
  217    HB3  ASP  10           HB1      ASP  10   0.866   3.803  -7.619
  218    H    LEU  11           H        LEU  11  -2.036   1.437  -6.183
  219    HA   LEU  11           HA       LEU  11  -0.388   1.347  -3.813
  220    HB2  LEU  11           HB2      LEU  11  -3.228   0.706  -4.459
  221    HB3  LEU  11           HB1      LEU  11  -2.544  -0.046  -3.020
  222    HG   LEU  11           HG       LEU  11  -2.227   2.906  -3.536
  223   HD11  LEU  11          HD11      LEU  11  -4.502   1.481  -2.127
  224   HD12  LEU  11          HD12      LEU  11  -4.626   2.500  -3.562
  225   HD13  LEU  11          HD13      LEU  11  -4.191   3.212  -2.009
  226   HD21  LEU  11          HD21      LEU  11  -1.747   2.990  -1.191
  227   HD22  LEU  11          HD22      LEU  11  -0.843   1.614  -1.823
  228   HD23  LEU  11          HD23      LEU  11  -2.348   1.351  -0.943
  229    H    VAL  12           H        VAL  12  -1.367  -0.962  -6.235
  230    HA   VAL  12           HA       VAL  12  -0.395  -3.230  -4.648
  231    HB   VAL  12           HB       VAL  12  -0.577  -4.477  -6.844
  232   HG11  VAL  12          HG11      VAL  12  -3.101  -4.414  -6.790
  233   HG12  VAL  12          HG12      VAL  12  -2.972  -3.074  -5.649
  234   HG13  VAL  12          HG13      VAL  12  -2.333  -4.661  -5.221
  235   HG21  VAL  12          HG21      VAL  12  -1.800  -3.413  -8.655
  236   HG22  VAL  12          HG22      VAL  12  -0.355  -2.473  -8.284
  237   HG23  VAL  12          HG23      VAL  12  -1.933  -1.922  -7.723
  238    H    GLU  13           H        GLU  13   0.760  -1.258  -7.403
  239    HA   GLU  13           HA       GLU  13   3.092  -2.640  -8.020
  240    HB2  GLU  13           HB2      GLU  13   3.854  -0.680  -8.995
  241    HB3  GLU  13           HB1      GLU  13   2.164  -0.240  -8.778
  242    HG2  GLU  13           HG2      GLU  13   2.958   0.628  -6.436
  243    HG3  GLU  13           HG1      GLU  13   4.561   0.615  -7.172
  244    H    ALA  14           H        ALA  14   2.287  -0.755  -5.240
  245    HA   ALA  14           HA       ALA  14   4.916  -0.901  -3.985
  246    HB1  ALA  14           HB1      ALA  14   3.731   0.982  -3.285
  247    HB2  ALA  14           HB2      ALA  14   3.373  -0.143  -1.975
  248    HB3  ALA  14           HB3      ALA  14   2.194   0.120  -3.258
  249    H    LEU  15           H        LEU  15   1.729  -2.109  -3.019
  250    HA   LEU  15           HA       LEU  15   2.674  -4.021  -1.123
  251    HB2  LEU  15           HB2      LEU  15   0.118  -3.443  -2.531
  252    HB3  LEU  15           HB1      LEU  15   0.288  -5.064  -1.859
  253    HG   LEU  15           HG       LEU  15   1.267  -3.306   0.111
  254   HD11  LEU  15          HD11      LEU  15  -0.625  -1.788   0.480
  255   HD12  LEU  15          HD12      LEU  15  -1.415  -2.391  -0.976
  256   HD13  LEU  15          HD13      LEU  15   0.090  -1.480  -1.102
  257   HD21  LEU  15          HD21      LEU  15  -1.439  -4.105   0.645
  258   HD22  LEU  15          HD22      LEU  15   0.051  -4.785   1.296
  259   HD23  LEU  15          HD23      LEU  15  -0.619  -5.412  -0.211
  260    H    TYR  16           H        TYR  16   2.860  -4.038  -4.469
  261    HA   TYR  16           HA       TYR  16   2.527  -6.871  -4.975
  262    HB2  TYR  16           HB2      TYR  16   2.040  -5.622  -6.868
  263    HB3  TYR  16           HB1      TYR  16   3.294  -4.436  -6.534
  264    HD1  TYR  16           HD1      TYR  16   3.063  -8.111  -7.253
  265    HD2  TYR  16           HD2      TYR  16   5.091  -4.390  -7.945
  266    HE1  TYR  16           HE1      TYR  16   4.615  -9.250  -8.827
  267    HE2  TYR  16           HE2      TYR  16   6.645  -5.521  -9.518
  268    HH   TYR  16           HH       TYR  16   7.383  -7.555 -10.228
  269    H    LEU  17           H        LEU  17   5.328  -4.655  -4.753
  270    HA   LEU  17           HA       LEU  17   7.099  -7.034  -4.882
  271    HB2  LEU  17           HB2      LEU  17   8.801  -4.900  -4.647
  272    HB3  LEU  17           HB1      LEU  17   8.273  -5.613  -6.163
  273    HG   LEU  17           HG       LEU  17   6.312  -4.011  -6.122
  274   HD11  LEU  17          HD11      LEU  17   7.658  -2.073  -4.440
  275   HD12  LEU  17          HD12      LEU  17   7.283  -3.532  -3.524
  276   HD13  LEU  17          HD13      LEU  17   5.996  -2.655  -4.351
  277   HD21  LEU  17          HD21      LEU  17   9.152  -2.968  -6.237
  278   HD22  LEU  17          HD22      LEU  17   7.754  -2.041  -6.781
  279   HD23  LEU  17          HD23      LEU  17   8.173  -3.557  -7.579
  280    H    VAL  18           H        VAL  18   5.650  -5.074  -2.544
  281    HA   VAL  18           HA       VAL  18   7.818  -5.375  -0.578
  282    HB   VAL  18           HB       VAL  18   6.428  -4.201   0.949
  283   HG11  VAL  18          HG11      VAL  18   5.239  -2.522  -0.874
  284   HG12  VAL  18          HG12      VAL  18   6.499  -3.285  -1.844
  285   HG13  VAL  18          HG13      VAL  18   6.925  -2.421  -0.367
  286   HG21  VAL  18          HG21      VAL  18   3.985  -3.787   0.365
  287   HG22  VAL  18          HG22      VAL  18   4.392  -5.445   0.813
  288   HG23  VAL  18          HG23      VAL  18   4.173  -5.017  -0.883
  289    H    CYS  19           H        CYS  19   4.639  -6.749  -1.214
  290    HA   CYS  19           HA       CYS  19   5.159  -8.833   0.851
  291    HB2  CYS  19           HB2      CYS  19   2.691  -7.673  -0.373
  292    HB3  CYS  19           HB1      CYS  19   2.637  -9.352   0.162
  293    H    GLY  20           H        GLY  20   3.851  -8.561  -2.475
  294    HA2  GLY  20           HA2      GLY  20   4.745  -9.941  -4.288
  295    HA3  GLY  20           HA1      GLY  20   5.198 -11.151  -3.086
  296    H    GLU  21           H        GLU  21   3.742 -12.760  -2.613
  297    HA   GLU  21           HA       GLU  21   0.957 -12.430  -3.650
  298    HB2  GLU  21           HB2      GLU  21   2.726 -14.010  -4.915
  299    HB3  GLU  21           HB1      GLU  21   2.186 -15.145  -3.677
  300    HG2  GLU  21           HG2      GLU  21   0.096 -15.326  -4.569
  301    HG3  GLU  21           HG1      GLU  21   0.027 -13.617  -5.001
  302    H    ARG  22           H        ARG  22   2.253 -12.231  -0.917
  303    HA   ARG  22           HA       ARG  22   1.488 -14.554   0.605
  304    HB2  ARG  22           HB2      ARG  22   1.733 -11.688   1.569
  305    HB3  ARG  22           HB1      ARG  22   1.816 -13.144   2.561
  306    HG2  ARG  22           HG2      ARG  22   3.705 -12.889   0.254
  307    HG3  ARG  22           HG1      ARG  22   4.034 -11.957   1.716
  308    HD2  ARG  22           HD2      ARG  22   3.709 -14.145   3.006
  309    HD3  ARG  22           HD1      ARG  22   3.789 -14.957   1.442
  310    HE   ARG  22           HE       ARG  22   6.025 -13.439   2.699
  311   HH11  ARG  22          HH21      ARG  22   5.220 -16.374   1.423
  312   HH12  ARG  22          HH22      ARG  22   6.536 -16.477   0.301
  313   HH21  ARG  22          HH11      ARG  22   7.525 -13.184   0.752
  314   HH22  ARG  22          HH12      ARG  22   7.841 -14.671  -0.079
  315    H    GLY  23           H        GLY  23  -0.346 -12.120  -0.901
  316    HA2  GLY  23           HA2      GLY  23  -2.855 -12.947  -0.669
  317    HA3  GLY  23           HA1      GLY  23  -2.612 -12.415   0.996
  318    H    ALA  24           H        ALA  24  -4.570 -11.086  -0.207
  319    HA   ALA  24           HA       ALA  24  -3.894  -8.373  -0.076
  320    HB1  ALA  24           HB1      ALA  24  -3.087  -9.599  -2.585
  321    HB2  ALA  24           HB2      ALA  24  -2.763  -7.972  -1.986
  322    HB3  ALA  24           HB3      ALA  24  -4.259  -8.310  -2.856
  323    H    PHE  25           H        PHE  25  -5.837  -7.393   0.216
  324    HA   PHE  25           HA       PHE  25  -8.228  -8.664  -1.025
  325    HB2  PHE  25           HB2      PHE  25  -9.526  -7.824   0.817
  326    HB3  PHE  25           HB1      PHE  25  -8.099  -8.607   1.496
  327    HD1  PHE  25           HD2      PHE  25  -6.065  -7.132   2.053
  328    HD2  PHE  25           HD1      PHE  25  -9.987  -5.556   1.271
  329    HE1  PHE  25           HE2      PHE  25  -5.435  -5.010   3.173
  330    HE2  PHE  25           HE1      PHE  25  -9.357  -3.434   2.392
  331    HZ   PHE  25           HZ       PHE  25  -7.082  -3.161   3.343
  332    H    TYR  26           H        TYR  26 -10.005  -6.562  -0.633
  333    HA   TYR  26           HA       TYR  26 -10.809  -4.844  -2.024
  334    HB2  TYR  26           HB2      TYR  26  -9.991  -2.799  -1.310
  335    HB3  TYR  26           HB1      TYR  26  -9.599  -3.868   0.022
  336    HD1  TYR  26           HD2      TYR  26  -7.253  -4.725   0.291
  337    HD2  TYR  26           HD1      TYR  26  -8.277  -1.729  -2.614
  338    HE1  TYR  26           HE2      TYR  26  -4.857  -4.125   0.067
  339    HE2  TYR  26           HE1      TYR  26  -5.881  -1.128  -2.837
  340    HH   TYR  26           HH       TYR  26  -3.793  -1.659  -2.275
  341    H    THR  27           H        THR  27  -8.990  -6.700  -3.383
  342    HA   THR  27           HA       THR  27  -8.381  -4.980  -5.700
  343    HB   THR  27           HB       THR  27  -6.287  -4.997  -4.343
  344    HG1  THR  27           HG1      THR  27  -6.509  -6.149  -6.868
  345   HG21  THR  27          HG21      THR  27  -7.006  -7.668  -3.902
  346   HG22  THR  27          HG22      THR  27  -5.509  -6.885  -3.395
  347   HG23  THR  27          HG23      THR  27  -5.576  -7.750  -4.931
  348    H    LYS  28           H        LYS  28  -8.962  -6.056  -7.534
  349    HA   LYS  28           HA       LYS  28  -8.983  -9.041  -7.458
  350    HB2  LYS  28           HB2      LYS  28 -11.174  -7.257  -8.567
  351    HB3  LYS  28           HB1      LYS  28 -11.133  -9.017  -8.684
  352    HG2  LYS  28           HG2      LYS  28 -10.755  -8.693  -6.009
  353    HG3  LYS  28           HG1      LYS  28 -11.773  -7.295  -6.363
  354    HD2  LYS  28           HD2      LYS  28 -13.564  -8.603  -7.066
  355    HD3  LYS  28           HD1      LYS  28 -12.532  -9.969  -7.492
  356    HE2  LYS  28           HE2      LYS  28 -12.626 -10.837  -5.401
  357    HE3  LYS  28           HE1      LYS  28 -12.406  -9.259  -4.644
  358    HZ1  LYS  28           HZ1      LYS  28 -14.614  -8.908  -4.516
  359    HZ2  LYS  28           HZ2      LYS  28 -14.683 -10.606  -4.550
  360    HZ3  LYS  28           HZ3      LYS  28 -14.953  -9.712  -5.970
  361    HA   PRO  29           HA       PRO  29  -6.858  -7.411 -11.214
  362    HB2  PRO  29           HB2      PRO  29  -4.567  -8.885 -10.840
  363    HB3  PRO  29           HB1      PRO  29  -4.811  -7.265 -10.164
  364    HG2  PRO  29           HG2      PRO  29  -4.886  -9.908  -8.781
  365    HG3  PRO  29           HG1      PRO  29  -4.491  -8.310  -8.126
  366    HD2  PRO  29           HD2      PRO  29  -6.955  -9.665  -7.810
  367    HD3  PRO  29           HD1      PRO  29  -6.656  -7.947  -7.464
  368    H    THR  30           H        THR  30  -8.865  -9.173 -11.546
  369    HA   THR  30           HA       THR  30  -7.584 -11.445 -13.006
  370    HB   THR  30           HB       THR  30  -9.370 -12.925 -12.309
  371    HG1  THR  30           HG1      THR  30 -10.462 -10.516 -11.447
  372   HG21  THR  30          HG21      THR  30  -8.965 -11.833  -9.645
  373   HG22  THR  30          HG22      THR  30  -7.469 -11.830 -10.577
  374   HG23  THR  30          HG23      THR  30  -8.357 -13.335 -10.339
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1  -9.560   3.383   6.114
    2    H2   GLY   1           HT2      GLY   1 -10.463   4.026   4.827
    3    H3   GLY   1           HT3      GLY   1 -10.443   4.816   6.331
    4    HA2  GLY   1           HA1      GLY   1  -8.627   5.154   4.241
    5    HA3  GLY   1           HA2      GLY   1  -8.734   6.108   5.752
    6    H    ILE   2           H        ILE   2  -8.185   2.844   4.126
    7    HA   ILE   2           HA       ILE   2  -5.640   2.252   5.214
    8    HB   ILE   2           HB       ILE   2  -7.149   0.681   3.909
    9   HG12  ILE   2          HG12      ILE   2  -5.170  -0.460   2.768
   10   HG13  ILE   2          HG11      ILE   2  -4.204   0.937   3.250
   11   HG21  ILE   2          HG21      ILE   2  -7.347   2.401   1.995
   12   HG22  ILE   2          HG22      ILE   2  -7.131   0.711   1.539
   13   HG23  ILE   2          HG23      ILE   2  -5.762   1.821   1.482
   14   HD11  ILE   2          HD11      ILE   2  -4.617  -1.297   4.805
   15   HD12  ILE   2          HD12      ILE   2  -5.830  -0.181   5.429
   16   HD13  ILE   2          HD13      ILE   2  -4.129   0.281   5.420
   17    H    VAL   3           H        VAL   3  -6.515   4.062   2.285
   18    HA   VAL   3           HA       VAL   3  -3.634   4.676   1.847
   19    HB   VAL   3           HB       VAL   3  -4.294   5.450  -0.346
   20   HG11  VAL   3          HG11      VAL   3  -4.277   2.914   0.254
   21   HG12  VAL   3          HG12      VAL   3  -4.986   3.412  -1.282
   22   HG13  VAL   3          HG13      VAL   3  -6.029   3.029   0.086
   23   HG21  VAL   3          HG21      VAL   3  -6.943   5.028  -0.736
   24   HG22  VAL   3          HG22      VAL   3  -6.281   6.593  -0.269
   25   HG23  VAL   3          HG23      VAL   3  -6.963   5.525   0.956
   26    H    GLU   4           H        GLU   4  -6.091   5.904   3.626
   27    HA   GLU   4           HA       GLU   4  -6.569   8.537   3.129
   28    HB2  GLU   4           HB2      GLU   4  -6.568   8.965   5.519
   29    HB3  GLU   4           HB1      GLU   4  -7.176   7.334   5.242
   30    HG2  GLU   4           HG2      GLU   4  -4.777   6.527   5.600
   31    HG3  GLU   4           HG1      GLU   4  -4.428   8.149   6.201
   32    H    GLN   5           H        GLN   5  -3.415   7.190   3.911
   33    HA   GLN   5           HA       GLN   5  -2.283   9.943   3.820
   34    HB2  GLN   5           HB2      GLN   5  -0.165   8.373   4.524
   35    HB3  GLN   5           HB1      GLN   5  -1.241   9.147   5.685
   36    HG2  GLN   5           HG2      GLN   5  -2.673   7.083   5.640
   37    HG3  GLN   5           HG1      GLN   5  -1.457   6.315   4.621
   38   HE21  GLN   5          HE21      GLN   5  -1.575   4.859   6.766
   39   HE22  GLN   5          HE22      GLN   5  -0.436   5.259   7.960
   40    H    CYS   6           H        CYS   6  -1.030   6.728   2.861
   41    HA   CYS   6           HA       CYS   6   0.781   7.479   0.938
   42    HB2  CYS   6           HB2      CYS   6  -1.214   5.217   0.623
   43    HB3  CYS   6           HB1      CYS   6   0.327   5.359  -0.222
   44    H    CYS   7           H        CYS   7  -2.727   7.550   0.617
   45    HA   CYS   7           HA       CYS   7  -2.567   8.240  -2.232
   46    HB2  CYS   7           HB2      CYS   7  -4.670   7.516  -0.325
   47    HB3  CYS   7           HB1      CYS   7  -5.141   8.777  -1.455
   48    H    THR   8           H        THR   8  -2.792   9.920   0.836
   49    HA   THR   8           HA       THR   8  -3.534  12.441  -0.533
   50    HB   THR   8           HB       THR   8  -4.499  11.690   1.733
   51    HG1  THR   8           HG1      THR   8  -4.980  13.713   1.707
   52   HG21  THR   8          HG21      THR   8  -2.017  11.224   2.504
   53   HG22  THR   8          HG22      THR   8  -3.206  11.831   3.655
   54   HG23  THR   8          HG23      THR   8  -2.047  12.938   2.918
   55    H    SER   9           H        SER   9  -0.769  10.980   1.152
   56    HA   SER   9           HA       SER   9   0.907  13.147   0.005
   57    HB2  SER   9           HB2      SER   9   2.191  13.053   2.255
   58    HB3  SER   9           HB1      SER   9   0.690  13.970   2.197
   59    HG   SER   9           HG       SER   9  -0.328  11.975   2.940
   60    H    ILE  10           H        ILE  10   2.371  11.081   2.351
   61    HA   ILE  10           HA       ILE  10   3.175   9.108   0.285
   62    HB   ILE  10           HB       ILE  10   5.338  10.279   1.992
   63   HG12  ILE  10          HG12      ILE  10   4.044  12.194   0.918
   64   HG13  ILE  10          HG11      ILE  10   5.745  12.089   0.464
   65   HG21  ILE  10          HG21      ILE  10   5.030   8.755  -0.545
   66   HG22  ILE  10          HG22      ILE  10   6.242   8.592   0.726
   67   HG23  ILE  10          HG23      ILE  10   6.380   9.887  -0.463
   68   HD11  ILE  10          HD11      ILE  10   5.263  11.576  -1.698
   69   HD12  ILE  10          HD12      ILE  10   3.679  12.257  -1.328
   70   HD13  ILE  10          HD13      ILE  10   3.930  10.514  -1.245
   71    H    CYS  11           H        CYS  11   4.925   7.590   1.593
   72    HA   CYS  11           HA       CYS  11   4.514   7.234   4.399
   73    HB2  CYS  11           HB2      CYS  11   3.139   5.090   4.198
   74    HB3  CYS  11           HB1      CYS  11   2.258   6.595   3.932
   75    H    SER  12           H        SER  12   4.887   4.557   4.728
   76    HA   SER  12           HA       SER  12   7.396   4.061   3.184
   77    HB2  SER  12           HB2      SER  12   7.508   2.362   5.307
   78    HB3  SER  12           HB1      SER  12   8.206   3.979   5.299
   79    HG   SER  12           HG       SER  12   6.439   4.745   6.350
   80    H    LEU  13           H        LEU  13   7.329   2.361   1.775
   81    HA   LEU  13           HA       LEU  13   5.024   0.790   1.383
   82    HB2  LEU  13           HB2      LEU  13   6.325  -0.611  -0.091
   83    HB3  LEU  13           HB1      LEU  13   6.852   1.050  -0.302
   84    HG   LEU  13           HG       LEU  13   8.803  -0.362  -0.254
   85   HD11  LEU  13          HD11      LEU  13   8.931   1.818   0.947
   86   HD12  LEU  13          HD12      LEU  13  10.062   0.614   1.563
   87   HD13  LEU  13          HD13      LEU  13   8.583   0.970   2.449
   88   HD21  LEU  13          HD21      LEU  13   9.051  -2.184   1.057
   89   HD22  LEU  13          HD22      LEU  13   7.337  -1.990   1.421
   90   HD23  LEU  13          HD23      LEU  13   8.550  -1.314   2.507
   91    H    TYR  14           H        TYR  14   7.489   0.470   3.775
   92    HA   TYR  14           HA       TYR  14   6.987  -2.345   4.288
   93    HB2  TYR  14           HB2      TYR  14   8.259  -2.016   6.371
   94    HB3  TYR  14           HB1      TYR  14   9.120  -1.343   4.992
   95    HD1  TYR  14           HD1      TYR  14   6.550  -0.244   7.526
   96    HD2  TYR  14           HD2      TYR  14  10.066   0.751   5.261
   97    HE1  TYR  14           HE1      TYR  14   6.670   1.949   8.673
   98    HE2  TYR  14           HE2      TYR  14  10.184   2.947   6.409
   99    HH   TYR  14           HH       TYR  14   7.829   4.380   7.883
  100    H    GLN  15           H        GLN  15   5.550   0.660   5.188
  101    HA   GLN  15           HA       GLN  15   4.002  -0.438   7.391
  102    HB2  GLN  15           HB2      GLN  15   3.318   1.728   7.711
  103    HB3  GLN  15           HB1      GLN  15   4.710   2.081   6.701
  104    HG2  GLN  15           HG2      GLN  15   3.299   2.207   4.720
  105    HG3  GLN  15           HG1      GLN  15   1.888   1.711   5.653
  106   HE21  GLN  15          HE21      GLN  15   0.955   3.863   4.914
  107   HE22  GLN  15          HE22      GLN  15   1.366   5.262   5.783
  108    H    LEU  16           H        LEU  16   3.793  -0.225   3.957
  109    HA   LEU  16           HA       LEU  16   0.938  -0.634   3.697
  110    HB2  LEU  16           HB2      LEU  16   3.315  -0.920   1.862
  111    HB3  LEU  16           HB1      LEU  16   1.730  -1.506   1.359
  112    HG   LEU  16           HG       LEU  16   2.356   0.910   0.714
  113   HD11  LEU  16          HD11      LEU  16  -0.138  -0.171   1.862
  114   HD12  LEU  16          HD12      LEU  16   0.134   0.631   0.315
  115   HD13  LEU  16          HD13      LEU  16  -0.068   1.589   1.782
  116   HD21  LEU  16          HD21      LEU  16   2.055   2.603   2.419
  117   HD22  LEU  16          HD22      LEU  16   3.248   1.447   3.013
  118   HD23  LEU  16          HD23      LEU  16   1.589   1.387   3.609
  119    H    GLU  17           H        GLU  17   3.693  -2.657   4.301
  120    HA   GLU  17           HA       GLU  17   2.743  -5.174   3.443
  121    HB2  GLU  17           HB2      GLU  17   4.913  -5.337   4.215
  122    HB3  GLU  17           HB1      GLU  17   4.640  -4.200   5.532
  123    HG2  GLU  17           HG2      GLU  17   3.727  -5.836   6.932
  124    HG3  GLU  17           HG1      GLU  17   3.310  -6.896   5.586
  125    H    ASN  18           H        ASN  18   1.654  -3.112   5.988
  126    HA   ASN  18           HA       ASN  18   0.416  -5.053   7.688
  127    HB2  ASN  18           HB2      ASN  18   0.690  -2.282   7.677
  128    HB3  ASN  18           HB1      ASN  18  -1.047  -2.532   7.501
  129   HD21  ASN  18          HD21      ASN  18   0.935  -1.824   9.892
  130   HD22  ASN  18          HD22      ASN  18   0.346  -2.809  11.144
  131    H    TYR  19           H        TYR  19  -0.388  -3.958   4.539
  132    HA   TYR  19           HA       TYR  19  -3.190  -4.924   4.840
  133    HB2  TYR  19           HB2      TYR  19  -2.167  -3.684   2.312
  134    HB3  TYR  19           HB1      TYR  19  -3.775  -3.600   3.026
  135    HD1  TYR  19           HD2      TYR  19  -2.809  -2.927   5.882
  136    HD2  TYR  19           HD1      TYR  19  -1.839  -1.312   2.019
  137    HE1  TYR  19           HE2      TYR  19  -2.225  -0.757   6.934
  138    HE2  TYR  19           HE1      TYR  19  -1.259   0.857   3.071
  139    HH   TYR  19           HH       TYR  19  -0.471   1.605   5.422
  140    H    CYS  20           H        CYS  20  -0.683  -6.608   4.617
  141    HA   CYS  20           HA       CYS  20  -1.044  -7.884   1.981
  142    HB2  CYS  20           HB2      CYS  20   0.886  -8.377   4.254
  143    HB3  CYS  20           HB1      CYS  20   0.839  -9.359   2.790
  144    H    ASN  21           H        ASN  21  -3.221  -8.002   3.927
  145    HA   ASN  21           HA       ASN  21  -3.196 -10.685   5.083
  146    HB2  ASN  21           HB2      ASN  21  -5.233  -8.481   4.850
  147    HB3  ASN  21           HB1      ASN  21  -5.725 -10.094   5.367
  148   HD21  ASN  21          HD21      ASN  21  -3.929  -7.219   6.316
  149   HD22  ASN  21          HD22      ASN  21  -3.604  -7.718   7.905
  150    H1   PHE   1           HT1      PHE   1  11.976   1.678  -2.653
  151    H2   PHE   1           HT2      PHE   1  11.044   0.877  -1.480
  152    H3   PHE   1           HT3      PHE   1  11.688   2.415  -1.152
  153    HA   PHE   1           HA       PHE   1   9.769   1.944  -3.356
  154    HB2  PHE   1           HB2      PHE   1   9.027   1.374  -0.873
  155    HB3  PHE   1           HB1      PHE   1   8.941   3.129  -0.731
  156    HD1  PHE   1           HD1      PHE   1   8.195   0.824  -3.596
  157    HD2  PHE   1           HD2      PHE   1   6.690   3.760  -0.842
  158    HE1  PHE   1           HE1      PHE   1   6.020   0.825  -4.786
  159    HE2  PHE   1           HE2      PHE   1   4.515   3.761  -2.031
  160    HZ   PHE   1           HZ       PHE   1   4.179   2.296  -4.005
  161    H    VAL   2           H        VAL   2   8.827   4.020  -4.023
  162    HA   VAL   2           HA       VAL   2  10.807   6.174  -3.906
  163    HB   VAL   2           HB       VAL   2   9.255   7.338  -5.450
  164   HG11  VAL   2          HG11      VAL   2   9.159   5.327  -7.161
  165   HG12  VAL   2          HG12      VAL   2  10.110   4.501  -5.927
  166   HG13  VAL   2          HG13      VAL   2  10.717   5.985  -6.660
  167   HG21  VAL   2          HG21      VAL   2   7.154   6.395  -6.055
  168   HG22  VAL   2          HG22      VAL   2   7.210   6.299  -4.295
  169   HG23  VAL   2          HG23      VAL   2   7.529   4.863  -5.268
  170    H    ASN   3           H        ASN   3   9.462   8.497  -3.786
  171    HA   ASN   3           HA       ASN   3   7.866   8.389  -1.262
  172    HB2  ASN   3           HB2      ASN   3  10.012  10.438  -1.891
  173    HB3  ASN   3           HB1      ASN   3   9.066  10.326  -0.407
  174   HD21  ASN   3          HD21      ASN   3  10.171   9.289   1.251
  175   HD22  ASN   3          HD22      ASN   3  11.346   8.083   1.039
  176    H    GLN   4           H        GLN   4   6.260   8.529  -3.233
  177    HA   GLN   4           HA       GLN   4   5.616  11.412  -3.576
  178    HB2  GLN   4           HB2      GLN   4   5.138  11.129  -5.923
  179    HB3  GLN   4           HB1      GLN   4   6.764  10.505  -5.643
  180    HG2  GLN   4           HG2      GLN   4   5.796   8.207  -5.433
  181    HG3  GLN   4           HG1      GLN   4   4.220   8.872  -5.868
  182   HE21  GLN   4          HE21      GLN   4   5.701  10.858  -7.727
  183   HE22  GLN   4          HE22      GLN   4   6.048   9.933  -9.107
  184    H    HIS   5           H        HIS   5   3.297  11.203  -4.972
  185    HA   HIS   5           HA       HIS   5   1.543   9.847  -3.027
  186    HB2  HIS   5           HB2      HIS   5   0.676  11.431  -5.448
  187    HB3  HIS   5           HB1      HIS   5  -0.231  11.128  -3.968
  188    HD2  HIS   5           HD2      HIS   5   2.877  13.291  -5.117
  189    HE1  HIS   5           HE1      HIS   5   1.406  14.801  -1.451
  190    HE2  HIS   5           HE2      HIS   5   3.082  15.179  -3.337
  191    H    LEU   6           H        LEU   6   0.238   8.080  -3.529
  192    HA   LEU   6           HA       LEU   6   0.131   7.146  -6.319
  193    HB2  LEU   6           HB2      LEU   6   0.853   4.852  -5.695
  194    HB3  LEU   6           HB1      LEU   6   2.135   6.037  -5.517
  195    HG   LEU   6           HG       LEU   6   2.151   4.519  -3.618
  196   HD11  LEU   6          HD11      LEU   6   0.937   6.882  -2.307
  197   HD12  LEU   6          HD12      LEU   6   2.282   7.201  -3.403
  198   HD13  LEU   6          HD13      LEU   6   2.500   6.114  -2.034
  199   HD21  LEU   6          HD21      LEU   6  -0.561   4.379  -3.912
  200   HD22  LEU   6          HD22      LEU   6  -0.420   5.410  -2.487
  201   HD23  LEU   6          HD23      LEU   6   0.317   3.812  -2.494
  202    H    CYS   7           H        CYS   7  -1.627   5.724  -6.717
  203    HA   CYS   7           HA       CYS   7  -3.364   4.928  -4.481
  204    HB2  CYS   7           HB2      CYS   7  -4.218   6.983  -6.538
  205    HB3  CYS   7           HB1      CYS   7  -5.348   6.109  -5.505
  206    H    GLY   8           H        GLY   8  -5.349   3.769  -5.387
  207    HA2  GLY   8           HA2      GLY   8  -6.201   2.029  -6.698
  208    HA3  GLY   8           HA1      GLY   8  -5.605   2.956  -8.072
  209    H    SER   9           H        SER   9  -4.538   1.537  -9.333
  210    HA   SER   9           HA       SER   9  -3.286  -0.857  -8.510
  211    HB2  SER   9           HB2      SER   9  -2.114   0.543 -10.850
  212    HB3  SER   9           HB1      SER   9  -2.713  -1.108 -10.710
  213    HG   SER   9           HG       SER   9  -4.822  -0.279 -10.776
  214    H    ASP  10           H        ASP  10  -2.224   2.371  -8.100
  215    HA   ASP  10           HA       ASP  10   0.617   1.721  -8.088
  216    HB2  ASP  10           HB2      ASP  10  -0.703   4.124  -6.816
  217    HB3  ASP  10           HB1      ASP  10   0.973   3.980  -7.346
  218    H    LEU  11           H        LEU  11  -1.939   1.976  -5.687
  219    HA   LEU  11           HA       LEU  11  -0.233   1.747  -3.388
  220    HB2  LEU  11           HB2      LEU  11  -3.044   0.645  -3.610
  221    HB3  LEU  11           HB1      LEU  11  -2.214   1.180  -2.150
  222    HG   LEU  11           HG       LEU  11  -2.477   3.165  -4.355
  223   HD11  LEU  11          HD11      LEU  11  -4.712   2.313  -4.403
  224   HD12  LEU  11          HD12      LEU  11  -4.765   3.766  -3.407
  225   HD13  LEU  11          HD13      LEU  11  -4.769   2.174  -2.647
  226   HD21  LEU  11          HD21      LEU  11  -3.116   3.605  -1.459
  227   HD22  LEU  11          HD22      LEU  11  -2.335   4.691  -2.607
  228   HD23  LEU  11          HD23      LEU  11  -1.436   3.338  -1.921
  229    H    VAL  12           H        VAL  12  -1.478  -0.519  -5.720
  230    HA   VAL  12           HA       VAL  12  -0.588  -2.821  -4.113
  231    HB   VAL  12           HB       VAL  12  -1.097  -4.125  -6.241
  232   HG11  VAL  12          HG11      VAL  12  -3.582  -3.869  -5.902
  233   HG12  VAL  12          HG12      VAL  12  -3.228  -2.512  -4.832
  234   HG13  VAL  12          HG13      VAL  12  -2.659  -4.131  -4.423
  235   HG21  VAL  12          HG21      VAL  12  -2.548  -2.976  -7.882
  236   HG22  VAL  12          HG22      VAL  12  -0.930  -2.282  -7.835
  237   HG23  VAL  12          HG23      VAL  12  -2.271  -1.450  -7.047
  238    H    GLU  13           H        GLU  13   0.412  -1.129  -7.113
  239    HA   GLU  13           HA       GLU  13   2.581  -2.657  -7.892
  240    HB2  GLU  13           HB2      GLU  13   2.185  -0.643  -9.114
  241    HB3  GLU  13           HB1      GLU  13   2.320   0.348  -7.661
  242    HG2  GLU  13           HG2      GLU  13   4.583   0.428  -7.785
  243    HG3  GLU  13           HG1      GLU  13   4.707  -1.281  -8.202
  244    H    ALA  14           H        ALA  14   2.244  -0.563  -5.151
  245    HA   ALA  14           HA       ALA  14   4.936  -0.801  -4.137
  246    HB1  ALA  14           HB1      ALA  14   4.156   0.489  -2.358
  247    HB2  ALA  14           HB2      ALA  14   2.568  -0.277  -2.379
  248    HB3  ALA  14           HB3      ALA  14   2.986   0.916  -3.607
  249    H    LEU  15           H        LEU  15   1.865  -2.088  -2.921
  250    HA   LEU  15           HA       LEU  15   3.014  -4.013  -1.158
  251    HB2  LEU  15           HB2      LEU  15   0.346  -3.443  -2.288
  252    HB3  LEU  15           HB1      LEU  15   0.609  -5.137  -1.866
  253    HG   LEU  15           HG       LEU  15   1.657  -3.398   0.205
  254   HD11  LEU  15          HD11      LEU  15  -0.870  -2.865   0.894
  255   HD12  LEU  15          HD12      LEU  15  -1.083  -2.844  -0.857
  256   HD13  LEU  15          HD13      LEU  15   0.067  -1.745  -0.094
  257   HD21  LEU  15          HD21      LEU  15   0.506  -4.911   1.615
  258   HD22  LEU  15          HD22      LEU  15   0.920  -5.886   0.205
  259   HD23  LEU  15          HD23      LEU  15  -0.716  -5.255   0.390
  260    H    TYR  16           H        TYR  16   1.414  -4.573  -4.234
  261    HA   TYR  16           HA       TYR  16   1.723  -7.096  -4.938
  262    HB2  TYR  16           HB2      TYR  16   1.050  -5.792  -6.721
  263    HB3  TYR  16           HB1      TYR  16   2.335  -4.613  -6.483
  264    HD1  TYR  16           HD1      TYR  16   2.478  -8.331  -6.861
  265    HD2  TYR  16           HD2      TYR  16   3.545  -4.497  -8.479
  266    HE1  TYR  16           HE1      TYR  16   3.830  -9.452  -8.618
  267    HE2  TYR  16           HE2      TYR  16   4.897  -5.615 -10.237
  268    HH   TYR  16           HH       TYR  16   5.159  -7.691 -11.313
  269    H    LEU  17           H        LEU  17   4.635  -4.942  -4.906
  270    HA   LEU  17           HA       LEU  17   6.230  -7.422  -5.337
  271    HB2  LEU  17           HB2      LEU  17   8.100  -5.460  -5.426
  272    HB3  LEU  17           HB1      LEU  17   7.207  -6.039  -6.826
  273    HG   LEU  17           HG       LEU  17   5.479  -4.260  -6.351
  274   HD11  LEU  17          HD11      LEU  17   7.631  -3.056  -4.611
  275   HD12  LEU  17          HD12      LEU  17   6.338  -4.036  -3.933
  276   HD13  LEU  17          HD13      LEU  17   5.957  -2.540  -4.777
  277   HD21  LEU  17          HD21      LEU  17   6.838  -2.457  -7.317
  278   HD22  LEU  17          HD22      LEU  17   7.263  -3.996  -8.064
  279   HD23  LEU  17          HD23      LEU  17   8.314  -3.293  -6.836
  280    H    VAL  18           H        VAL  18   5.478  -5.206  -2.781
  281    HA   VAL  18           HA       VAL  18   7.937  -5.732  -1.300
  282    HB   VAL  18           HB       VAL  18   6.932  -4.569   0.535
  283   HG11  VAL  18          HG11      VAL  18   7.342  -2.736  -0.713
  284   HG12  VAL  18          HG12      VAL  18   5.620  -2.731  -1.090
  285   HG13  VAL  18          HG13      VAL  18   6.758  -3.521  -2.180
  286   HG21  VAL  18          HG21      VAL  18   4.374  -5.232  -0.885
  287   HG22  VAL  18          HG22      VAL  18   4.442  -3.862   0.218
  288   HG23  VAL  18          HG23      VAL  18   4.798  -5.486   0.804
  289    H    CYS  19           H        CYS  19   4.668  -7.001  -1.305
  290    HA   CYS  19           HA       CYS  19   5.473  -9.076   0.671
  291    HB2  CYS  19           HB2      CYS  19   2.861  -7.930  -0.235
  292    HB3  CYS  19           HB1      CYS  19   2.882  -9.598   0.340
  293    H    GLY  20           H        GLY  20   4.052  -8.698  -2.573
  294    HA2  GLY  20           HA2      GLY  20   4.498 -10.124  -4.438
  295    HA3  GLY  20           HA1      GLY  20   5.228 -11.295  -3.340
  296    H    GLU  21           H        GLU  21   4.011 -13.050  -2.808
  297    HA   GLU  21           HA       GLU  21   1.111 -12.963  -3.518
  298    HB2  GLU  21           HB2      GLU  21   2.807 -14.669  -4.565
  299    HB3  GLU  21           HB1      GLU  21   2.645 -15.501  -3.018
  300    HG2  GLU  21           HG2      GLU  21   0.961 -16.482  -4.346
  301    HG3  GLU  21           HG1      GLU  21   0.089 -15.273  -3.402
  302    H    ARG  22           H        ARG  22   2.703 -12.270  -0.914
  303    HA   ARG  22           HA       ARG  22   1.726 -14.216   1.019
  304    HB2  ARG  22           HB2      ARG  22   3.763 -12.758   1.350
  305    HB3  ARG  22           HB1      ARG  22   2.672 -11.385   1.547
  306    HG2  ARG  22           HG2      ARG  22   1.724 -12.273   3.523
  307    HG3  ARG  22           HG1      ARG  22   2.346 -13.890   3.197
  308    HD2  ARG  22           HD2      ARG  22   4.655 -13.063   3.519
  309    HD3  ARG  22           HD1      ARG  22   4.023 -11.455   3.873
  310    HE   ARG  22           HE       ARG  22   2.820 -12.603   5.834
  311   HH11  ARG  22          HH21      ARG  22   3.638 -15.379   5.399
  312   HH12  ARG  22          HH22      ARG  22   5.069 -15.534   6.362
  313   HH21  ARG  22          HH11      ARG  22   5.565 -12.113   6.647
  314   HH22  ARG  22          HH12      ARG  22   6.158 -13.685   7.071
  315    H    GLY  23           H        GLY  23   0.292 -11.654  -0.690
  316    HA2  GLY  23           HA2      GLY  23  -2.267 -11.756  -0.232
  317    HA3  GLY  23           HA1      GLY  23  -1.801 -11.293   1.406
  318    H    ALA  24           H        ALA  24  -3.488  -9.711  -0.297
  319    HA   ALA  24           HA       ALA  24  -2.334  -7.142   0.045
  320    HB1  ALA  24           HB1      ALA  24  -2.202  -8.169  -2.807
  321    HB2  ALA  24           HB2      ALA  24  -0.812  -7.841  -1.773
  322    HB3  ALA  24           HB3      ALA  24  -1.855  -6.519  -2.293
  323    H    PHE  25           H        PHE  25  -4.472  -9.060  -2.066
  324    HA   PHE  25           HA       PHE  25  -6.292  -7.151  -2.912
  325    HB2  PHE  25           HB2      PHE  25  -8.066  -8.993  -2.544
  326    HB3  PHE  25           HB1      PHE  25  -6.705  -9.384  -3.594
  327    HD1  PHE  25           HD1      PHE  25  -8.200  -9.903  -0.256
  328    HD2  PHE  25           HD2      PHE  25  -4.979 -10.949  -2.903
  329    HE1  PHE  25           HE1      PHE  25  -7.593 -11.797   1.229
  330    HE2  PHE  25           HE2      PHE  25  -4.374 -12.842  -1.418
  331    HZ   PHE  25           HZ       PHE  25  -5.680 -13.265   0.648
  332    H    TYR  26           H        TYR  26  -6.993  -5.480  -1.641
  333    HA   TYR  26           HA       TYR  26  -8.051  -6.164   1.070
  334    HB2  TYR  26           HB2      TYR  26  -7.592  -3.799   1.648
  335    HB3  TYR  26           HB1      TYR  26  -6.125  -4.636   1.141
  336    HD1  TYR  26           HD2      TYR  26  -5.252  -4.318  -1.193
  337    HD2  TYR  26           HD1      TYR  26  -8.481  -1.965   0.392
  338    HE1  TYR  26           HE2      TYR  26  -4.926  -2.651  -3.002
  339    HE2  TYR  26           HE1      TYR  26  -8.154  -0.299  -1.417
  340    HH   TYR  26           HH       TYR  26  -6.902   0.314  -3.147
  341    H    THR  27           H        THR  27  -9.040  -5.486  -2.012
  342    HA   THR  27           HA       THR  27 -11.215  -3.629  -1.352
  343    HB   THR  27           HB       THR  27 -10.079  -3.699  -3.603
  344    HG1  THR  27           HG1      THR  27 -12.350  -4.012  -4.653
  345   HG21  THR  27          HG21      THR  27  -9.890  -6.162  -3.749
  346   HG22  THR  27          HG22      THR  27 -10.726  -5.495  -5.151
  347   HG23  THR  27          HG23      THR  27 -11.645  -6.281  -3.868
  348    H    LYS  28           H        LYS  28 -13.459  -4.202  -1.378
  349    HA   LYS  28           HA       LYS  28 -14.046  -7.123  -1.276
  350    HB2  LYS  28           HB2      LYS  28 -14.120  -5.261   0.935
  351    HB3  LYS  28           HB1      LYS  28 -15.739  -5.884   0.613
  352    HG2  LYS  28           HG2      LYS  28 -14.733  -8.206   0.572
  353    HG3  LYS  28           HG1      LYS  28 -13.229  -7.491   1.154
  354    HD2  LYS  28           HD2      LYS  28 -14.330  -6.675   3.159
  355    HD3  LYS  28           HD1      LYS  28 -15.900  -7.211   2.560
  356    HE2  LYS  28           HE2      LYS  28 -14.986  -8.826   4.185
  357    HE3  LYS  28           HE1      LYS  28 -15.110  -9.550   2.581
  358    HZ1  LYS  28           HZ1      LYS  28 -12.956  -9.908   3.814
  359    HZ2  LYS  28           HZ2      LYS  28 -12.628  -8.262   3.550
  360    HZ3  LYS  28           HZ3      LYS  28 -12.818  -9.315   2.231
  361    HA   PRO  29           HA       PRO  29 -17.083  -5.049  -3.959
  362    HB2  PRO  29           HB2      PRO  29 -17.181  -7.124  -5.760
  363    HB3  PRO  29           HB1      PRO  29 -15.985  -5.818  -5.835
  364    HG2  PRO  29           HG2      PRO  29 -15.625  -8.647  -4.955
  365    HG3  PRO  29           HG1      PRO  29 -14.436  -7.523  -5.637
  366    HD2  PRO  29           HD2      PRO  29 -14.703  -8.194  -2.899
  367    HD3  PRO  29           HD1      PRO  29 -13.757  -6.840  -3.555
  368    H    THR  30           H        THR  30 -18.183  -5.861  -1.712
  369    HA   THR  30           HA       THR  30 -20.204  -7.911  -2.516
  370    HB   THR  30           HB       THR  30 -20.081  -8.992  -0.449
  371    HG1  THR  30           HG1      THR  30 -20.174  -7.608   1.130
  372   HG21  THR  30          HG21      THR  30 -17.720  -9.422   0.003
  373   HG22  THR  30          HG22      THR  30 -17.266  -7.939  -0.837
  374   HG23  THR  30          HG23      THR  30 -17.971  -9.282  -1.737
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1 -10.254   5.460   4.000
    2    H2   GLY   1           HT2      GLY   1  -9.895   3.886   3.473
    3    H3   GLY   1           HT3      GLY   1  -8.868   5.176   3.063
    4    HA2  GLY   1           HA1      GLY   1  -8.140   5.325   5.305
    5    HA3  GLY   1           HA2      GLY   1  -9.436   4.250   5.911
    6    H    ILE   2           H        ILE   2  -7.972   2.703   3.491
    7    HA   ILE   2           HA       ILE   2  -5.632   1.814   4.900
    8    HB   ILE   2           HB       ILE   2  -6.793   0.346   3.327
    9   HG12  ILE   2          HG12      ILE   2  -4.238   0.786   1.868
   10   HG13  ILE   2          HG11      ILE   2  -4.112   0.515   3.607
   11   HG21  ILE   2          HG21      ILE   2  -6.962   0.780   1.003
   12   HG22  ILE   2          HG22      ILE   2  -5.767   2.075   1.075
   13   HG23  ILE   2          HG23      ILE   2  -7.370   2.315   1.770
   14   HD11  ILE   2          HD11      ILE   2  -4.385  -1.459   1.659
   15   HD12  ILE   2          HD12      ILE   2  -5.999  -1.321   2.354
   16   HD13  ILE   2          HD13      ILE   2  -4.620  -1.674   3.393
   17    H    VAL   3           H        VAL   3  -5.972   3.811   1.937
   18    HA   VAL   3           HA       VAL   3  -3.139   4.667   2.326
   19    HB   VAL   3           HB       VAL   3  -3.270   5.432  -0.021
   20   HG11  VAL   3          HG11      VAL   3  -3.288   2.780   0.947
   21   HG12  VAL   3          HG12      VAL   3  -2.636   3.355  -0.585
   22   HG13  VAL   3          HG13      VAL   3  -4.301   2.781  -0.496
   23   HG21  VAL   3          HG21      VAL   3  -5.278   4.871  -1.348
   24   HG22  VAL   3          HG22      VAL   3  -5.688   5.967  -0.030
   25   HG23  VAL   3          HG23      VAL   3  -6.064   4.250   0.103
   26    H    GLU   4           H        GLU   4  -6.044   5.669   3.306
   27    HA   GLU   4           HA       GLU   4  -6.647   8.212   2.502
   28    HB2  GLU   4           HB2      GLU   4  -7.303   8.739   4.798
   29    HB3  GLU   4           HB1      GLU   4  -7.709   7.059   4.438
   30    HG2  GLU   4           HG2      GLU   4  -6.549   6.515   6.298
   31    HG3  GLU   4           HG1      GLU   4  -5.096   6.913   5.383
   32    H    GLN   5           H        GLN   5  -3.705   7.250   4.161
   33    HA   GLN   5           HA       GLN   5  -2.847  10.107   4.218
   34    HB2  GLN   5           HB2      GLN   5  -0.884   8.962   5.580
   35    HB3  GLN   5           HB1      GLN   5  -2.428   9.307   6.361
   36    HG2  GLN   5           HG2      GLN   5  -3.185   7.019   5.954
   37    HG3  GLN   5           HG1      GLN   5  -1.695   6.657   5.079
   38   HE21  GLN   5          HE21      GLN   5  -3.048   7.249   8.302
   39   HE22  GLN   5          HE22      GLN   5  -1.679   6.736   9.163
   40    H    CYS   6           H        CYS   6  -1.731   6.861   3.220
   41    HA   CYS   6           HA       CYS   6   0.688   7.763   1.986
   42    HB2  CYS   6           HB2      CYS   6  -0.942   5.416   1.016
   43    HB3  CYS   6           HB1      CYS   6   0.812   5.600   1.015
   44    H    CYS   7           H        CYS   7  -2.643   7.780   0.986
   45    HA   CYS   7           HA       CYS   7  -2.029   8.284  -1.830
   46    HB2  CYS   7           HB2      CYS   7  -4.422   7.818  -0.200
   47    HB3  CYS   7           HB1      CYS   7  -4.651   9.019  -1.467
   48    H    THR   8           H        THR   8  -2.816  10.208   1.032
   49    HA   THR   8           HA       THR   8  -3.130  12.655  -0.553
   50    HB   THR   8           HB       THR   8  -4.332  12.190   1.645
   51    HG1  THR   8           HG1      THR   8  -2.799  14.502   1.152
   52   HG21  THR   8          HG21      THR   8  -1.628  12.934   2.791
   53   HG22  THR   8          HG22      THR   8  -2.320  11.313   2.827
   54   HG23  THR   8          HG23      THR   8  -3.104  12.625   3.704
   55    H    SER   9           H        SER   9  -0.695  11.380   1.746
   56    HA   SER   9           HA       SER   9   1.192  13.405   0.614
   57    HB2  SER   9           HB2      SER   9   2.429  13.079   2.822
   58    HB3  SER   9           HB1      SER   9   0.879  13.909   2.926
   59    HG   SER   9           HG       SER   9  -0.045  11.866   3.470
   60    H    ILE  10           H        ILE  10   2.817  11.240   2.614
   61    HA   ILE  10           HA       ILE  10   3.487   9.494   0.282
   62    HB   ILE  10           HB       ILE  10   5.515  10.147   2.396
   63   HG12  ILE  10          HG12      ILE  10   4.470  12.306   1.539
   64   HG13  ILE  10          HG11      ILE  10   6.202  12.146   1.247
   65   HG21  ILE  10          HG21      ILE  10   6.521   8.671   0.975
   66   HG22  ILE  10          HG22      ILE  10   6.766  10.105  -0.023
   67   HG23  ILE  10          HG23      ILE  10   5.405   9.029  -0.343
   68   HD11  ILE  10          HD11      ILE  10   4.900  12.952  -0.755
   69   HD12  ILE  10          HD12      ILE  10   4.081  11.390  -0.780
   70   HD13  ILE  10          HD13      ILE  10   5.822  11.476  -1.045
   71    H    CYS  11           H        CYS  11   5.039   7.614   1.458
   72    HA   CYS  11           HA       CYS  11   4.092   6.733   4.039
   73    HB2  CYS  11           HB2      CYS  11   2.450   6.121   1.750
   74    HB3  CYS  11           HB1      CYS  11   3.115   4.631   2.418
   75    H    SER  12           H        SER  12   4.807   4.397   4.427
   76    HA   SER  12           HA       SER  12   7.375   3.940   2.979
   77    HB2  SER  12           HB2      SER  12   7.413   2.256   5.126
   78    HB3  SER  12           HB1      SER  12   8.086   3.883   5.131
   79    HG   SER  12           HG       SER  12   6.414   4.579   6.258
   80    H    LEU  13           H        LEU  13   7.413   2.255   1.564
   81    HA   LEU  13           HA       LEU  13   5.210   0.615   1.018
   82    HB2  LEU  13           HB2      LEU  13   6.664  -0.769  -0.325
   83    HB3  LEU  13           HB1      LEU  13   7.158   0.904  -0.512
   84    HG   LEU  13           HG       LEU  13   9.140  -0.459  -0.289
   85   HD11  LEU  13          HD11      LEU  13   9.100   1.751   0.876
   86   HD12  LEU  13          HD12      LEU  13  10.227   0.597   1.590
   87   HD13  LEU  13          HD13      LEU  13   8.679   0.912   2.365
   88   HD21  LEU  13          HD21      LEU  13   9.347  -2.238   1.089
   89   HD22  LEU  13          HD22      LEU  13   7.600  -2.109   1.286
   90   HD23  LEU  13          HD23      LEU  13   8.678  -1.364   2.467
   91    H    TYR  14           H        TYR  14   7.500   0.335   3.585
   92    HA   TYR  14           HA       TYR  14   6.955  -2.485   4.067
   93    HB2  TYR  14           HB2      TYR  14   8.147  -2.162   6.202
   94    HB3  TYR  14           HB1      TYR  14   9.070  -1.507   4.856
   95    HD1  TYR  14           HD1      TYR  14   6.429  -0.390   7.297
   96    HD2  TYR  14           HD2      TYR  14   9.997   0.603   5.116
   97    HE1  TYR  14           HE1      TYR  14   6.510   1.813   8.430
   98    HE2  TYR  14           HE2      TYR  14  10.078   2.808   6.248
   99    HH   TYR  14           HH       TYR  14   8.442   3.524   8.989
  100    H    GLN  15           H        GLN  15   5.566   0.554   4.977
  101    HA   GLN  15           HA       GLN  15   3.912  -0.524   7.097
  102    HB2  GLN  15           HB2      GLN  15   3.135   1.650   7.319
  103    HB3  GLN  15           HB1      GLN  15   4.692   1.945   6.561
  104    HG2  GLN  15           HG2      GLN  15   3.451   3.170   5.090
  105    HG3  GLN  15           HG1      GLN  15   3.139   1.594   4.358
  106   HE21  GLN  15          HE21      GLN  15   1.475   0.787   6.786
  107   HE22  GLN  15          HE22      GLN  15  -0.003   1.593   6.575
  108    H    LEU  16           H        LEU  16   3.759  -0.269   3.648
  109    HA   LEU  16           HA       LEU  16   0.903  -0.657   3.379
  110    HB2  LEU  16           HB2      LEU  16   3.271  -0.874   1.533
  111    HB3  LEU  16           HB1      LEU  16   1.699  -1.488   1.019
  112    HG   LEU  16           HG       LEU  16   0.735   0.765   1.670
  113   HD11  LEU  16          HD11      LEU  16   2.962   2.399   1.364
  114   HD12  LEU  16          HD12      LEU  16   3.522   1.120   2.438
  115   HD13  LEU  16          HD13      LEU  16   2.111   2.081   2.875
  116   HD21  LEU  16          HD21      LEU  16   1.264   0.090  -0.680
  117   HD22  LEU  16          HD22      LEU  16   2.869   0.796  -0.486
  118   HD23  LEU  16          HD23      LEU  16   1.437   1.825  -0.415
  119    H    GLU  17           H        GLU  17   3.698  -2.760   3.732
  120    HA   GLU  17           HA       GLU  17   2.678  -5.227   2.900
  121    HB2  GLU  17           HB2      GLU  17   4.205  -6.245   4.410
  122    HB3  GLU  17           HB1      GLU  17   4.944  -4.692   4.025
  123    HG2  GLU  17           HG2      GLU  17   3.666  -3.817   6.114
  124    HG3  GLU  17           HG1      GLU  17   3.514  -5.521   6.543
  125    H    ASN  18           H        ASN  18   1.781  -3.218   5.565
  126    HA   ASN  18           HA       ASN  18   0.348  -5.054   7.187
  127    HB2  ASN  18           HB2      ASN  18   0.891  -2.409   7.355
  128    HB3  ASN  18           HB1      ASN  18  -0.795  -2.335   6.842
  129   HD21  ASN  18          HD21      ASN  18  -0.812  -1.387   9.238
  130   HD22  ASN  18          HD22      ASN  18  -1.130  -2.519  10.462
  131    H    TYR  19           H        TYR  19  -0.634  -3.206   4.357
  132    HA   TYR  19           HA       TYR  19  -3.399  -3.960   4.405
  133    HB2  TYR  19           HB2      TYR  19  -1.844  -3.378   1.886
  134    HB3  TYR  19           HB1      TYR  19  -3.536  -3.033   2.227
  135    HD1  TYR  19           HD2      TYR  19  -2.612  -2.148   5.218
  136    HD2  TYR  19           HD1      TYR  19  -1.624  -0.956   1.208
  137    HE1  TYR  19           HE2      TYR  19  -1.983   0.105   6.042
  138    HE2  TYR  19           HE1      TYR  19  -0.999   1.298   2.033
  139    HH   TYR  19           HH       TYR  19  -1.727   2.734   4.188
  140    H    CYS  20           H        CYS  20  -0.609  -5.780   3.813
  141    HA   CYS  20           HA       CYS  20  -1.656  -7.604   1.829
  142    HB2  CYS  20           HB2      CYS  20   0.549  -7.990   3.867
  143    HB3  CYS  20           HB1      CYS  20   0.237  -9.048   2.492
  144    H    ASN  21           H        ASN  21  -0.728  -8.553   5.097
  145    HA   ASN  21           HA       ASN  21  -2.304 -10.798   5.386
  146    HB2  ASN  21           HB2      ASN  21  -2.107  -8.811   7.647
  147    HB3  ASN  21           HB1      ASN  21  -2.088 -10.572   7.730
  148   HD21  ASN  21          HD21      ASN  21  -0.182 -11.053   5.611
  149   HD22  ASN  21          HD22      ASN  21   1.328 -10.477   6.128
  150    H1   PHE   1           HT1      PHE   1  12.179   1.282  -2.710
  151    H2   PHE   1           HT2      PHE   1  11.422   1.016  -1.213
  152    H3   PHE   1           HT3      PHE   1  12.384   2.396  -1.446
  153    HA   PHE   1           HA       PHE   1  10.271   2.186  -3.372
  154    HB2  PHE   1           HB2      PHE   1   9.478   1.242  -0.969
  155    HB3  PHE   1           HB1      PHE   1   9.285   2.971  -0.677
  156    HD1  PHE   1           HD1      PHE   1   8.861   0.983  -3.822
  157    HD2  PHE   1           HD2      PHE   1   6.977   3.411  -0.818
  158    HE1  PHE   1           HE1      PHE   1   6.758   0.975  -5.134
  159    HE2  PHE   1           HE2      PHE   1   4.874   3.404  -2.131
  160    HZ   PHE   1           HZ       PHE   1   4.762   2.186  -4.289
  161    H    VAL   2           H        VAL   2   9.777   4.302  -4.011
  162    HA   VAL   2           HA       VAL   2  11.608   6.374  -3.061
  163    HB   VAL   2           HB       VAL   2  10.579   7.770  -4.791
  164   HG11  VAL   2          HG11      VAL   2  10.629   5.353  -6.393
  165   HG12  VAL   2          HG12      VAL   2  11.931   5.338  -5.203
  166   HG13  VAL   2          HG13      VAL   2  11.794   6.676  -6.344
  167   HG21  VAL   2          HG21      VAL   2   8.710   5.456  -5.334
  168   HG22  VAL   2          HG22      VAL   2   8.650   7.079  -6.019
  169   HG23  VAL   2          HG23      VAL   2   8.250   6.823  -4.321
  170    H    ASN   3           H        ASN   3  10.305   8.681  -2.891
  171    HA   ASN   3           HA       ASN   3   8.133   8.215  -0.886
  172    HB2  ASN   3           HB2      ASN   3  10.303  10.336  -0.827
  173    HB3  ASN   3           HB1      ASN   3   8.987  10.191   0.339
  174   HD21  ASN   3          HD21      ASN   3  11.634   9.993   1.280
  175   HD22  ASN   3          HD22      ASN   3  11.953   8.391   1.738
  176    H    GLN   4           H        GLN   4   6.419   8.679  -2.295
  177    HA   GLN   4           HA       GLN   4   6.010  11.508  -2.901
  178    HB2  GLN   4           HB2      GLN   4   5.492  10.896  -5.363
  179    HB3  GLN   4           HB1      GLN   4   7.188  11.057  -4.905
  180    HG2  GLN   4           HG2      GLN   4   7.578   8.776  -4.999
  181    HG3  GLN   4           HG1      GLN   4   5.900   8.371  -4.635
  182   HE21  GLN   4          HE21      GLN   4   6.137   6.902  -6.610
  183   HE22  GLN   4          HE22      GLN   4   5.894   7.585  -8.146
  184    H    HIS   5           H        HIS   5   3.821  11.504  -4.376
  185    HA   HIS   5           HA       HIS   5   1.851  10.141  -2.704
  186    HB2  HIS   5           HB2      HIS   5   1.340  11.697  -5.246
  187    HB3  HIS   5           HB1      HIS   5   0.208  11.388  -3.930
  188    HD2  HIS   5           HD2      HIS   5   3.591  13.424  -4.409
  189    HE1  HIS   5           HE1      HIS   5   1.332  15.142  -1.275
  190    HE2  HIS   5           HE2      HIS   5   3.445  15.369  -2.687
  191    H    LEU   6           H        LEU   6   0.598   8.367  -3.289
  192    HA   LEU   6           HA       LEU   6   0.686   7.366  -6.040
  193    HB2  LEU   6           HB2      LEU   6   1.513   5.137  -5.396
  194    HB3  LEU   6           HB1      LEU   6   2.718   6.381  -5.111
  195    HG   LEU   6           HG       LEU   6   2.710   4.864  -3.233
  196   HD11  LEU   6          HD11      LEU   6   2.706   6.420  -1.547
  197   HD12  LEU   6          HD12      LEU   6   1.161   7.112  -2.042
  198   HD13  LEU   6          HD13      LEU   6   2.633   7.511  -2.931
  199   HD21  LEU   6          HD21      LEU   6   0.876   3.914  -2.341
  200   HD22  LEU   6          HD22      LEU   6   0.025   4.534  -3.753
  201   HD23  LEU   6          HD23      LEU   6   0.018   5.449  -2.244
  202    H    CYS   7           H        CYS   7  -1.024   5.942  -6.500
  203    HA   CYS   7           HA       CYS   7  -2.781   4.980  -4.348
  204    HB2  CYS   7           HB2      CYS   7  -3.743   7.066  -6.332
  205    HB3  CYS   7           HB1      CYS   7  -4.788   6.155  -5.245
  206    H    GLY   8           H        GLY   8  -4.943   4.194  -5.606
  207    HA2  GLY   8           HA2      GLY   8  -5.698   2.420  -6.952
  208    HA3  GLY   8           HA1      GLY   8  -5.074   3.439  -8.244
  209    H    SER   9           H        SER   9  -3.967   2.158  -9.594
  210    HA   SER   9           HA       SER   9  -2.840  -0.346  -9.075
  211    HB2  SER   9           HB2      SER   9  -2.150   1.771 -11.108
  212    HB3  SER   9           HB1      SER   9  -1.309   0.225 -11.069
  213    HG   SER   9           HG       SER   9  -4.061   0.750 -11.479
  214    H    ASP  10           H        ASP  10  -1.656   2.764  -8.189
  215    HA   ASP  10           HA       ASP  10   1.114   1.945  -7.885
  216    HB2  ASP  10           HB2      ASP  10  -0.198   4.232  -6.418
  217    HB3  ASP  10           HB1      ASP  10   1.485   4.086  -6.928
  218    H    LEU  11           H        LEU  11  -1.732   2.012  -5.842
  219    HA   LEU  11           HA       LEU  11  -0.443   1.491  -3.344
  220    HB2  LEU  11           HB2      LEU  11  -3.179   1.158  -4.456
  221    HB3  LEU  11           HB1      LEU  11  -2.778   0.106  -3.107
  222    HG   LEU  11           HG       LEU  11  -2.684   1.829  -1.605
  223   HD11  LEU  11          HD11      LEU  11  -2.244   4.278  -2.644
  224   HD12  LEU  11          HD12      LEU  11  -1.425   3.303  -3.864
  225   HD13  LEU  11          HD13      LEU  11  -0.931   3.199  -2.175
  226   HD21  LEU  11          HD21      LEU  11  -4.904   2.099  -2.338
  227   HD22  LEU  11          HD22      LEU  11  -4.405   2.794  -3.882
  228   HD23  LEU  11          HD23      LEU  11  -4.255   3.736  -2.399
  229    H    VAL  12           H        VAL  12  -1.256  -0.502  -6.082
  230    HA   VAL  12           HA       VAL  12  -0.454  -2.938  -4.629
  231    HB   VAL  12           HB       VAL  12  -0.835  -4.052  -6.864
  232   HG11  VAL  12          HG11      VAL  12  -2.850  -2.679  -5.165
  233   HG12  VAL  12          HG12      VAL  12  -2.638  -4.399  -5.496
  234   HG13  VAL  12          HG13      VAL  12  -3.432  -3.364  -6.684
  235   HG21  VAL  12          HG21      VAL  12  -0.530  -2.070  -8.286
  236   HG22  VAL  12          HG22      VAL  12  -1.949  -1.319  -7.557
  237   HG23  VAL  12          HG23      VAL  12  -2.125  -2.775  -8.533
  238    H    GLU  13           H        GLU  13   0.703  -0.987  -7.419
  239    HA   GLU  13           HA       GLU  13   2.960  -2.440  -8.117
  240    HB2  GLU  13           HB2      GLU  13   2.611  -0.388  -9.285
  241    HB3  GLU  13           HB1      GLU  13   2.587   0.544  -7.788
  242    HG2  GLU  13           HG2      GLU  13   4.876   0.572  -7.606
  243    HG3  GLU  13           HG1      GLU  13   5.059  -1.013  -8.355
  244    H    ALA  14           H        ALA  14   2.359  -0.469  -5.330
  245    HA   ALA  14           HA       ALA  14   4.974  -0.724  -4.112
  246    HB1  ALA  14           HB1      ALA  14   2.757  -0.269  -2.276
  247    HB2  ALA  14           HB2      ALA  14   2.661   0.789  -3.683
  248    HB3  ALA  14           HB3      ALA  14   4.106   0.797  -2.671
  249    H    LEU  15           H        LEU  15   1.821  -1.957  -3.076
  250    HA   LEU  15           HA       LEU  15   2.801  -3.928  -1.299
  251    HB2  LEU  15           HB2      LEU  15   0.245  -3.506  -2.805
  252    HB3  LEU  15           HB1      LEU  15   0.497  -5.071  -2.030
  253    HG   LEU  15           HG       LEU  15   1.248  -2.874  -0.269
  254   HD11  LEU  15          HD11      LEU  15  -0.441  -1.439  -0.719
  255   HD12  LEU  15          HD12      LEU  15  -1.533  -2.670  -0.088
  256   HD13  LEU  15          HD13      LEU  15  -1.209  -2.583  -1.819
  257   HD21  LEU  15          HD21      LEU  15   0.584  -4.435   1.218
  258   HD22  LEU  15          HD22      LEU  15   0.221  -5.492  -0.146
  259   HD23  LEU  15          HD23      LEU  15  -1.041  -4.465   0.535
  260    H    TYR  16           H        TYR  16   1.554  -4.402  -4.543
  261    HA   TYR  16           HA       TYR  16   1.894  -6.903  -5.307
  262    HB2  TYR  16           HB2      TYR  16   1.475  -5.364  -7.038
  263    HB3  TYR  16           HB1      TYR  16   2.928  -4.435  -6.687
  264    HD1  TYR  16           HD1      TYR  16   2.202  -8.052  -7.367
  265    HD2  TYR  16           HD2      TYR  16   4.513  -4.569  -8.356
  266    HE1  TYR  16           HE1      TYR  16   3.474  -9.376  -9.042
  267    HE2  TYR  16           HE2      TYR  16   5.787  -5.889 -10.033
  268    HH   TYR  16           HH       TYR  16   4.901  -9.231 -10.795
  269    H    LEU  17           H        LEU  17   4.872  -4.829  -5.066
  270    HA   LEU  17           HA       LEU  17   6.382  -7.391  -5.206
  271    HB2  LEU  17           HB2      LEU  17   8.330  -5.476  -5.161
  272    HB3  LEU  17           HB1      LEU  17   7.620  -6.160  -6.618
  273    HG   LEU  17           HG       LEU  17   5.860  -4.318  -6.463
  274   HD11  LEU  17          HD11      LEU  17   5.922  -2.892  -4.719
  275   HD12  LEU  17          HD12      LEU  17   7.613  -2.520  -5.031
  276   HD13  LEU  17          HD13      LEU  17   7.184  -3.891  -4.009
  277   HD21  LEU  17          HD21      LEU  17   7.464  -4.031  -8.156
  278   HD22  LEU  17          HD22      LEU  17   8.787  -3.856  -7.002
  279   HD23  LEU  17          HD23      LEU  17   7.624  -2.548  -7.215
  280    H    VAL  18           H        VAL  18   5.685  -4.841  -2.877
  281    HA   VAL  18           HA       VAL  18   7.872  -5.432  -1.114
  282    HB   VAL  18           HB       VAL  18   6.690  -4.239   0.576
  283   HG11  VAL  18          HG11      VAL  18   5.453  -2.463  -1.106
  284   HG12  VAL  18          HG12      VAL  18   6.555  -3.295  -2.205
  285   HG13  VAL  18          HG13      VAL  18   7.185  -2.486  -0.772
  286   HG21  VAL  18          HG21      VAL  18   4.260  -4.989  -1.025
  287   HG22  VAL  18          HG22      VAL  18   4.217  -3.664   0.130
  288   HG23  VAL  18          HG23      VAL  18   4.585  -5.299   0.676
  289    H    CYS  19           H        CYS  19   4.624  -6.749  -1.380
  290    HA   CYS  19           HA       CYS  19   5.246  -8.754   0.718
  291    HB2  CYS  19           HB2      CYS  19   2.747  -7.736  -0.572
  292    HB3  CYS  19           HB1      CYS  19   2.740  -9.385   0.051
  293    H    GLY  20           H        GLY  20   3.575  -8.910  -2.445
  294    HA2  GLY  20           HA2      GLY  20   3.828 -10.439  -4.209
  295    HA3  GLY  20           HA1      GLY  20   5.420 -10.825  -3.554
  296    H    GLU  21           H        GLU  21   2.149 -11.867  -3.813
  297    HA   GLU  21           HA       GLU  21   1.090 -13.838  -3.104
  298    HB2  GLU  21           HB2      GLU  21   3.264 -14.727  -4.150
  299    HB3  GLU  21           HB1      GLU  21   3.856 -14.884  -2.497
  300    HG2  GLU  21           HG2      GLU  21   2.384 -16.581  -1.977
  301    HG3  GLU  21           HG1      GLU  21   1.159 -16.009  -3.110
  302    H    ARG  22           H        ARG  22   2.214 -11.699  -1.115
  303    HA   ARG  22           HA       ARG  22   2.154 -13.388   1.340
  304    HB2  ARG  22           HB2      ARG  22   3.558 -10.966   0.575
  305    HB3  ARG  22           HB1      ARG  22   2.639 -10.714   2.060
  306    HG2  ARG  22           HG2      ARG  22   3.730 -13.202   2.485
  307    HG3  ARG  22           HG1      ARG  22   5.009 -12.393   1.580
  308    HD2  ARG  22           HD2      ARG  22   5.538 -11.730   3.743
  309    HD3  ARG  22           HD1      ARG  22   4.492 -10.401   3.243
  310    HE   ARG  22           HE       ARG  22   2.629 -11.641   4.442
  311   HH11  ARG  22          HH21      ARG  22   4.012 -14.167   5.069
  312   HH12  ARG  22          HH22      ARG  22   4.576 -13.913   6.687
  313   HH21  ARG  22          HH11      ARG  22   4.186 -10.470   6.564
  314   HH22  ARG  22          HH12      ARG  22   4.674 -11.819   7.533
  315    H    GLY  23           H        GLY  23  -0.208 -12.573  -0.356
  316    HA2  GLY  23           HA2      GLY  23  -2.460 -12.152   0.246
  317    HA3  GLY  23           HA1      GLY  23  -1.914 -11.737   1.871
  318    H    ALA  24           H        ALA  24  -3.755 -10.271   0.005
  319    HA   ALA  24           HA       ALA  24  -3.121  -7.629   0.637
  320    HB1  ALA  24           HB1      ALA  24  -1.176  -7.450  -0.602
  321    HB2  ALA  24           HB2      ALA  24  -2.353  -6.987  -1.831
  322    HB3  ALA  24           HB3      ALA  24  -1.709  -8.628  -1.803
  323    H    PHE  25           H        PHE  25  -5.392  -9.369   0.153
  324    HA   PHE  25           HA       PHE  25  -6.736  -7.905  -2.066
  325    HB2  PHE  25           HB2      PHE  25  -8.426  -9.887  -1.777
  326    HB3  PHE  25           HB1      PHE  25  -6.913 -10.169  -2.638
  327    HD1  PHE  25           HD2      PHE  25  -5.010 -11.300  -1.506
  328    HD2  PHE  25           HD1      PHE  25  -8.849 -10.880   0.380
  329    HE1  PHE  25           HE2      PHE  25  -4.384 -13.034   0.156
  330    HE2  PHE  25           HE1      PHE  25  -8.224 -12.612   2.041
  331    HZ   PHE  25           HZ       PHE  25  -5.991 -13.689   1.930
  332    H    TYR  26           H        TYR  26  -7.430  -6.106  -0.830
  333    HA   TYR  26           HA       TYR  26  -9.222  -6.737   1.475
  334    HB2  TYR  26           HB2      TYR  26  -8.927  -4.122   1.769
  335    HB3  TYR  26           HB1      TYR  26  -7.676  -5.228   2.332
  336    HD1  TYR  26           HD2      TYR  26  -5.640  -5.636   0.932
  337    HD2  TYR  26           HD1      TYR  26  -8.546  -2.634  -0.077
  338    HE1  TYR  26           HE2      TYR  26  -4.008  -4.572  -0.603
  339    HE2  TYR  26           HE1      TYR  26  -6.913  -1.570  -1.612
  340    HH   TYR  26           HH       TYR  26  -4.935  -1.874  -2.687
  341    H    THR  27           H        THR  27  -9.194  -5.684  -1.766
  342    HA   THR  27           HA       THR  27 -11.694  -4.141  -1.551
  343    HB   THR  27           HB       THR  27  -9.863  -3.592  -3.211
  344    HG1  THR  27           HG1      THR  27 -12.328  -3.300  -3.415
  345   HG21  THR  27          HG21      THR  27 -10.871  -5.683  -5.045
  346   HG22  THR  27          HG22      THR  27  -9.857  -6.262  -3.723
  347   HG23  THR  27          HG23      THR  27  -9.237  -5.051  -4.845
  348    H    LYS  28           H        LYS  28 -13.704  -4.859  -2.427
  349    HA   LYS  28           HA       LYS  28 -14.213  -7.214  -3.855
  350    HB2  LYS  28           HB2      LYS  28 -14.988  -8.699  -1.910
  351    HB3  LYS  28           HB1      LYS  28 -13.245  -8.566  -2.147
  352    HG2  LYS  28           HG2      LYS  28 -12.958  -7.194  -0.286
  353    HG3  LYS  28           HG1      LYS  28 -14.626  -6.625  -0.322
  354    HD2  LYS  28           HD2      LYS  28 -15.455  -8.613   0.635
  355    HD3  LYS  28           HD1      LYS  28 -13.996  -9.520   0.232
  356    HE2  LYS  28           HE2      LYS  28 -12.753  -7.928   1.810
  357    HE3  LYS  28           HE1      LYS  28 -14.343  -7.410   2.369
  358    HZ1  LYS  28           HZ1      LYS  28 -14.841  -9.766   2.845
  359    HZ2  LYS  28           HZ2      LYS  28 -13.558  -9.154   3.776
  360    HZ3  LYS  28           HZ3      LYS  28 -13.241 -10.165   2.447
  361    HA   PRO  29           HA       PRO  29 -17.881  -4.673  -2.976
  362    HB2  PRO  29           HB2      PRO  29 -18.760  -4.716  -5.581
  363    HB3  PRO  29           HB1      PRO  29 -17.589  -3.540  -4.963
  364    HG2  PRO  29           HG2      PRO  29 -17.122  -5.912  -6.711
  365    HG3  PRO  29           HG1      PRO  29 -16.190  -4.411  -6.584
  366    HD2  PRO  29           HD2      PRO  29 -15.488  -6.896  -5.428
  367    HD3  PRO  29           HD1      PRO  29 -14.763  -5.321  -5.038
  368    H    THR  30           H        THR  30 -18.157  -7.077  -1.972
  369    HA   THR  30           HA       THR  30 -19.912  -8.785  -3.609
  370    HB   THR  30           HB       THR  30 -19.846 -10.314  -1.717
  371    HG1  THR  30           HG1      THR  30 -18.387  -9.390   0.070
  372   HG21  THR  30          HG21      THR  30 -17.481 -10.745  -1.633
  373   HG22  THR  30          HG22      THR  30 -17.106  -9.061  -1.995
  374   HG23  THR  30          HG23      THR  30 -17.832 -10.088  -3.231
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1 -10.532   4.246   2.076
    2    H2   GLY   1           HT2      GLY   1  -8.867   4.234   1.739
    3    H3   GLY   1           HT3      GLY   1  -9.575   5.590   2.475
    4    HA2  GLY   1           HA1      GLY   1  -9.270   4.639   4.472
    5    HA3  GLY   1           HA2      GLY   1 -10.165   3.166   3.987
    6    H    ILE   2           H        ILE   2  -8.115   1.729   3.800
    7    HA   ILE   2           HA       ILE   2  -6.015   2.154   5.588
    8    HB   ILE   2           HB       ILE   2  -6.358  -0.045   4.726
    9   HG12  ILE   2          HG12      ILE   2  -3.928   0.857   5.094
   10   HG13  ILE   2          HG11      ILE   2  -4.147  -0.705   4.311
   11   HG21  ILE   2          HG21      ILE   2  -7.201  -0.120   2.627
   12   HG22  ILE   2          HG22      ILE   2  -5.517  -0.134   2.100
   13   HG23  ILE   2          HG23      ILE   2  -6.410   1.386   2.161
   14   HD11  ILE   2          HD11      ILE   2  -4.214   1.478   2.379
   15   HD12  ILE   2          HD12      ILE   2  -3.208   0.033   2.396
   16   HD13  ILE   2          HD13      ILE   2  -2.708   1.464   3.295
   17    H    VAL   3           H        VAL   3  -6.387   3.399   2.350
   18    HA   VAL   3           HA       VAL   3  -3.581   4.398   2.380
   19    HB   VAL   3           HB       VAL   3  -3.900   4.876   0.020
   20   HG11  VAL   3          HG11      VAL   3  -3.327   2.574   0.520
   21   HG12  VAL   3          HG12      VAL   3  -4.506   2.578  -0.790
   22   HG13  VAL   3          HG13      VAL   3  -5.015   2.184   0.851
   23   HG21  VAL   3          HG21      VAL   3  -6.747   3.893   0.356
   24   HG22  VAL   3          HG22      VAL   3  -6.022   4.597  -1.090
   25   HG23  VAL   3          HG23      VAL   3  -6.311   5.602   0.331
   26    H    GLU   4           H        GLU   4  -6.445   5.400   3.552
   27    HA   GLU   4           HA       GLU   4  -7.145   7.883   2.617
   28    HB2  GLU   4           HB2      GLU   4  -7.489   8.569   5.022
   29    HB3  GLU   4           HB1      GLU   4  -8.191   7.003   4.612
   30    HG2  GLU   4           HG2      GLU   4  -5.901   6.036   5.401
   31    HG3  GLU   4           HG1      GLU   4  -5.708   7.594   6.207
   32    H    GLN   5           H        GLN   5  -4.110   7.038   4.159
   33    HA   GLN   5           HA       GLN   5  -3.274   9.895   3.989
   34    HB2  GLN   5           HB2      GLN   5  -1.211   8.723   5.294
   35    HB3  GLN   5           HB1      GLN   5  -2.628   9.363   6.123
   36    HG2  GLN   5           HG2      GLN   5  -3.685   7.100   5.969
   37    HG3  GLN   5           HG1      GLN   5  -2.185   6.485   5.274
   38   HE21  GLN   5          HE21      GLN   5  -0.472   8.226   7.002
   39   HE22  GLN   5          HE22      GLN   5  -0.547   7.547   8.557
   40    H    CYS   6           H        CYS   6  -1.815   6.651   3.450
   41    HA   CYS   6           HA       CYS   6   0.400   7.436   1.957
   42    HB2  CYS   6           HB2      CYS   6  -1.352   5.064   1.267
   43    HB3  CYS   6           HB1      CYS   6   0.373   5.239   0.946
   44    H    CYS   7           H        CYS   7  -2.966   7.194   0.898
   45    HA   CYS   7           HA       CYS   7  -2.311   7.769  -1.887
   46    HB2  CYS   7           HB2      CYS   7  -4.718   7.138  -0.333
   47    HB3  CYS   7           HB1      CYS   7  -4.989   8.316  -1.613
   48    H    THR   8           H        THR   8  -1.950   9.697   0.672
   49    HA   THR   8           HA       THR   8  -3.098  12.092  -0.704
   50    HB   THR   8           HB       THR   8  -3.130  13.194   1.455
   51    HG1  THR   8           HG1      THR   8  -2.253  10.870   2.731
   52   HG21  THR   8          HG21      THR   8  -5.058  11.794   1.009
   53   HG22  THR   8          HG22      THR   8  -4.637  11.639   2.714
   54   HG23  THR   8          HG23      THR   8  -4.199  10.363   1.578
   55    H    SER   9           H        SER   9  -0.496  11.743   1.713
   56    HA   SER   9           HA       SER   9   1.198  13.459  -0.023
   57    HB2  SER   9           HB2      SER   9   2.669  13.423   2.120
   58    HB3  SER   9           HB1      SER   9   1.158  14.326   2.164
   59    HG   SER   9           HG       SER   9   0.694  13.078   3.786
   60    H    ILE  10           H        ILE  10   2.680  11.303   2.287
   61    HA   ILE  10           HA       ILE  10   3.502   9.454   0.111
   62    HB   ILE  10           HB       ILE  10   5.573  10.553   2.001
   63   HG12  ILE  10          HG12      ILE  10   4.447  12.461   0.802
   64   HG13  ILE  10          HG11      ILE  10   6.150  12.267   0.383
   65   HG21  ILE  10          HG21      ILE  10   6.724  10.065  -0.442
   66   HG22  ILE  10          HG22      ILE  10   5.448   8.849  -0.403
   67   HG23  ILE  10          HG23      ILE  10   6.658   8.900   0.880
   68   HD11  ILE  10          HD11      ILE  10   4.033  12.377  -1.421
   69   HD12  ILE  10          HD12      ILE  10   4.409  10.656  -1.320
   70   HD13  ILE  10          HD13      ILE  10   5.665  11.809  -1.774
   71    H    CYS  11           H        CYS  11   4.321   7.422   0.927
   72    HA   CYS  11           HA       CYS  11   3.895   6.969   3.845
   73    HB2  CYS  11           HB2      CYS  11   2.340   5.887   1.635
   74    HB3  CYS  11           HB1      CYS  11   3.096   4.600   2.574
   75    H    SER  12           H        SER  12   4.989   4.915   4.567
   76    HA   SER  12           HA       SER  12   7.549   4.632   3.114
   77    HB2  SER  12           HB2      SER  12   7.732   2.956   5.270
   78    HB3  SER  12           HB1      SER  12   8.215   4.649   5.279
   79    HG   SER  12           HG       SER  12   5.589   3.746   5.847
   80    H    LEU  13           H        LEU  13   8.329   2.585   2.387
   81    HA   LEU  13           HA       LEU  13   6.300   0.872   1.274
   82    HB2  LEU  13           HB2      LEU  13   8.413   1.123   0.125
   83    HB3  LEU  13           HB1      LEU  13   9.301   0.572   1.543
   84    HG   LEU  13           HG       LEU  13   7.230  -1.197   0.270
   85   HD11  LEU  13          HD11      LEU  13   8.486  -1.085  -1.634
   86   HD12  LEU  13          HD12      LEU  13   9.587  -2.131  -0.738
   87   HD13  LEU  13          HD13      LEU  13   9.873  -0.392  -0.794
   88   HD21  LEU  13          HD21      LEU  13   9.237  -1.360   2.374
   89   HD22  LEU  13          HD22      LEU  13   9.481  -2.619   1.162
   90   HD23  LEU  13          HD23      LEU  13   7.931  -2.483   1.993
   91    H    TYR  14           H        TYR  14   8.515   0.539   3.996
   92    HA   TYR  14           HA       TYR  14   7.797  -2.151   4.642
   93    HB2  TYR  14           HB2      TYR  14   8.447  -1.134   7.095
   94    HB3  TYR  14           HB1      TYR  14   9.617  -1.743   5.931
   95    HD1  TYR  14           HD2      TYR  14  10.927  -0.219   4.535
   96    HD2  TYR  14           HD1      TYR  14   8.151   1.265   7.461
   97    HE1  TYR  14           HE2      TYR  14  11.952   2.032   4.361
   98    HE2  TYR  14           HE1      TYR  14   9.177   3.519   7.287
   99    HH   TYR  14           HH       TYR  14  10.749   4.654   5.020
  100    H    GLN  15           H        GLN  15   6.302   0.912   5.400
  101    HA   GLN  15           HA       GLN  15   4.491  -0.229   7.348
  102    HB2  GLN  15           HB2      GLN  15   3.727   1.923   7.616
  103    HB3  GLN  15           HB1      GLN  15   5.274   2.275   6.878
  104    HG2  GLN  15           HG2      GLN  15   4.316   2.861   4.841
  105    HG3  GLN  15           HG1      GLN  15   2.874   1.891   5.107
  106   HE21  GLN  15          HE21      GLN  15   1.263   2.739   6.686
  107   HE22  GLN  15          HE22      GLN  15   1.203   4.404   7.009
  108    H    LEU  16           H        LEU  16   4.621   0.049   3.903
  109    HA   LEU  16           HA       LEU  16   1.832  -0.288   3.325
  110    HB2  LEU  16           HB2      LEU  16   4.410  -0.609   1.859
  111    HB3  LEU  16           HB1      LEU  16   3.010  -1.448   1.198
  112    HG   LEU  16           HG       LEU  16   3.450   0.936   0.362
  113   HD11  LEU  16          HD11      LEU  16   0.964  -0.368   1.202
  114   HD12  LEU  16          HD12      LEU  16   1.355   0.423  -0.326
  115   HD13  LEU  16          HD13      LEU  16   0.808   1.381   1.049
  116   HD21  LEU  16          HD21      LEU  16   3.356   2.686   1.782
  117   HD22  LEU  16          HD22      LEU  16   3.507   1.502   3.073
  118   HD23  LEU  16          HD23      LEU  16   1.914   2.059   2.579
  119    H    GLU  17           H        GLU  17   4.453  -2.496   4.099
  120    HA   GLU  17           HA       GLU  17   3.309  -4.947   3.332
  121    HB2  GLU  17           HB2      GLU  17   5.450  -5.250   4.148
  122    HB3  GLU  17           HB1      GLU  17   5.238  -4.065   5.434
  123    HG2  GLU  17           HG2      GLU  17   4.254  -5.593   6.871
  124    HG3  GLU  17           HG1      GLU  17   3.648  -6.598   5.556
  125    H    ASN  18           H        ASN  18   2.334  -2.717   5.771
  126    HA   ASN  18           HA       ASN  18   0.951  -4.463   7.551
  127    HB2  ASN  18           HB2      ASN  18   1.402  -1.756   7.431
  128    HB3  ASN  18           HB1      ASN  18  -0.325  -1.851   7.081
  129   HD21  ASN  18          HD21      ASN  18   1.709  -1.453   9.641
  130   HD22  ASN  18          HD22      ASN  18   0.793  -2.189  10.866
  131    H    TYR  19           H        TYR  19   0.181  -3.396   4.351
  132    HA   TYR  19           HA       TYR  19  -2.613  -4.379   4.671
  133    HB2  TYR  19           HB2      TYR  19  -1.752  -3.123   2.115
  134    HB3  TYR  19           HB1      TYR  19  -3.258  -2.938   3.008
  135    HD1  TYR  19           HD2      TYR  19  -2.306  -2.184   5.692
  136    HD2  TYR  19           HD1      TYR  19  -0.933  -0.927   1.818
  137    HE1  TYR  19           HE2      TYR  19  -1.468  -0.067   6.676
  138    HE2  TYR  19           HE1      TYR  19  -0.095   1.190   2.803
  139    HH   TYR  19           HH       TYR  19   0.605   2.054   4.978
  140    H    CYS  20           H        CYS  20   0.015  -5.962   4.251
  141    HA   CYS  20           HA       CYS  20   0.038  -7.098   1.654
  142    HB2  CYS  20           HB2      CYS  20   0.724  -8.294   4.346
  143    HB3  CYS  20           HB1      CYS  20   0.987  -9.147   2.827
  144    H    ASN  21           H        ASN  21  -2.279  -7.360   4.169
  145    HA   ASN  21           HA       ASN  21  -3.393  -9.917   3.284
  146    HB2  ASN  21           HB2      ASN  21  -4.390  -7.784   5.186
  147    HB3  ASN  21           HB1      ASN  21  -5.269  -9.277   4.856
  148   HD21  ASN  21          HD21      ASN  21  -4.806 -10.922   6.317
  149   HD22  ASN  21          HD22      ASN  21  -3.347 -11.094   7.166
  150    H1   PHE   1           HT1      PHE   1  11.242   0.437  -4.353
  151    H2   PHE   1           HT2      PHE   1  10.952   1.032  -5.918
  152    H3   PHE   1           HT3      PHE   1  10.136  -0.352  -5.367
  153    HA   PHE   1           HA       PHE   1   8.846   1.820  -5.385
  154    HB2  PHE   1           HB2      PHE   1   8.184  -0.281  -4.183
  155    HB3  PHE   1           HB1      PHE   1   9.077   0.293  -2.775
  156    HD1  PHE   1           HD1      PHE   1   7.125   2.425  -5.119
  157    HD2  PHE   1           HD2      PHE   1   7.264   0.583  -1.239
  158    HE1  PHE   1           HE1      PHE   1   5.162   3.763  -4.414
  159    HE2  PHE   1           HE2      PHE   1   5.300   1.923  -0.533
  160    HZ   PHE   1           HZ       PHE   1   4.249   3.514  -2.120
  161    H    VAL   2           H        VAL   2   9.264   3.937  -5.011
  162    HA   VAL   2           HA       VAL   2  11.099   4.636  -2.762
  163    HB   VAL   2           HB       VAL   2  11.052   6.922  -4.059
  164   HG11  VAL   2          HG11      VAL   2  12.570   5.317  -5.832
  165   HG12  VAL   2          HG12      VAL   2  12.625   4.513  -4.263
  166   HG13  VAL   2          HG13      VAL   2  13.151   6.190  -4.414
  167   HG21  VAL   2          HG21      VAL   2  10.484   6.802  -6.358
  168   HG22  VAL   2          HG22      VAL   2   9.160   5.973  -5.540
  169   HG23  VAL   2          HG23      VAL   2  10.427   5.040  -6.337
  170    H    ASN   3           H        ASN   3  10.455   7.186  -2.203
  171    HA   ASN   3           HA       ASN   3   7.786   6.914  -0.983
  172    HB2  ASN   3           HB2      ASN   3   8.387   9.048   0.159
  173    HB3  ASN   3           HB1      ASN   3   9.603   7.793   0.402
  174   HD21  ASN   3          HD21      ASN   3   8.966  10.892  -1.157
  175   HD22  ASN   3          HD22      ASN   3  10.556  11.162  -1.686
  176    H    GLN   4           H        GLN   4   6.130   7.386  -2.373
  177    HA   GLN   4           HA       GLN   4   5.953  10.086  -3.467
  178    HB2  GLN   4           HB2      GLN   4   5.416   8.998  -5.804
  179    HB3  GLN   4           HB1      GLN   4   7.092   9.314  -5.357
  180    HG2  GLN   4           HG2      GLN   4   7.270   6.974  -4.510
  181    HG3  GLN   4           HG1      GLN   4   5.630   6.672  -5.088
  182   HE21  GLN   4          HE21      GLN   4   6.286   5.140  -6.734
  183   HE22  GLN   4          HE22      GLN   4   7.163   5.616  -8.108
  184    H    HIS   5           H        HIS   5   3.770  10.375  -4.522
  185    HA   HIS   5           HA       HIS   5   1.718   9.167  -2.904
  186    HB2  HIS   5           HB2      HIS   5   1.229  10.565  -5.535
  187    HB3  HIS   5           HB1      HIS   5   0.186  10.515  -4.114
  188    HD2  HIS   5           HD2      HIS   5   3.472  12.333  -5.308
  189    HE1  HIS   5           HE1      HIS   5   2.084  14.195  -1.775
  190    HE2  HIS   5           HE2      HIS   5   3.797  14.321  -3.662
  191    H    LEU   6           H        LEU   6   0.370   7.436  -3.362
  192    HA   LEU   6           HA       LEU   6   0.397   6.275  -6.066
  193    HB2  LEU   6           HB2      LEU   6   0.973   4.018  -5.245
  194    HB3  LEU   6           HB1      LEU   6   2.292   5.154  -5.013
  195    HG   LEU   6           HG       LEU   6   2.080   3.774  -3.035
  196   HD11  LEU   6          HD11      LEU   6   2.270   6.445  -2.940
  197   HD12  LEU   6          HD12      LEU   6   2.268   5.445  -1.490
  198   HD13  LEU   6          HD13      LEU   6   0.785   6.242  -2.010
  199   HD21  LEU   6          HD21      LEU   6   0.132   3.125  -2.102
  200   HD22  LEU   6          HD22      LEU   6  -0.607   3.695  -3.595
  201   HD23  LEU   6          HD23      LEU   6  -0.554   4.746  -2.179
  202    H    CYS   7           H        CYS   7  -1.417   4.952  -6.479
  203    HA   CYS   7           HA       CYS   7  -3.319   4.352  -4.324
  204    HB2  CYS   7           HB2      CYS   7  -3.960   6.380  -6.484
  205    HB3  CYS   7           HB1      CYS   7  -5.181   5.605  -5.478
  206    H    GLY   8           H        GLY   8  -5.424   3.457  -5.455
  207    HA2  GLY   8           HA2      GLY   8  -6.181   1.557  -6.628
  208    HA3  GLY   8           HA1      GLY   8  -5.707   2.540  -8.009
  209    H    SER   9           H        SER   9  -4.697   1.182  -9.379
  210    HA   SER   9           HA       SER   9  -3.366  -1.209  -8.771
  211    HB2  SER   9           HB2      SER   9  -3.856  -0.906 -11.045
  212    HB3  SER   9           HB1      SER   9  -3.172   0.717 -11.071
  213    HG   SER   9           HG       SER   9  -1.921  -1.779 -11.194
  214    H    ASP  10           H        ASP  10  -2.245   2.055  -8.457
  215    HA   ASP  10           HA       ASP  10   0.577   1.340  -8.366
  216    HB2  ASP  10           HB2      ASP  10  -1.032   3.797  -7.966
  217    HB3  ASP  10           HB1      ASP  10   0.466   3.714  -7.038
  218    H    LEU  11           H        LEU  11  -2.061   1.396  -6.122
  219    HA   LEU  11           HA       LEU  11  -0.490   1.428  -3.704
  220    HB2  LEU  11           HB2      LEU  11  -3.284   0.594  -4.421
  221    HB3  LEU  11           HB1      LEU  11  -2.620   0.080  -2.872
  222    HG   LEU  11           HG       LEU  11  -2.310   2.946  -3.657
  223   HD11  LEU  11          HD11      LEU  11  -4.697   2.348  -4.125
  224   HD12  LEU  11          HD12      LEU  11  -4.523   3.494  -2.796
  225   HD13  LEU  11          HD13      LEU  11  -4.847   1.793  -2.458
  226   HD21  LEU  11          HD21      LEU  11  -2.881   1.513  -1.043
  227   HD22  LEU  11          HD22      LEU  11  -2.522   3.231  -1.217
  228   HD23  LEU  11          HD23      LEU  11  -1.288   2.029  -1.594
  229    H    VAL  12           H        VAL  12  -1.463  -1.046  -5.986
  230    HA   VAL  12           HA       VAL  12  -0.414  -3.183  -4.279
  231    HB   VAL  12           HB       VAL  12  -0.665  -4.587  -6.382
  232   HG11  VAL  12          HG11      VAL  12  -2.923  -4.956  -5.901
  233   HG12  VAL  12          HG12      VAL  12  -3.242  -3.244  -5.619
  234   HG13  VAL  12          HG13      VAL  12  -2.336  -4.180  -4.431
  235   HG21  VAL  12          HG21      VAL  12  -2.027  -3.657  -8.179
  236   HG22  VAL  12          HG22      VAL  12  -0.567  -2.690  -7.973
  237   HG23  VAL  12          HG23      VAL  12  -2.109  -2.106  -7.346
  238    H    GLU  13           H        GLU  13   0.647  -1.467  -7.248
  239    HA   GLU  13           HA       GLU  13   2.971  -2.869  -7.825
  240    HB2  GLU  13           HB2      GLU  13   2.551  -0.956  -9.171
  241    HB3  GLU  13           HB1      GLU  13   2.436   0.104  -7.768
  242    HG2  GLU  13           HG2      GLU  13   4.673   0.440  -7.704
  243    HG3  GLU  13           HG1      GLU  13   5.017  -1.273  -7.950
  244    H    ALA  14           H        ALA  14   2.262  -0.755  -5.181
  245    HA   ALA  14           HA       ALA  14   4.915  -0.789  -3.994
  246    HB1  ALA  14           HB1      ALA  14   2.377  -0.169  -2.506
  247    HB2  ALA  14           HB2      ALA  14   2.955   0.945  -3.745
  248    HB3  ALA  14           HB3      ALA  14   3.964   0.585  -2.344
  249    H    LEU  15           H        LEU  15   1.784  -2.114  -2.998
  250    HA   LEU  15           HA       LEU  15   2.943  -3.881  -1.013
  251    HB2  LEU  15           HB2      LEU  15   0.220  -3.480  -2.219
  252    HB3  LEU  15           HB1      LEU  15   0.528  -4.879  -1.191
  253    HG   LEU  15           HG       LEU  15   1.582  -2.397  -0.054
  254   HD11  LEU  15          HD11      LEU  15  -0.259  -1.072  -0.033
  255   HD12  LEU  15          HD12      LEU  15  -1.342  -2.436   0.237
  256   HD13  LEU  15          HD13      LEU  15  -0.807  -2.045  -1.397
  257   HD21  LEU  15          HD21      LEU  15   1.428  -4.301   1.351
  258   HD22  LEU  15          HD22      LEU  15  -0.206  -4.676   0.804
  259   HD23  LEU  15          HD23      LEU  15   0.076  -3.287   1.853
  260    H    TYR  16           H        TYR  16   3.075  -4.063  -4.278
  261    HA   TYR  16           HA       TYR  16   2.472  -6.921  -4.578
  262    HB2  TYR  16           HB2      TYR  16   1.842  -5.911  -6.542
  263    HB3  TYR  16           HB1      TYR  16   3.012  -4.611  -6.369
  264    HD1  TYR  16           HD1      TYR  16   2.867  -8.295  -7.023
  265    HD2  TYR  16           HD2      TYR  16   4.882  -4.568  -7.729
  266    HE1  TYR  16           HE1      TYR  16   4.391  -9.424  -8.629
  267    HE2  TYR  16           HE2      TYR  16   6.407  -5.692  -9.335
  268    HH   TYR  16           HH       TYR  16   5.916  -9.065 -10.278
  269    H    LEU  17           H        LEU  17   5.314  -4.774  -4.664
  270    HA   LEU  17           HA       LEU  17   7.026  -7.187  -4.863
  271    HB2  LEU  17           HB2      LEU  17   8.780  -5.087  -4.720
  272    HB3  LEU  17           HB1      LEU  17   8.165  -5.798  -6.201
  273    HG   LEU  17           HG       LEU  17   6.249  -4.155  -6.094
  274   HD11  LEU  17          HD11      LEU  17   7.599  -2.181  -4.524
  275   HD12  LEU  17          HD12      LEU  17   7.436  -3.644  -3.552
  276   HD13  LEU  17          HD13      LEU  17   6.006  -2.888  -4.255
  277   HD21  LEU  17          HD21      LEU  17   7.579  -3.185  -7.630
  278   HD22  LEU  17          HD22      LEU  17   9.030  -3.723  -6.786
  279   HD23  LEU  17          HD23      LEU  17   8.258  -2.204  -6.330
  280    H    VAL  18           H        VAL  18   5.612  -5.403  -2.461
  281    HA   VAL  18           HA       VAL  18   7.874  -5.795  -0.578
  282    HB   VAL  18           HB       VAL  18   6.779  -4.358   0.928
  283   HG11  VAL  18          HG11      VAL  18   5.764  -2.531  -0.733
  284   HG12  VAL  18          HG12      VAL  18   6.543  -3.566  -1.929
  285   HG13  VAL  18          HG13      VAL  18   7.496  -2.842  -0.641
  286   HG21  VAL  18          HG21      VAL  18   4.372  -3.621   0.462
  287   HG22  VAL  18          HG22      VAL  18   4.597  -5.263   1.068
  288   HG23  VAL  18          HG23      VAL  18   4.297  -4.987  -0.646
  289    H    CYS  19           H        CYS  19   4.517  -6.710  -1.085
  290    HA   CYS  19           HA       CYS  19   4.656  -8.678   1.118
  291    HB2  CYS  19           HB2      CYS  19   2.375  -8.115  -0.805
  292    HB3  CYS  19           HB1      CYS  19   2.286  -9.048   0.689
  293    H    GLY  20           H        GLY  20   3.279  -9.024  -2.159
  294    HA2  GLY  20           HA2      GLY  20   3.843 -10.582  -3.849
  295    HA3  GLY  20           HA1      GLY  20   5.193 -11.125  -2.854
  296    H    GLU  21           H        GLU  21   2.399 -12.184  -4.160
  297    HA   GLU  21           HA       GLU  21   0.812 -13.841  -3.589
  298    HB2  GLU  21           HB2      GLU  21   3.263 -14.872  -3.854
  299    HB3  GLU  21           HB1      GLU  21   2.995 -15.284  -2.162
  300    HG2  GLU  21           HG2      GLU  21   0.633 -16.082  -3.100
  301    HG3  GLU  21           HG1      GLU  21   1.551 -16.242  -4.599
  302    H    ARG  22           H        ARG  22   1.200 -11.710  -1.531
  303    HA   ARG  22           HA       ARG  22   0.640 -13.282   0.943
  304    HB2  ARG  22           HB2      ARG  22   2.118 -10.880   0.425
  305    HB3  ARG  22           HB1      ARG  22   0.768 -10.492   1.493
  306    HG2  ARG  22           HG2      ARG  22   2.894 -12.607   1.923
  307    HG3  ARG  22           HG1      ARG  22   2.621 -11.156   2.888
  308    HD2  ARG  22           HD2      ARG  22   1.089 -12.219   4.146
  309    HD3  ARG  22           HD1      ARG  22   0.178 -12.684   2.710
  310    HE   ARG  22           HE       ARG  22   2.290 -14.465   2.732
  311   HH11  ARG  22          HH21      ARG  22  -0.734 -14.106   4.115
  312   HH12  ARG  22          HH22      ARG  22  -0.521 -15.316   5.335
  313   HH21  ARG  22          HH11      ARG  22   2.859 -15.750   4.694
  314   HH22  ARG  22          HH12      ARG  22   1.512 -16.246   5.664
  315    H    GLY  23           H        GLY  23  -1.151 -12.387  -1.483
  316    HA2  GLY  23           HA2      GLY  23  -3.447 -11.924  -1.685
  317    HA3  GLY  23           HA1      GLY  23  -3.562 -12.070   0.070
  318    H    ALA  24           H        ALA  24  -2.535  -9.822  -2.497
  319    HA   ALA  24           HA       ALA  24  -2.734  -7.560  -0.597
  320    HB1  ALA  24           HB1      ALA  24  -2.077  -6.273  -2.761
  321    HB2  ALA  24           HB2      ALA  24  -1.744  -7.873  -3.424
  322    HB3  ALA  24           HB3      ALA  24  -0.865  -7.307  -2.003
  323    H    PHE  25           H        PHE  25  -5.184  -8.823  -1.019
  324    HA   PHE  25           HA       PHE  25  -6.607  -7.060  -2.941
  325    HB2  PHE  25           HB2      PHE  25  -8.531  -8.686  -2.477
  326    HB3  PHE  25           HB1      PHE  25  -7.144  -9.346  -3.344
  327    HD1  PHE  25           HD1      PHE  25  -8.928  -9.247  -0.117
  328    HD2  PHE  25           HD2      PHE  25  -5.614 -10.917  -2.284
  329    HE1  PHE  25           HE1      PHE  25  -8.615 -10.941   1.668
  330    HE2  PHE  25           HE2      PHE  25  -5.301 -12.611  -0.498
  331    HZ   PHE  25           HZ       PHE  25  -6.802 -12.623   1.478
  332    H    TYR  26           H        TYR  26  -7.347  -5.225  -1.980
  333    HA   TYR  26           HA       TYR  26  -8.518  -5.481   0.761
  334    HB2  TYR  26           HB2      TYR  26  -7.961  -2.880   0.725
  335    HB3  TYR  26           HB1      TYR  26  -6.736  -4.062   1.182
  336    HD1  TYR  26           HD1      TYR  26  -8.166  -2.803  -2.062
  337    HD2  TYR  26           HD2      TYR  26  -4.646  -3.620   0.265
  338    HE1  TYR  26           HE1      TYR  26  -6.743  -2.066  -3.955
  339    HE2  TYR  26           HE2      TYR  26  -3.224  -2.882  -1.628
  340    HH   TYR  26           HH       TYR  26  -4.623  -1.430  -4.520
  341    H    THR  27           H        THR  27  -9.075  -4.726  -2.501
  342    HA   THR  27           HA       THR  27 -11.501  -3.124  -1.828
  343    HB   THR  27           HB       THR  27  -9.901  -2.197  -3.524
  344    HG1  THR  27           HG1      THR  27 -12.231  -2.906  -4.898
  345   HG21  THR  27          HG21      THR  27  -9.372  -4.564  -4.398
  346   HG22  THR  27          HG22      THR  27  -9.534  -3.280  -5.595
  347   HG23  THR  27          HG23      THR  27 -10.860  -4.413  -5.332
  348    H    LYS  28           H        LYS  28 -13.280  -4.396  -1.582
  349    HA   LYS  28           HA       LYS  28 -13.842  -6.426  -3.669
  350    HB2  LYS  28           HB2      LYS  28 -14.578  -8.009  -1.786
  351    HB3  LYS  28           HB1      LYS  28 -12.840  -7.829  -2.026
  352    HG2  LYS  28           HG2      LYS  28 -12.857  -6.047  -0.243
  353    HG3  LYS  28           HG1      LYS  28 -14.540  -6.465   0.076
  354    HD2  LYS  28           HD2      LYS  28 -12.330  -8.527   0.120
  355    HD3  LYS  28           HD1      LYS  28 -12.800  -7.616   1.557
  356    HE2  LYS  28           HE2      LYS  28 -14.991  -8.528   1.554
  357    HE3  LYS  28           HE1      LYS  28 -14.829  -9.119  -0.101
  358    HZ1  LYS  28           HZ1      LYS  28 -13.567 -10.165   2.358
  359    HZ2  LYS  28           HZ2      LYS  28 -12.938 -10.523   0.820
  360    HZ3  LYS  28           HZ3      LYS  28 -14.521 -10.990   1.225
  361    HA   PRO  29           HA       PRO  29 -17.565  -4.008  -2.662
  362    HB2  PRO  29           HB2      PRO  29 -18.396  -3.860  -5.279
  363    HB3  PRO  29           HB1      PRO  29 -17.261  -2.713  -4.545
  364    HG2  PRO  29           HG2      PRO  29 -16.713  -4.925  -6.469
  365    HG3  PRO  29           HG1      PRO  29 -15.815  -3.422  -6.201
  366    HD2  PRO  29           HD2      PRO  29 -15.086  -5.982  -5.238
  367    HD3  PRO  29           HD1      PRO  29 -14.395  -4.433  -4.713
  368    H    THR  30           H        THR  30 -18.652  -5.780  -1.654
  369    HA   THR  30           HA       THR  30 -20.128  -7.565  -3.547
  370    HB   THR  30           HB       THR  30 -19.824  -9.429  -2.110
  371    HG1  THR  30           HG1      THR  30 -18.480  -7.926  -0.175
  372   HG21  THR  30          HG21      THR  30 -17.153  -8.207  -1.622
  373   HG22  THR  30          HG22      THR  30 -17.701  -8.290  -3.297
  374   HG23  THR  30          HG23      THR  30 -17.564  -9.765  -2.340
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  -8.676   5.966   3.604
    2    H2   GLY   1           HT2      GLY   1  -9.936   6.282   4.699
    3    H3   GLY   1           HT3      GLY   1 -10.269   5.529   3.212
    4    HA2  GLY   1           HA1      GLY   1  -9.496   4.285   5.595
    5    HA3  GLY   1           HA2      GLY   1 -10.083   3.502   4.098
    6    H    ILE   2           H        ILE   2  -7.857   2.591   3.453
    7    HA   ILE   2           HA       ILE   2  -5.856   2.534   5.626
    8    HB   ILE   2           HB       ILE   2  -6.506   0.397   4.631
    9   HG12  ILE   2          HG12      ILE   2  -4.255  -0.410   3.967
   10   HG13  ILE   2          HG11      ILE   2  -3.716   1.261   3.804
   11   HG21  ILE   2          HG21      ILE   2  -7.132   0.530   2.454
   12   HG22  ILE   2          HG22      ILE   2  -5.415   0.325   2.105
   13   HG23  ILE   2          HG23      ILE   2  -6.117   1.942   2.157
   14   HD11  ILE   2          HD11      ILE   2  -3.218   1.271   5.997
   15   HD12  ILE   2          HD12      ILE   2  -3.892  -0.347   6.189
   16   HD13  ILE   2          HD13      ILE   2  -4.934   1.068   6.351
   17    H    VAL   3           H        VAL   3  -6.301   3.888   2.444
   18    HA   VAL   3           HA       VAL   3  -3.432   4.694   2.363
   19    HB   VAL   3           HB       VAL   3  -3.756   5.142   0.029
   20   HG11  VAL   3          HG11      VAL   3  -3.544   2.898  -0.147
   21   HG12  VAL   3          HG12      VAL   3  -5.283   2.884  -0.440
   22   HG13  VAL   3          HG13      VAL   3  -4.660   2.608   1.188
   23   HG21  VAL   3          HG21      VAL   3  -5.836   6.283  -0.037
   24   HG22  VAL   3          HG22      VAL   3  -6.685   4.946   0.739
   25   HG23  VAL   3          HG23      VAL   3  -6.127   4.788  -0.926
   26    H    GLU   4           H        GLU   4  -6.087   5.849   3.751
   27    HA   GLU   4           HA       GLU   4  -6.759   8.362   2.877
   28    HB2  GLU   4           HB2      GLU   4  -6.900   9.056   5.272
   29    HB3  GLU   4           HB1      GLU   4  -7.618   7.472   4.980
   30    HG2  GLU   4           HG2      GLU   4  -6.035   6.385   6.207
   31    HG3  GLU   4           HG1      GLU   4  -4.734   7.425   5.624
   32    H    GLN   5           H        GLN   5  -3.625   7.375   4.104
   33    HA   GLN   5           HA       GLN   5  -2.692  10.198   3.885
   34    HB2  GLN   5           HB2      GLN   5  -0.560   8.881   4.948
   35    HB3  GLN   5           HB1      GLN   5  -1.827   9.631   5.917
   36    HG2  GLN   5           HG2      GLN   5  -2.962   7.560   6.226
   37    HG3  GLN   5           HG1      GLN   5  -2.028   6.772   4.954
   38   HE21  GLN   5          HE21      GLN   5  -0.266   5.568   5.674
   39   HE22  GLN   5          HE22      GLN   5   0.499   5.765   7.177
   40    H    CYS   6           H        CYS   6  -1.201   6.989   3.304
   41    HA   CYS   6           HA       CYS   6   0.821   7.668   1.593
   42    HB2  CYS   6           HB2      CYS   6  -1.071   5.366   1.076
   43    HB3  CYS   6           HB1      CYS   6   0.619   5.475   0.583
   44    H    CYS   7           H        CYS   7  -2.606   7.356   0.653
   45    HA   CYS   7           HA       CYS   7  -2.181   7.848  -2.133
   46    HB2  CYS   7           HB2      CYS   7  -4.468   7.722  -0.295
   47    HB3  CYS   7           HB1      CYS   7  -4.695   8.825  -1.646
   48    H    THR   8           H        THR   8  -2.481  10.002   0.635
   49    HA   THR   8           HA       THR   8  -2.392  12.331  -1.235
   50    HB   THR   8           HB       THR   8  -4.263  12.477   0.283
   51    HG1  THR   8           HG1      THR   8  -3.736  14.479   0.493
   52   HG21  THR   8          HG21      THR   8  -3.479  10.878   1.964
   53   HG22  THR   8          HG22      THR   8  -3.920  12.400   2.739
   54   HG23  THR   8          HG23      THR   8  -2.222  12.005   2.473
   55    H    SER   9           H        SER   9  -0.421  10.461   0.751
   56    HA   SER   9           HA       SER   9   1.677  12.542   0.658
   57    HB2  SER   9           HB2      SER   9   2.098  11.531   3.167
   58    HB3  SER   9           HB1      SER   9   1.300  13.058   2.825
   59    HG   SER   9           HG       SER   9  -0.379  12.176   3.719
   60    H    ILE  10           H        ILE  10   3.594  11.193   2.171
   61    HA   ILE  10           HA       ILE  10   3.898   8.656   0.617
   62    HB   ILE  10           HB       ILE  10   6.350   9.916   1.666
   63   HG12  ILE  10          HG12      ILE  10   4.888  11.896   0.977
   64   HG13  ILE  10          HG11      ILE  10   6.422  11.755   0.119
   65   HG21  ILE  10          HG21      ILE  10   6.762   9.550  -0.956
   66   HG22  ILE  10          HG22      ILE  10   5.369   8.487  -0.759
   67   HG23  ILE  10          HG23      ILE  10   6.828   8.216   0.195
   68   HD11  ILE  10          HD11      ILE  10   3.799  11.796  -0.989
   69   HD12  ILE  10          HD12      ILE  10   4.467  10.188  -1.269
   70   HD13  ILE  10          HD13      ILE  10   5.332  11.615  -1.840
   71    H    CYS  11           H        CYS  11   3.530   7.000   2.032
   72    HA   CYS  11           HA       CYS  11   4.390   7.294   4.858
   73    HB2  CYS  11           HB2      CYS  11   3.116   4.802   3.775
   74    HB3  CYS  11           HB1      CYS  11   2.950   5.536   5.368
   75    H    SER  12           H        SER  12   4.795   4.427   5.214
   76    HA   SER  12           HA       SER  12   7.457   4.197   3.882
   77    HB2  SER  12           HB2      SER  12   7.471   2.343   5.896
   78    HB3  SER  12           HB1      SER  12   8.117   3.973   6.036
   79    HG   SER  12           HG       SER  12   5.399   3.361   6.513
   80    H    LEU  13           H        LEU  13   7.392   2.800   2.191
   81    HA   LEU  13           HA       LEU  13   5.298   1.066   1.550
   82    HB2  LEU  13           HB2      LEU  13   6.782  -0.012  -0.006
   83    HB3  LEU  13           HB1      LEU  13   7.214   1.696   0.038
   84    HG   LEU  13           HG       LEU  13   8.592  -0.399   1.726
   85   HD11  LEU  13          HD11      LEU  13  10.394   0.362  -0.207
   86   HD12  LEU  13          HD12      LEU  13   8.887   0.297  -1.122
   87   HD13  LEU  13          HD13      LEU  13   9.450  -1.128  -0.250
   88   HD21  LEU  13          HD21      LEU  13  10.384   1.529   1.496
   89   HD22  LEU  13          HD22      LEU  13   9.077   1.680   2.671
   90   HD23  LEU  13          HD23      LEU  13   8.972   2.518   1.124
   91    H    TYR  14           H        TYR  14   7.892   0.598   3.820
   92    HA   TYR  14           HA       TYR  14   7.476  -2.271   4.049
   93    HB2  TYR  14           HB2      TYR  14   8.561  -1.645   6.470
   94    HB3  TYR  14           HB1      TYR  14   9.507  -1.969   5.024
   95    HD1  TYR  14           HD2      TYR  14  10.277  -0.029   3.590
   96    HD2  TYR  14           HD1      TYR  14   8.520   0.509   7.476
   97    HE1  TYR  14           HE2      TYR  14  11.216   2.265   3.696
   98    HE2  TYR  14           HE1      TYR  14   9.466   2.800   7.584
   99    HH   TYR  14           HH       TYR  14  10.326   4.544   5.239
  100    H    GLN  15           H        GLN  15   6.119   0.586   5.494
  101    HA   GLN  15           HA       GLN  15   4.641  -0.864   7.533
  102    HB2  GLN  15           HB2      GLN  15   4.052   1.216   8.282
  103    HB3  GLN  15           HB1      GLN  15   5.380   1.721   7.264
  104    HG2  GLN  15           HG2      GLN  15   3.899   2.362   5.496
  105    HG3  GLN  15           HG1      GLN  15   2.526   1.563   6.262
  106   HE21  GLN  15          HE21      GLN  15   1.661   2.568   8.270
  107   HE22  GLN  15          HE22      GLN  15   1.945   4.211   8.585
  108    H    LEU  16           H        LEU  16   4.232  -0.038   4.202
  109    HA   LEU  16           HA       LEU  16   1.369  -0.341   4.065
  110    HB2  LEU  16           HB2      LEU  16   3.616  -0.399   2.062
  111    HB3  LEU  16           HB1      LEU  16   1.993  -0.890   1.575
  112    HG   LEU  16           HG       LEU  16   1.136   1.280   2.483
  113   HD11  LEU  16          HD11      LEU  16   4.081   1.943   2.675
  114   HD12  LEU  16          HD12      LEU  16   3.005   1.682   4.047
  115   HD13  LEU  16          HD13      LEU  16   2.745   3.056   2.974
  116   HD21  LEU  16          HD21      LEU  16   2.987   2.418   0.620
  117   HD22  LEU  16          HD22      LEU  16   1.312   1.945   0.337
  118   HD23  LEU  16          HD23      LEU  16   2.611   0.778   0.091
  119    H    GLU  17           H        GLU  17   4.073  -2.549   4.111
  120    HA   GLU  17           HA       GLU  17   2.928  -4.865   2.987
  121    HB2  GLU  17           HB2      GLU  17   4.467  -6.115   4.346
  122    HB3  GLU  17           HB1      GLU  17   5.270  -4.600   3.938
  123    HG2  GLU  17           HG2      GLU  17   5.662  -4.618   6.210
  124    HG3  GLU  17           HG1      GLU  17   4.097  -3.806   6.200
  125    H    ASN  18           H        ASN  18   2.203  -3.168   5.894
  126    HA   ASN  18           HA       ASN  18   0.896  -5.202   7.398
  127    HB2  ASN  18           HB2      ASN  18   1.481  -2.648   7.918
  128    HB3  ASN  18           HB1      ASN  18  -0.202  -2.426   7.439
  129   HD21  ASN  18          HD21      ASN  18  -1.597  -2.553   9.194
  130   HD22  ASN  18          HD22      ASN  18  -1.362  -3.527  10.564
  131    H    TYR  19           H        TYR  19   0.011  -3.788   4.428
  132    HA   TYR  19           HA       TYR  19  -2.869  -4.373   4.830
  133    HB2  TYR  19           HB2      TYR  19  -1.695  -3.348   2.260
  134    HB3  TYR  19           HB1      TYR  19  -3.305  -3.088   2.921
  135    HD1  TYR  19           HD2      TYR  19  -2.062  -2.560   5.820
  136    HD2  TYR  19           HD1      TYR  19  -1.414  -0.912   1.904
  137    HE1  TYR  19           HE2      TYR  19  -1.298  -0.431   6.841
  138    HE2  TYR  19           HE1      TYR  19  -0.656   1.215   2.925
  139    HH   TYR  19           HH       TYR  19   0.414   1.607   5.776
  140    H    CYS  20           H        CYS  20  -0.211  -6.120   4.042
  141    HA   CYS  20           HA       CYS  20  -0.739  -7.467   1.651
  142    HB2  CYS  20           HB2      CYS  20   0.287  -8.587   4.269
  143    HB3  CYS  20           HB1      CYS  20   0.325  -9.469   2.745
  144    H    ASN  21           H        ASN  21  -2.539  -7.527   4.600
  145    HA   ASN  21           HA       ASN  21  -4.499  -9.350   3.318
  146    HB2  ASN  21           HB2      ASN  21  -2.936  -9.900   5.786
  147    HB3  ASN  21           HB1      ASN  21  -4.660 -10.267   5.858
  148   HD21  ASN  21          HD21      ASN  21  -3.362 -12.546   6.003
  149   HD22  ASN  21          HD22      ASN  21  -3.217 -13.351   4.517
  150    H1   PHE   1           HT1      PHE   1  10.973   1.211  -5.518
  151    H2   PHE   1           HT2      PHE   1   9.744   0.882  -6.642
  152    H3   PHE   1           HT3      PHE   1   9.912  -0.085  -5.256
  153    HA   PHE   1           HA       PHE   1   8.078   1.699  -5.299
  154    HB2  PHE   1           HB2      PHE   1   9.368   0.363  -3.310
  155    HB3  PHE   1           HB1      PHE   1   9.720   2.031  -2.860
  156    HD1  PHE   1           HD2      PHE   1   7.611   3.684  -3.111
  157    HD2  PHE   1           HD1      PHE   1   7.384  -0.568  -2.521
  158    HE1  PHE   1           HE2      PHE   1   5.313   3.929  -2.211
  159    HE2  PHE   1           HE1      PHE   1   5.088  -0.322  -1.622
  160    HZ   PHE   1           HZ       PHE   1   4.049   1.927  -1.469
  161    H    VAL   2           H        VAL   2   7.702   3.936  -4.999
  162    HA   VAL   2           HA       VAL   2  10.137   5.655  -5.271
  163    HB   VAL   2           HB       VAL   2   8.338   7.271  -6.316
  164   HG11  VAL   2          HG11      VAL   2  10.016   5.137  -7.402
  165   HG12  VAL   2          HG12      VAL   2   9.795   6.789  -7.977
  166   HG13  VAL   2          HG13      VAL   2   8.661   5.528  -8.461
  167   HG21  VAL   2          HG21      VAL   2   6.505   5.586  -5.689
  168   HG22  VAL   2          HG22      VAL   2   7.123   4.588  -7.005
  169   HG23  VAL   2          HG23      VAL   2   6.475   6.193  -7.345
  170    H    ASN   3           H        ASN   3   9.254   8.092  -4.699
  171    HA   ASN   3           HA       ASN   3   7.933   7.829  -2.026
  172    HB2  ASN   3           HB2      ASN   3  10.242   9.545  -2.940
  173    HB3  ASN   3           HB1      ASN   3   9.289   9.974  -1.518
  174   HD21  ASN   3          HD21      ASN   3  10.667   9.405   0.204
  175   HD22  ASN   3          HD22      ASN   3  11.351   7.864   0.407
  176    H    GLN   4           H        GLN   4   6.030   8.158  -3.692
  177    HA   GLN   4           HA       GLN   4   5.363  11.038  -3.611
  178    HB2  GLN   4           HB2      GLN   4   4.681  11.093  -5.932
  179    HB3  GLN   4           HB1      GLN   4   6.350  10.530  -5.871
  180    HG2  GLN   4           HG2      GLN   4   5.443   8.162  -5.894
  181    HG3  GLN   4           HG1      GLN   4   3.857   8.854  -6.241
  182   HE21  GLN   4          HE21      GLN   4   3.435   9.528  -8.392
  183   HE22  GLN   4          HE22      GLN   4   4.580   9.452  -9.641
  184    H    HIS   5           H        HIS   5   2.941  11.072  -4.710
  185    HA   HIS   5           HA       HIS   5   1.342   9.454  -2.888
  186    HB2  HIS   5           HB2      HIS   5   0.308  11.106  -5.197
  187    HB3  HIS   5           HB1      HIS   5  -0.531  10.688  -3.704
  188    HD2  HIS   5           HD2      HIS   5   2.597  12.919  -4.728
  189    HE1  HIS   5           HE1      HIS   5   0.910  14.401  -1.144
  190    HE2  HIS   5           HE2      HIS   5   2.700  14.789  -2.920
  191    H    LEU   6           H        LEU   6   0.091   7.649  -3.422
  192    HA   LEU   6           HA       LEU   6  -0.074   6.844  -6.248
  193    HB2  LEU   6           HB2      LEU   6   0.797   4.574  -5.785
  194    HB3  LEU   6           HB1      LEU   6   2.018   5.816  -5.565
  195    HG   LEU   6           HG       LEU   6   2.181   4.202  -3.767
  196   HD11  LEU   6          HD11      LEU   6   0.831   6.394  -2.290
  197   HD12  LEU   6          HD12      LEU   6   2.148   6.858  -3.367
  198   HD13  LEU   6          HD13      LEU   6   2.437   5.704  -2.067
  199   HD21  LEU   6          HD21      LEU   6  -0.392   4.809  -2.496
  200   HD22  LEU   6          HD22      LEU   6   0.436   3.266  -2.690
  201   HD23  LEU   6          HD23      LEU   6  -0.533   3.914  -4.010
  202    H    CYS   7           H        CYS   7  -1.793   5.453  -6.678
  203    HA   CYS   7           HA       CYS   7  -3.406   4.346  -4.484
  204    HB2  CYS   7           HB2      CYS   7  -4.628   6.402  -6.348
  205    HB3  CYS   7           HB1      CYS   7  -5.434   5.567  -5.023
  206    H    GLY   8           H        GLY   8  -5.485   3.341  -5.536
  207    HA2  GLY   8           HA2      GLY   8  -6.351   1.779  -7.047
  208    HA3  GLY   8           HA1      GLY   8  -5.639   2.784  -8.306
  209    H    SER   9           H        SER   9  -4.785   1.193  -9.604
  210    HA   SER   9           HA       SER   9  -3.536  -1.200  -8.792
  211    HB2  SER   9           HB2      SER   9  -3.335   0.511 -11.250
  212    HB3  SER   9           HB1      SER   9  -2.254  -0.866 -11.060
  213    HG   SER   9           HG       SER   9  -4.487  -1.105 -12.080
  214    H    ASP  10           H        ASP  10  -2.405   2.032  -8.550
  215    HA   ASP  10           HA       ASP  10   0.425   1.306  -8.507
  216    HB2  ASP  10           HB2      ASP  10  -1.092   3.830  -7.834
  217    HB3  ASP  10           HB1      ASP  10   0.642   3.687  -7.550
  218    H    LEU  11           H        LEU  11  -2.172   1.595  -6.213
  219    HA   LEU  11           HA       LEU  11  -0.516   1.653  -3.850
  220    HB2  LEU  11           HB2      LEU  11  -3.380   1.215  -4.451
  221    HB3  LEU  11           HB1      LEU  11  -2.785   0.382  -3.017
  222    HG   LEU  11           HG       LEU  11  -2.221   3.306  -3.516
  223   HD11  LEU  11          HD11      LEU  11  -4.505   2.080  -1.940
  224   HD12  LEU  11          HD12      LEU  11  -4.670   2.959  -3.460
  225   HD13  LEU  11          HD13      LEU  11  -4.112   3.797  -2.011
  226   HD21  LEU  11          HD21      LEU  11  -0.822   2.041  -1.877
  227   HD22  LEU  11          HD22      LEU  11  -2.289   1.624  -0.991
  228   HD23  LEU  11          HD23      LEU  11  -1.781   3.308  -1.111
  229    H    VAL  12           H        VAL  12  -1.647  -0.831  -6.020
  230    HA   VAL  12           HA       VAL  12  -0.757  -2.970  -4.224
  231    HB   VAL  12           HB       VAL  12  -1.073  -4.436  -6.272
  232   HG11  VAL  12          HG11      VAL  12  -3.593  -2.933  -5.674
  233   HG12  VAL  12          HG12      VAL  12  -2.767  -3.794  -4.377
  234   HG13  VAL  12          HG13      VAL  12  -3.332  -4.673  -5.798
  235   HG21  VAL  12          HG21      VAL  12  -2.369  -3.487  -8.122
  236   HG22  VAL  12          HG22      VAL  12  -0.828  -2.651  -7.954
  237   HG23  VAL  12          HG23      VAL  12  -2.309  -1.896  -7.366
  238    H    GLU  13           H        GLU  13   0.410  -1.447  -7.261
  239    HA   GLU  13           HA       GLU  13   2.656  -2.990  -7.751
  240    HB2  GLU  13           HB2      GLU  13   3.455  -1.209  -8.988
  241    HB3  GLU  13           HB1      GLU  13   1.813  -0.629  -8.734
  242    HG2  GLU  13           HG2      GLU  13   2.725   0.498  -6.604
  243    HG3  GLU  13           HG1      GLU  13   4.327   0.180  -7.267
  244    H    ALA  14           H        ALA  14   2.016  -0.813  -5.161
  245    HA   ALA  14           HA       ALA  14   4.686  -0.946  -3.981
  246    HB1  ALA  14           HB1      ALA  14   2.032   0.266  -3.239
  247    HB2  ALA  14           HB2      ALA  14   3.568   1.081  -3.535
  248    HB3  ALA  14           HB3      ALA  14   3.327   0.168  -2.044
  249    H    LEU  15           H        LEU  15   1.443  -2.032  -3.068
  250    HA   LEU  15           HA       LEU  15   2.410  -3.742  -0.926
  251    HB2  LEU  15           HB2      LEU  15  -0.260  -3.322  -2.264
  252    HB3  LEU  15           HB1      LEU  15  -0.031  -4.550  -1.018
  253    HG   LEU  15           HG       LEU  15   0.948  -1.776  -0.462
  254   HD11  LEU  15          HD11      LEU  15  -1.751  -2.109   0.502
  255   HD12  LEU  15          HD12      LEU  15  -1.726  -2.274  -1.253
  256   HD13  LEU  15          HD13      LEU  15  -1.088  -0.814  -0.496
  257   HD21  LEU  15          HD21      LEU  15   1.417  -3.291   1.271
  258   HD22  LEU  15          HD22      LEU  15  -0.116  -4.140   1.072
  259   HD23  LEU  15          HD23      LEU  15  -0.084  -2.538   1.809
  260    H    TYR  16           H        TYR  16   2.642  -4.082  -4.161
  261    HA   TYR  16           HA       TYR  16   1.907  -6.930  -4.344
  262    HB2  TYR  16           HB2      TYR  16   1.338  -6.062  -6.384
  263    HB3  TYR  16           HB1      TYR  16   2.446  -4.711  -6.223
  264    HD1  TYR  16           HD1      TYR  16   2.790  -8.443  -6.428
  265    HD2  TYR  16           HD2      TYR  16   4.031  -4.596  -7.878
  266    HE1  TYR  16           HE1      TYR  16   4.408  -9.543  -7.960
  267    HE2  TYR  16           HE2      TYR  16   5.647  -5.691  -9.413
  268    HH   TYR  16           HH       TYR  16   5.751  -8.123 -10.541
  269    H    LEU  17           H        LEU  17   4.781  -4.860  -4.562
  270    HA   LEU  17           HA       LEU  17   6.494  -7.256  -4.740
  271    HB2  LEU  17           HB2      LEU  17   8.240  -5.155  -4.455
  272    HB3  LEU  17           HB1      LEU  17   7.681  -5.812  -5.983
  273    HG   LEU  17           HG       LEU  17   5.748  -4.183  -5.870
  274   HD11  LEU  17          HD11      LEU  17   7.458  -2.943  -3.694
  275   HD12  LEU  17          HD12      LEU  17   5.931  -3.778  -3.416
  276   HD13  LEU  17          HD13      LEU  17   5.960  -2.283  -4.352
  277   HD21  LEU  17          HD21      LEU  17   8.128  -2.455  -5.828
  278   HD22  LEU  17          HD22      LEU  17   6.972  -2.754  -7.126
  279   HD23  LEU  17          HD23      LEU  17   8.289  -3.891  -6.839
  280    H    VAL  18           H        VAL  18   5.118  -5.358  -2.325
  281    HA   VAL  18           HA       VAL  18   7.263  -5.920  -0.367
  282    HB   VAL  18           HB       VAL  18   5.998  -4.627   1.193
  283   HG11  VAL  18          HG11      VAL  18   6.207  -3.617  -1.584
  284   HG12  VAL  18          HG12      VAL  18   6.851  -2.940  -0.089
  285   HG13  VAL  18          HG13      VAL  18   5.157  -2.691  -0.512
  286   HG21  VAL  18          HG21      VAL  18   3.716  -5.015  -0.749
  287   HG22  VAL  18          HG22      VAL  18   3.661  -3.864   0.584
  288   HG23  VAL  18          HG23      VAL  18   3.816  -5.590   0.915
  289    H    CYS  19           H        CYS  19   3.933  -6.813  -1.078
  290    HA   CYS  19           HA       CYS  19   3.882  -8.850   1.039
  291    HB2  CYS  19           HB2      CYS  19   1.903  -8.280  -1.193
  292    HB3  CYS  19           HB1      CYS  19   1.625  -9.352   0.180
  293    H    GLY  20           H        GLY  20   4.230  -8.678  -2.474
  294    HA2  GLY  20           HA2      GLY  20   5.041 -10.271  -3.993
  295    HA3  GLY  20           HA1      GLY  20   5.659 -11.164  -2.602
  296    H    GLU  21           H        GLU  21   4.404 -12.846  -1.727
  297    HA   GLU  21           HA       GLU  21   2.021 -13.592  -3.370
  298    HB2  GLU  21           HB2      GLU  21   4.261 -15.065  -3.034
  299    HB3  GLU  21           HB1      GLU  21   3.333 -15.620  -1.639
  300    HG2  GLU  21           HG2      GLU  21   2.465 -17.072  -3.190
  301    HG3  GLU  21           HG1      GLU  21   1.394 -15.707  -3.510
  302    H    ARG  22           H        ARG  22   2.768 -12.234  -0.468
  303    HA   ARG  22           HA       ARG  22   1.103 -13.745   1.340
  304    HB2  ARG  22           HB2      ARG  22   2.818 -11.503   1.507
  305    HB3  ARG  22           HB1      ARG  22   1.232 -10.948   2.043
  306    HG2  ARG  22           HG2      ARG  22   2.622 -13.440   3.070
  307    HG3  ARG  22           HG1      ARG  22   2.591 -11.889   3.910
  308    HD2  ARG  22           HD2      ARG  22   0.641 -12.516   4.845
  309    HD3  ARG  22           HD1      ARG  22  -0.089 -12.420   3.242
  310    HE   ARG  22           HE       ARG  22   1.182 -14.935   3.404
  311   HH11  ARG  22          HH21      ARG  22  -1.792 -14.316   2.927
  312   HH12  ARG  22          HH22      ARG  22  -2.516 -15.201   4.228
  313   HH21  ARG  22          HH11      ARG  22   0.458 -15.588   5.970
  314   HH22  ARG  22          HH12      ARG  22  -1.242 -15.920   5.952
  315    H    GLY  23           H        GLY  23   0.341 -11.804  -1.312
  316    HA2  GLY  23           HA2      GLY  23  -2.085 -11.816  -1.931
  317    HA3  GLY  23           HA1      GLY  23  -2.427 -11.401  -0.251
  318    H    ALA  24           H        ALA  24  -3.411  -9.774  -2.267
  319    HA   ALA  24           HA       ALA  24  -2.176  -7.225  -1.566
  320    HB1  ALA  24           HB1      ALA  24  -2.297  -7.701  -4.519
  321    HB2  ALA  24           HB2      ALA  24  -0.917  -8.343  -3.628
  322    HB3  ALA  24           HB3      ALA  24  -1.255  -6.613  -3.601
  323    H    PHE  25           H        PHE  25  -4.813  -8.686  -1.538
  324    HA   PHE  25           HA       PHE  25  -6.387  -6.595  -2.963
  325    HB2  PHE  25           HB2      PHE  25  -8.183  -8.400  -3.166
  326    HB3  PHE  25           HB1      PHE  25  -6.762  -8.615  -4.190
  327    HD1  PHE  25           HD2      PHE  25  -5.052 -10.304  -3.644
  328    HD2  PHE  25           HD1      PHE  25  -8.606  -9.859  -1.270
  329    HE1  PHE  25           HE2      PHE  25  -4.616 -12.503  -2.580
  330    HE2  PHE  25           HE1      PHE  25  -8.170 -12.056  -0.205
  331    HZ   PHE  25           HZ       PHE  25  -6.175 -13.378  -0.861
  332    H    TYR  26           H        TYR  26  -7.094  -5.298  -1.316
  333    HA   TYR  26           HA       TYR  26  -8.099  -6.633   1.160
  334    HB2  TYR  26           HB2      TYR  26  -7.779  -4.419   2.236
  335    HB3  TYR  26           HB1      TYR  26  -6.276  -5.039   1.553
  336    HD1  TYR  26           HD1      TYR  26  -9.185  -2.822   0.769
  337    HD2  TYR  26           HD2      TYR  26  -5.071  -3.773  -0.026
  338    HE1  TYR  26           HE1      TYR  26  -8.990  -0.793  -0.645
  339    HE2  TYR  26           HE2      TYR  26  -4.875  -1.744  -1.440
  340    HH   TYR  26           HH       TYR  26  -5.897   0.285  -1.895
  341    H    THR  27           H        THR  27  -9.247  -5.456  -1.675
  342    HA   THR  27           HA       THR  27 -11.463  -3.840  -0.658
  343    HB   THR  27           HB       THR  27 -12.287  -4.174  -3.085
  344    HG1  THR  27           HG1      THR  27 -11.070  -6.016  -3.534
  345   HG21  THR  27          HG21      THR  27 -10.904  -2.419  -3.830
  346   HG22  THR  27          HG22      THR  27  -9.520  -2.997  -2.902
  347   HG23  THR  27          HG23      THR  27 -10.884  -2.243  -2.075
  348    H    LYS  28           H        LYS  28 -13.462  -4.587  -0.076
  349    HA   LYS  28           HA       LYS  28 -14.083  -7.453  -0.666
  350    HB2  LYS  28           HB2      LYS  28 -13.643  -6.313   1.859
  351    HB3  LYS  28           HB1      LYS  28 -15.397  -6.443   1.724
  352    HG2  LYS  28           HG2      LYS  28 -15.305  -8.672   2.005
  353    HG3  LYS  28           HG1      LYS  28 -14.153  -8.831   0.679
  354    HD2  LYS  28           HD2      LYS  28 -12.755  -9.531   2.348
  355    HD3  LYS  28           HD1      LYS  28 -12.527  -7.797   2.585
  356    HE2  LYS  28           HE2      LYS  28 -14.618  -9.459   4.020
  357    HE3  LYS  28           HE1      LYS  28 -13.059  -9.004   4.709
  358    HZ1  LYS  28           HZ1      LYS  28 -15.428  -7.399   4.273
  359    HZ2  LYS  28           HZ2      LYS  28 -13.965  -6.643   3.854
  360    HZ3  LYS  28           HZ3      LYS  28 -14.199  -7.231   5.430
  361    HA   PRO  29           HA       PRO  29 -17.479  -4.940  -2.366
  362    HB2  PRO  29           HB2      PRO  29 -17.826  -6.559  -4.560
  363    HB3  PRO  29           HB1      PRO  29 -16.658  -5.227  -4.502
  364    HG2  PRO  29           HG2      PRO  29 -16.163  -8.164  -4.348
  365    HG3  PRO  29           HG1      PRO  29 -15.090  -6.874  -4.913
  366    HD2  PRO  29           HD2      PRO  29 -14.958  -8.152  -2.391
  367    HD3  PRO  29           HD1      PRO  29 -14.123  -6.651  -2.846
  368    H    THR  30           H        THR  30 -19.628  -6.131  -3.483
  369    HA   THR  30           HA       THR  30 -21.547  -7.379  -2.964
  370    HB   THR  30           HB       THR  30 -21.226  -9.675  -2.765
  371    HG1  THR  30           HG1      THR  30 -20.307 -10.106  -0.918
  372   HG21  THR  30          HG21      THR  30 -19.691  -8.500  -4.545
  373   HG22  THR  30          HG22      THR  30 -19.489 -10.222  -4.217
  374   HG23  THR  30          HG23      THR  30 -18.384  -9.051  -3.497
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1 -10.555   3.227   3.392
    2    H2   GLY   1           HT2      GLY   1 -11.433   3.868   4.697
    3    H3   GLY   1           HT3      GLY   1 -10.324   2.608   4.955
    4    HA2  GLY   1           HA1      GLY   1  -9.047   4.825   3.803
    5    HA3  GLY   1           HA2      GLY   1  -9.866   5.335   5.311
    6    H    ILE   2           H        ILE   2  -8.338   2.341   3.862
    7    HA   ILE   2           HA       ILE   2  -6.073   2.305   5.618
    8    HB   ILE   2           HB       ILE   2  -6.862   0.266   4.523
    9   HG12  ILE   2          HG12      ILE   2  -4.701  -0.575   3.685
   10   HG13  ILE   2          HG11      ILE   2  -4.112   1.081   3.527
   11   HG21  ILE   2          HG21      ILE   2  -5.740   0.979   1.882
   12   HG22  ILE   2          HG22      ILE   2  -7.215   1.841   2.318
   13   HG23  ILE   2          HG23      ILE   2  -7.204   0.078   2.276
   14   HD11  ILE   2          HD11      ILE   2  -4.081  -0.590   5.848
   15   HD12  ILE   2          HD12      ILE   2  -5.149   0.776   6.169
   16   HD13  ILE   2          HD13      ILE   2  -3.478   1.060   5.684
   17    H    VAL   3           H        VAL   3  -6.600   3.669   2.408
   18    HA   VAL   3           HA       VAL   3  -3.756   4.560   2.341
   19    HB   VAL   3           HB       VAL   3  -4.086   4.967  -0.008
   20   HG11  VAL   3          HG11      VAL   3  -4.375   2.464   1.169
   21   HG12  VAL   3          HG12      VAL   3  -4.032   2.775  -0.531
   22   HG13  VAL   3          HG13      VAL   3  -5.694   2.530   0.000
   23   HG21  VAL   3          HG21      VAL   3  -6.890   5.102   0.833
   24   HG22  VAL   3          HG22      VAL   3  -6.662   4.153  -0.636
   25   HG23  VAL   3          HG23      VAL   3  -6.107   5.826  -0.571
   26    H    GLU   4           H        GLU   4  -6.606   5.665   3.518
   27    HA   GLU   4           HA       GLU   4  -7.222   8.160   2.590
   28    HB2  GLU   4           HB2      GLU   4  -7.628   8.859   4.933
   29    HB3  GLU   4           HB1      GLU   4  -8.216   7.223   4.633
   30    HG2  GLU   4           HG2      GLU   4  -6.992   6.611   6.433
   31    HG3  GLU   4           HG1      GLU   4  -5.581   6.814   5.395
   32    H    GLN   5           H        GLN   5  -4.194   7.248   4.117
   33    HA   GLN   5           HA       GLN   5  -3.296  10.085   3.925
   34    HB2  GLN   5           HB2      GLN   5  -1.250   8.828   5.213
   35    HB3  GLN   5           HB1      GLN   5  -2.611   9.585   6.039
   36    HG2  GLN   5           HG2      GLN   5  -3.812   7.377   5.940
   37    HG3  GLN   5           HG1      GLN   5  -2.334   6.658   5.299
   38   HE21  GLN   5          HE21      GLN   5  -0.708   8.595   7.053
   39   HE22  GLN   5          HE22      GLN   5  -0.779   7.906   8.602
   40    H    CYS   6           H        CYS   6  -1.711   6.886   3.546
   41    HA   CYS   6           HA       CYS   6   0.444   7.608   2.002
   42    HB2  CYS   6           HB2      CYS   6  -1.300   5.214   1.390
   43    HB3  CYS   6           HB1      CYS   6   0.419   5.383   1.043
   44    H    CYS   7           H        CYS   7  -2.903   7.293   0.849
   45    HA   CYS   7           HA       CYS   7  -2.229   7.670  -1.931
   46    HB2  CYS   7           HB2      CYS   7  -4.676   7.483  -0.319
   47    HB3  CYS   7           HB1      CYS   7  -4.816   8.547  -1.713
   48    H    THR   8           H        THR   8  -3.548   9.907   0.540
   49    HA   THR   8           HA       THR   8  -3.173  12.177  -1.291
   50    HB   THR   8           HB       THR   8  -5.109  11.994   0.328
   51    HG1  THR   8           HG1      THR   8  -4.540  13.993  -0.516
   52   HG21  THR   8          HG21      THR   8  -4.670  12.564   2.677
   53   HG22  THR   8          HG22      THR   8  -2.938  12.632   2.345
   54   HG23  THR   8          HG23      THR   8  -3.799  11.098   2.227
   55    H    SER   9           H        SER   9  -1.148  10.444   0.706
   56    HA   SER   9           HA       SER   9   0.759  12.712   0.793
   57    HB2  SER   9           HB2      SER   9   1.264  11.515   3.204
   58    HB3  SER   9           HB1      SER   9   0.327  12.987   2.997
   59    HG   SER   9           HG       SER   9  -0.479  10.660   3.941
   60    H    ILE  10           H        ILE  10   2.791  11.424   2.190
   61    HA   ILE  10           HA       ILE  10   3.528   9.322   0.232
   62    HB   ILE  10           HB       ILE  10   5.380  10.404   2.336
   63   HG12  ILE  10          HG12      ILE  10   4.103  12.318   1.233
   64   HG13  ILE  10          HG11      ILE  10   5.852  12.359   1.020
   65   HG21  ILE  10          HG21      ILE  10   5.526   8.866  -0.129
   66   HG22  ILE  10          HG22      ILE  10   6.758   9.104   1.112
   67   HG23  ILE  10          HG23      ILE  10   6.580  10.279  -0.191
   68   HD11  ILE  10          HD11      ILE  10   4.647  10.771  -1.070
   69   HD12  ILE  10          HD12      ILE  10   5.635  12.225  -1.217
   70   HD13  ILE  10          HD13      ILE  10   3.888  12.361  -1.009
   71    H    CYS  11           H        CYS  11   4.787   7.414   1.173
   72    HA   CYS  11           HA       CYS  11   4.215   6.735   3.966
   73    HB2  CYS  11           HB2      CYS  11   2.567   5.721   1.726
   74    HB3  CYS  11           HB1      CYS  11   3.139   4.494   2.856
   75    H    SER  12           H        SER  12   4.953   4.341   4.333
   76    HA   SER  12           HA       SER  12   7.463   3.948   2.761
   77    HB2  SER  12           HB2      SER  12   7.697   2.336   4.949
   78    HB3  SER  12           HB1      SER  12   8.304   3.987   4.868
   79    HG   SER  12           HG       SER  12   6.534   4.693   5.934
   80    H    LEU  13           H        LEU  13   7.389   2.260   1.340
   81    HA   LEU  13           HA       LEU  13   5.235   0.503   1.062
   82    HB2  LEU  13           HB2      LEU  13   6.630  -0.893  -0.346
   83    HB3  LEU  13           HB1      LEU  13   7.007   0.791  -0.661
   84    HG   LEU  13           HG       LEU  13   9.075  -0.448  -0.566
   85   HD11  LEU  13          HD11      LEU  13   8.998   1.813   0.517
   86   HD12  LEU  13          HD12      LEU  13  10.272   0.762   1.132
   87   HD13  LEU  13          HD13      LEU  13   8.802   1.004   2.070
   88   HD21  LEU  13          HD21      LEU  13   9.513  -2.143   0.867
   89   HD22  LEU  13          HD22      LEU  13   7.783  -2.101   1.207
   90   HD23  LEU  13          HD23      LEU  13   8.908  -1.244   2.259
   91    H    TYR  14           H        TYR  14   7.742   0.431   3.428
   92    HA   TYR  14           HA       TYR  14   7.362  -2.388   4.064
   93    HB2  TYR  14           HB2      TYR  14   8.722  -1.949   6.064
   94    HB3  TYR  14           HB1      TYR  14   9.495  -1.281   4.632
   95    HD1  TYR  14           HD1      TYR  14   7.027  -0.239   7.280
   96    HD2  TYR  14           HD2      TYR  14  10.332   0.878   4.769
   97    HE1  TYR  14           HE1      TYR  14   7.098   1.990   8.363
   98    HE2  TYR  14           HE2      TYR  14  10.402   3.110   5.852
   99    HH   TYR  14           HH       TYR  14   7.905   4.297   7.775
  100    H    GLN  15           H        GLN  15   6.008   0.660   5.059
  101    HA   GLN  15           HA       GLN  15   4.493  -0.479   7.267
  102    HB2  GLN  15           HB2      GLN  15   3.891   1.694   7.699
  103    HB3  GLN  15           HB1      GLN  15   5.287   2.030   6.691
  104    HG2  GLN  15           HG2      GLN  15   3.855   2.306   4.731
  105    HG3  GLN  15           HG1      GLN  15   2.433   1.861   5.676
  106   HE21  GLN  15          HE21      GLN  15   1.314   3.593   6.592
  107   HE22  GLN  15          HE22      GLN  15   1.962   5.139   6.857
  108    H    LEU  16           H        LEU  16   4.187  -0.182   3.859
  109    HA   LEU  16           HA       LEU  16   1.297  -0.429   3.714
  110    HB2  LEU  16           HB2      LEU  16   3.581  -0.681   1.767
  111    HB3  LEU  16           HB1      LEU  16   1.975  -1.236   1.303
  112    HG   LEU  16           HG       LEU  16   2.660   1.220   0.761
  113   HD11  LEU  16          HD11      LEU  16   0.128   0.079   1.779
  114   HD12  LEU  16          HD12      LEU  16   0.459   0.913   0.262
  115   HD13  LEU  16          HD13      LEU  16   0.198   1.841   1.738
  116   HD21  LEU  16          HD21      LEU  16   3.496   1.847   2.955
  117   HD22  LEU  16          HD22      LEU  16   1.967   1.398   3.709
  118   HD23  LEU  16          HD23      LEU  16   2.040   2.784   2.621
  119    H    GLU  17           H        GLU  17   3.983  -2.613   4.077
  120    HA   GLU  17           HA       GLU  17   2.884  -5.032   3.133
  121    HB2  GLU  17           HB2      GLU  17   4.408  -6.137   4.605
  122    HB3  GLU  17           HB1      GLU  17   5.198  -4.628   4.148
  123    HG2  GLU  17           HG2      GLU  17   4.112  -3.643   6.275
  124    HG3  GLU  17           HG1      GLU  17   3.843  -5.319   6.751
  125    H    ASN  18           H        ASN  18   2.066  -3.080   5.850
  126    HA   ASN  18           HA       ASN  18   0.734  -4.972   7.504
  127    HB2  ASN  18           HB2      ASN  18   1.223  -2.297   7.669
  128    HB3  ASN  18           HB1      ASN  18  -0.503  -2.290   7.307
  129   HD21  ASN  18          HD21      ASN  18  -1.683  -4.206   8.689
  130   HD22  ASN  18          HD22      ASN  18  -1.283  -4.199  10.338
  131    H    TYR  19           H        TYR  19  -0.092  -3.822   4.397
  132    HA   TYR  19           HA       TYR  19  -2.948  -4.565   4.777
  133    HB2  TYR  19           HB2      TYR  19  -1.815  -3.417   2.237
  134    HB3  TYR  19           HB1      TYR  19  -3.448  -3.276   2.885
  135    HD1  TYR  19           HD2      TYR  19  -2.433  -2.714   5.798
  136    HD2  TYR  19           HD1      TYR  19  -1.530  -0.994   1.965
  137    HE1  TYR  19           HE2      TYR  19  -1.806  -0.585   6.901
  138    HE2  TYR  19           HE1      TYR  19  -0.907   1.138   3.072
  139    HH   TYR  19           HH       TYR  19  -1.777   2.055   5.919
  140    H    CYS  20           H        CYS  20  -1.174  -6.703   4.838
  141    HA   CYS  20           HA       CYS  20  -1.680  -7.986   2.196
  142    HB2  CYS  20           HB2      CYS  20   0.737  -8.035   3.968
  143    HB3  CYS  20           HB1      CYS  20   0.363  -9.459   2.997
  144    H    ASN  21           H        ASN  21  -2.431  -7.971   5.456
  145    HA   ASN  21           HA       ASN  21  -2.905 -10.907   5.561
  146    HB2  ASN  21           HB2      ASN  21  -2.797  -8.717   7.621
  147    HB3  ASN  21           HB1      ASN  21  -3.629 -10.229   7.984
  148   HD21  ASN  21          HD21      ASN  21  -0.511  -9.288   6.399
  149   HD22  ASN  21          HD22      ASN  21   0.417 -10.451   7.217
  150    H1   PHE   1           HT1      PHE   1  12.133   1.925  -3.474
  151    H2   PHE   1           HT2      PHE   1  11.002   0.687  -3.742
  152    H3   PHE   1           HT3      PHE   1  11.476   1.080  -2.159
  153    HA   PHE   1           HA       PHE   1   9.590   2.425  -3.928
  154    HB2  PHE   1           HB2      PHE   1   9.435   1.097  -1.534
  155    HB3  PHE   1           HB1      PHE   1   9.522   2.775  -1.001
  156    HD1  PHE   1           HD1      PHE   1   7.918   0.994  -3.901
  157    HD2  PHE   1           HD2      PHE   1   7.423   3.690  -0.590
  158    HE1  PHE   1           HE1      PHE   1   5.538   1.316  -4.518
  159    HE2  PHE   1           HE2      PHE   1   5.044   4.012  -1.208
  160    HZ   PHE   1           HZ       PHE   1   4.099   2.825  -3.172
  161    H    VAL   2           H        VAL   2   8.941   4.660  -2.719
  162    HA   VAL   2           HA       VAL   2  11.310   6.215  -1.966
  163    HB   VAL   2           HB       VAL   2  10.990   5.987  -4.607
  164   HG11  VAL   2          HG11      VAL   2   9.615   8.595  -4.320
  165   HG12  VAL   2          HG12      VAL   2   8.614   7.163  -4.083
  166   HG13  VAL   2          HG13      VAL   2   9.485   7.388  -5.600
  167   HG21  VAL   2          HG21      VAL   2  12.672   7.461  -4.544
  168   HG22  VAL   2          HG22      VAL   2  12.313   7.702  -2.834
  169   HG23  VAL   2          HG23      VAL   2  11.581   8.755  -4.046
  170    H    ASN   3           H        ASN   3  10.203   8.724  -2.548
  171    HA   ASN   3           HA       ASN   3   7.939   8.735  -0.601
  172    HB2  ASN   3           HB2      ASN   3   8.544  11.074  -0.168
  173    HB3  ASN   3           HB1      ASN   3   9.958  10.039   0.030
  174   HD21  ASN   3          HD21      ASN   3   9.751  12.974  -0.799
  175   HD22  ASN   3          HD22      ASN   3  10.602  13.060  -2.266
  176    H    GLN   4           H        GLN   4   6.195   8.412  -2.039
  177    HA   GLN   4           HA       GLN   4   5.376  10.782  -3.535
  178    HB2  GLN   4           HB2      GLN   4   4.981   9.319  -5.638
  179    HB3  GLN   4           HB1      GLN   4   6.619   9.898  -5.337
  180    HG2  GLN   4           HG2      GLN   4   7.337   7.766  -5.320
  181    HG3  GLN   4           HG1      GLN   4   6.331   7.463  -3.905
  182   HE21  GLN   4          HE21      GLN   4   4.864   5.796  -4.227
  183   HE22  GLN   4          HE22      GLN   4   4.172   5.375  -5.719
  184    H    HIS   5           H        HIS   5   3.132  10.595  -4.232
  185    HA   HIS   5           HA       HIS   5   1.557   8.951  -2.409
  186    HB2  HIS   5           HB2      HIS   5   0.422  10.491  -4.736
  187    HB3  HIS   5           HB1      HIS   5  -0.307  10.175  -3.162
  188    HD2  HIS   5           HD2      HIS   5   2.448  12.532  -4.719
  189    HE1  HIS   5           HE1      HIS   5   1.452  13.939  -0.857
  190    HE2  HIS   5           HE2      HIS   5   2.788  14.433  -2.975
  191    H    LEU   6           H        LEU   6   0.226   7.191  -2.984
  192    HA   LEU   6           HA       LEU   6   0.260   6.295  -5.793
  193    HB2  LEU   6           HB2      LEU   6   0.935   3.984  -5.122
  194    HB3  LEU   6           HB1      LEU   6   2.211   5.172  -4.922
  195    HG   LEU   6           HG       LEU   6   2.148   3.664  -3.007
  196   HD11  LEU   6          HD11      LEU   6   0.970   6.054  -1.730
  197   HD12  LEU   6          HD12      LEU   6   2.310   6.365  -2.837
  198   HD13  LEU   6          HD13      LEU   6   2.532   5.284  -1.463
  199   HD21  LEU   6          HD21      LEU   6  -0.540   3.562  -3.365
  200   HD22  LEU   6          HD22      LEU   6  -0.435   4.651  -1.979
  201   HD23  LEU   6          HD23      LEU   6   0.278   3.042  -1.894
  202    H    CYS   7           H        CYS   7  -1.486   4.899  -6.308
  203    HA   CYS   7           HA       CYS   7  -3.358   4.101  -4.174
  204    HB2  CYS   7           HB2      CYS   7  -4.198   6.042  -6.348
  205    HB3  CYS   7           HB1      CYS   7  -5.259   5.324  -5.137
  206    H    GLY   8           H        GLY   8  -5.443   3.201  -5.387
  207    HA2  GLY   8           HA2      GLY   8  -6.124   1.301  -6.609
  208    HA3  GLY   8           HA1      GLY   8  -5.622   2.311  -7.961
  209    H    SER   9           H        SER   9  -4.572   0.950  -9.307
  210    HA   SER   9           HA       SER   9  -3.169  -1.390  -8.629
  211    HB2  SER   9           HB2      SER   9  -1.879  -0.360 -10.902
  212    HB3  SER   9           HB1      SER   9  -3.233  -1.486 -10.874
  213    HG   SER   9           HG       SER   9  -3.327   1.353 -10.924
  214    H    ASP  10           H        ASP  10  -2.194   1.905  -8.298
  215    HA   ASP  10           HA       ASP  10   0.661   1.320  -8.258
  216    HB2  ASP  10           HB2      ASP  10  -1.044   3.700  -7.828
  217    HB3  ASP  10           HB1      ASP  10   0.445   3.670  -6.886
  218    H    LEU  11           H        LEU  11  -1.944   1.287  -5.954
  219    HA   LEU  11           HA       LEU  11  -0.299   1.300  -3.583
  220    HB2  LEU  11           HB2      LEU  11  -3.106   0.419  -4.207
  221    HB3  LEU  11           HB1      LEU  11  -2.375  -0.054  -2.675
  222    HG   LEU  11           HG       LEU  11  -2.215   2.806  -3.557
  223   HD11  LEU  11          HD11      LEU  11  -4.596   2.178  -3.782
  224   HD12  LEU  11          HD12      LEU  11  -4.352   3.256  -2.408
  225   HD13  LEU  11          HD13      LEU  11  -4.576   1.526  -2.144
  226   HD21  LEU  11          HD21      LEU  11  -1.958   3.210  -1.225
  227   HD22  LEU  11          HD22      LEU  11  -1.012   1.754  -1.538
  228   HD23  LEU  11          HD23      LEU  11  -2.607   1.625  -0.802
  229    H    VAL  12           H        VAL  12  -1.330  -1.131  -5.878
  230    HA   VAL  12           HA       VAL  12  -0.199  -3.297  -4.262
  231    HB   VAL  12           HB       VAL  12  -0.520  -4.664  -6.367
  232   HG11  VAL  12          HG11      VAL  12  -2.579  -5.172  -5.585
  233   HG12  VAL  12          HG12      VAL  12  -3.176  -3.528  -5.819
  234   HG13  VAL  12          HG13      VAL  12  -2.247  -3.933  -4.375
  235   HG21  VAL  12          HG21      VAL  12  -1.942  -2.149  -7.274
  236   HG22  VAL  12          HG22      VAL  12  -1.949  -3.700  -8.112
  237   HG23  VAL  12          HG23      VAL  12  -0.449  -2.788  -7.961
  238    H    GLU  13           H        GLU  13   0.716  -1.518  -7.244
  239    HA   GLU  13           HA       GLU  13   3.042  -2.865  -7.926
  240    HB2  GLU  13           HB2      GLU  13   2.553  -0.965  -9.250
  241    HB3  GLU  13           HB1      GLU  13   2.413   0.085  -7.841
  242    HG2  GLU  13           HG2      GLU  13   4.731   0.233  -7.555
  243    HG3  GLU  13           HG1      GLU  13   5.034  -1.252  -8.456
  244    H    ALA  14           H        ALA  14   2.396  -0.796  -5.233
  245    HA   ALA  14           HA       ALA  14   5.104  -0.816  -4.161
  246    HB1  ALA  14           HB1      ALA  14   4.092   0.373  -2.282
  247    HB2  ALA  14           HB2      ALA  14   2.480  -0.070  -2.841
  248    HB3  ALA  14           HB3      ALA  14   3.465   1.044  -3.787
  249    H    LEU  15           H        LEU  15   2.001  -2.143  -3.079
  250    HA   LEU  15           HA       LEU  15   3.202  -3.880  -1.095
  251    HB2  LEU  15           HB2      LEU  15   0.464  -3.457  -2.235
  252    HB3  LEU  15           HB1      LEU  15   0.776  -4.914  -1.289
  253    HG   LEU  15           HG       LEU  15   1.807  -2.405  -0.111
  254   HD11  LEU  15          HD11      LEU  15  -0.564  -1.982  -1.198
  255   HD12  LEU  15          HD12      LEU  15  -0.235  -1.423   0.442
  256   HD13  LEU  15          HD13      LEU  15  -1.137  -2.916   0.184
  257   HD21  LEU  15          HD21      LEU  15   1.865  -3.848   1.618
  258   HD22  LEU  15          HD22      LEU  15   1.005  -5.060   0.669
  259   HD23  LEU  15          HD23      LEU  15   0.101  -3.876   1.616
  260    H    TYR  16           H        TYR  16   3.270  -4.079  -4.365
  261    HA   TYR  16           HA       TYR  16   2.724  -6.948  -4.643
  262    HB2  TYR  16           HB2      TYR  16   2.022  -5.958  -6.592
  263    HB3  TYR  16           HB1      TYR  16   3.160  -4.628  -6.446
  264    HD1  TYR  16           HD1      TYR  16   3.184  -8.332  -7.021
  265    HD2  TYR  16           HD2      TYR  16   4.908  -4.507  -7.934
  266    HE1  TYR  16           HE1      TYR  16   4.706  -9.410  -8.662
  267    HE2  TYR  16           HE2      TYR  16   6.431  -5.580  -9.576
  268    HH   TYR  16           HH       TYR  16   6.381  -9.115 -10.085
  269    H    LEU  17           H        LEU  17   5.516  -4.740  -4.883
  270    HA   LEU  17           HA       LEU  17   7.284  -7.099  -5.141
  271    HB2  LEU  17           HB2      LEU  17   8.987  -4.955  -4.990
  272    HB3  LEU  17           HB1      LEU  17   8.360  -5.651  -6.474
  273    HG   LEU  17           HG       LEU  17   6.401  -4.063  -6.286
  274   HD11  LEU  17          HD11      LEU  17   6.170  -2.829  -4.423
  275   HD12  LEU  17          HD12      LEU  17   7.745  -2.090  -4.705
  276   HD13  LEU  17          HD13      LEU  17   7.624  -3.574  -3.760
  277   HD21  LEU  17          HD21      LEU  17   7.752  -3.175  -7.871
  278   HD22  LEU  17          HD22      LEU  17   9.206  -3.444  -6.912
  279   HD23  LEU  17          HD23      LEU  17   8.208  -2.020  -6.619
  280    H    VAL  18           H        VAL  18   5.959  -5.256  -2.678
  281    HA   VAL  18           HA       VAL  18   8.250  -5.651  -0.850
  282    HB   VAL  18           HB       VAL  18   7.038  -4.382   0.755
  283   HG11  VAL  18          HG11      VAL  18   7.677  -2.713  -0.686
  284   HG12  VAL  18          HG12      VAL  18   5.931  -2.547  -0.871
  285   HG13  VAL  18          HG13      VAL  18   6.862  -3.453  -2.063
  286   HG21  VAL  18          HG21      VAL  18   4.912  -5.504   0.699
  287   HG22  VAL  18          HG22      VAL  18   4.626  -4.985  -0.961
  288   HG23  VAL  18          HG23      VAL  18   4.609  -3.803   0.347
  289    H    CYS  19           H        CYS  19   4.934  -6.748  -1.305
  290    HA   CYS  19           HA       CYS  19   5.252  -8.789   0.809
  291    HB2  CYS  19           HB2      CYS  19   3.000  -7.572  -0.665
  292    HB3  CYS  19           HB1      CYS  19   2.822  -9.297  -0.348
  293    H    GLY  20           H        GLY  20   3.663  -9.190  -2.344
  294    HA2  GLY  20           HA2      GLY  20   4.388 -10.595  -4.153
  295    HA3  GLY  20           HA1      GLY  20   5.667 -11.227  -3.115
  296    H    GLU  21           H        GLU  21   2.493 -11.756  -4.284
  297    HA   GLU  21           HA       GLU  21   0.890 -13.413  -3.809
  298    HB2  GLU  21           HB2      GLU  21   3.096 -14.638  -4.528
  299    HB3  GLU  21           HB1      GLU  21   3.163 -15.117  -2.834
  300    HG2  GLU  21           HG2      GLU  21   1.204 -16.370  -2.968
  301    HG3  GLU  21           HG1      GLU  21   0.594 -15.455  -4.346
  302    H    ARG  22           H        ARG  22   1.847 -11.601  -1.553
  303    HA   ARG  22           HA       ARG  22   1.459 -13.359   0.800
  304    HB2  ARG  22           HB2      ARG  22   3.181 -11.462   0.705
  305    HB3  ARG  22           HB1      ARG  22   1.812 -10.355   0.809
  306    HG2  ARG  22           HG2      ARG  22   2.241 -10.590   3.059
  307    HG3  ARG  22           HG1      ARG  22   1.162 -11.969   2.845
  308    HD2  ARG  22           HD2      ARG  22   3.210 -13.381   2.385
  309    HD3  ARG  22           HD1      ARG  22   4.190 -11.999   2.876
  310    HE   ARG  22           HE       ARG  22   2.768 -12.188   5.078
  311   HH11  ARG  22          HH21      ARG  22   5.177 -14.110   4.246
  312   HH12  ARG  22          HH22      ARG  22   4.595 -15.578   4.958
  313   HH21  ARG  22          HH11      ARG  22   1.387 -14.368   5.474
  314   HH22  ARG  22          HH12      ARG  22   2.450 -15.724   5.650
  315    H    GLY  23           H        GLY  23  -0.593 -12.175  -1.363
  316    HA2  GLY  23           HA2      GLY  23  -2.951 -11.981  -1.197
  317    HA3  GLY  23           HA1      GLY  23  -2.801 -12.053   0.560
  318    H    ALA  24           H        ALA  24  -4.283 -10.123  -1.224
  319    HA   ALA  24           HA       ALA  24  -3.714  -7.736   0.276
  320    HB1  ALA  24           HB1      ALA  24  -1.991  -6.947  -0.964
  321    HB2  ALA  24           HB2      ALA  24  -3.199  -6.630  -2.210
  322    HB3  ALA  24           HB3      ALA  24  -2.268  -8.128  -2.244
  323    H    PHE  25           H        PHE  25  -6.052  -8.136   0.455
  324    HA   PHE  25           HA       PHE  25  -7.553  -7.308  -1.982
  325    HB2  PHE  25           HB2      PHE  25  -9.513  -8.301  -0.456
  326    HB3  PHE  25           HB1      PHE  25  -8.534  -9.339  -1.492
  327    HD1  PHE  25           HD1      PHE  25  -8.790  -7.991   1.984
  328    HD2  PHE  25           HD2      PHE  25  -7.182 -11.049  -0.573
  329    HE1  PHE  25           HE1      PHE  25  -8.004  -9.244   3.976
  330    HE2  PHE  25           HE2      PHE  25  -6.396 -12.301   1.420
  331    HZ   PHE  25           HZ       PHE  25  -6.807 -11.399   3.694
  332    H    TYR  26           H        TYR  26  -6.794  -5.087  -1.157
  333    HA   TYR  26           HA       TYR  26  -8.475  -4.117   1.103
  334    HB2  TYR  26           HB2      TYR  26  -7.026  -2.131   1.062
  335    HB3  TYR  26           HB1      TYR  26  -6.052  -3.596   1.174
  336    HD1  TYR  26           HD1      TYR  26  -7.400  -1.100  -1.258
  337    HD2  TYR  26           HD2      TYR  26  -4.429  -4.104  -0.469
  338    HE1  TYR  26           HE1      TYR  26  -6.211  -0.472  -3.343
  339    HE2  TYR  26           HE2      TYR  26  -3.241  -3.478  -2.555
  340    HH   TYR  26           HH       TYR  26  -4.644  -1.449  -4.930
  341    H    THR  27           H        THR  27  -8.868  -4.521  -2.093
  342    HA   THR  27           HA       THR  27  -9.998  -1.837  -2.651
  343    HB   THR  27           HB       THR  27  -8.773  -2.709  -4.499
  344    HG1  THR  27           HG1      THR  27 -11.143  -2.052  -4.766
  345   HG21  THR  27          HG21      THR  27  -8.416  -4.962  -4.192
  346   HG22  THR  27          HG22      THR  27  -9.712  -5.054  -5.385
  347   HG23  THR  27          HG23      THR  27 -10.075  -5.261  -3.671
  348    H    LYS  28           H        LYS  28 -11.991  -1.598  -1.718
  349    HA   LYS  28           HA       LYS  28 -13.802  -3.755  -1.192
  350    HB2  LYS  28           HB2      LYS  28 -13.672  -1.099  -0.474
  351    HB3  LYS  28           HB1      LYS  28 -15.050  -1.122  -1.574
  352    HG2  LYS  28           HG2      LYS  28 -14.944  -3.349   0.377
  353    HG3  LYS  28           HG1      LYS  28 -15.239  -1.750   1.061
  354    HD2  LYS  28           HD2      LYS  28 -17.305  -1.589   0.122
  355    HD3  LYS  28           HD1      LYS  28 -16.781  -2.339  -1.387
  356    HE2  LYS  28           HE2      LYS  28 -17.590  -4.338  -0.742
  357    HE3  LYS  28           HE1      LYS  28 -16.690  -4.264   0.773
  358    HZ1  LYS  28           HZ1      LYS  28 -18.941  -4.325   1.372
  359    HZ2  LYS  28           HZ2      LYS  28 -19.385  -3.184   0.194
  360    HZ3  LYS  28           HZ3      LYS  28 -18.489  -2.701   1.554
  361    HA   PRO  29           HA       PRO  29 -16.035  -2.361  -5.175
  362    HB2  PRO  29           HB2      PRO  29 -14.767  -0.505  -6.757
  363    HB3  PRO  29           HB1      PRO  29 -15.899  -0.078  -5.463
  364    HG2  PRO  29           HG2      PRO  29 -12.929   0.157  -5.511
  365    HG3  PRO  29           HG1      PRO  29 -14.112   1.078  -4.567
  366    HD2  PRO  29           HD2      PRO  29 -12.503  -1.053  -3.615
  367    HD3  PRO  29           HD1      PRO  29 -13.884  -0.324  -2.768
  368    H    THR  30           H        THR  30 -15.619  -4.338  -6.167
  369    HA   THR  30           HA       THR  30 -13.370  -4.406  -8.105
  370    HB   THR  30           HB       THR  30 -12.732  -6.677  -7.374
  371    HG1  THR  30           HG1      THR  30 -13.716  -7.616  -5.687
  372   HG21  THR  30          HG21      THR  30 -11.342  -5.925  -5.709
  373   HG22  THR  30          HG22      THR  30 -12.651  -5.134  -4.831
  374   HG23  THR  30          HG23      THR  30 -11.953  -4.362  -6.255
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1 -10.041   4.931   5.463
    2    H2   GLY   1           HT2      GLY   1 -10.623   3.339   5.568
    3    H3   GLY   1           HT3      GLY   1 -11.320   4.427   4.467
    4    HA2  GLY   1           HA1      GLY   1  -9.604   2.785   3.557
    5    HA3  GLY   1           HA2      GLY   1  -9.488   4.481   2.993
    6    H    ILE   2           H        ILE   2  -7.738   2.454   2.448
    7    HA   ILE   2           HA       ILE   2  -5.991   1.874   4.796
    8    HB   ILE   2           HB       ILE   2  -6.767  -0.072   3.454
    9   HG12  ILE   2          HG12      ILE   2  -4.441  -0.970   2.948
   10   HG13  ILE   2          HG11      ILE   2  -3.821   0.631   3.355
   11   HG21  ILE   2          HG21      ILE   2  -5.001   0.713   1.192
   12   HG22  ILE   2          HG22      ILE   2  -6.552   1.544   1.304
   13   HG23  ILE   2          HG23      ILE   2  -6.501  -0.215   1.179
   14   HD11  ILE   2          HD11      ILE   2  -4.404  -1.471   5.145
   15   HD12  ILE   2          HD12      ILE   2  -5.664  -0.260   5.394
   16   HD13  ILE   2          HD13      ILE   2  -3.965   0.188   5.556
   17    H    VAL   3           H        VAL   3  -6.097   3.458   1.670
   18    HA   VAL   3           HA       VAL   3  -3.210   4.152   1.916
   19    HB   VAL   3           HB       VAL   3  -3.349   4.834  -0.415
   20   HG11  VAL   3          HG11      VAL   3  -4.824   2.464  -0.962
   21   HG12  VAL   3          HG12      VAL   3  -3.957   2.203   0.552
   22   HG13  VAL   3          HG13      VAL   3  -3.072   2.657  -0.905
   23   HG21  VAL   3          HG21      VAL   3  -5.586   5.828  -0.381
   24   HG22  VAL   3          HG22      VAL   3  -6.311   4.244  -0.109
   25   HG23  VAL   3          HG23      VAL   3  -5.512   4.597  -1.640
   26    H    GLU   4           H        GLU   4  -5.836   5.316   3.228
   27    HA   GLU   4           HA       GLU   4  -6.441   7.881   2.466
   28    HB2  GLU   4           HB2      GLU   4  -6.691   8.456   4.856
   29    HB3  GLU   4           HB1      GLU   4  -7.328   6.845   4.520
   30    HG2  GLU   4           HG2      GLU   4  -5.110   5.898   5.244
   31    HG3  GLU   4           HG1      GLU   4  -4.642   7.521   5.750
   32    H    GLN   5           H        GLN   5  -3.345   6.778   3.696
   33    HA   GLN   5           HA       GLN   5  -2.366   9.594   3.641
   34    HB2  GLN   5           HB2      GLN   5  -0.259   8.248   4.654
   35    HB3  GLN   5           HB1      GLN   5  -1.573   8.852   5.663
   36    HG2  GLN   5           HG2      GLN   5  -2.711   6.654   5.467
   37    HG3  GLN   5           HG1      GLN   5  -1.355   6.054   4.512
   38   HE21  GLN   5          HE21      GLN   5   0.742   7.402   6.044
   39   HE22  GLN   5          HE22      GLN   5   0.818   6.642   7.561
   40    H    CYS   6           H        CYS   6  -1.240   6.321   2.673
   41    HA   CYS   6           HA       CYS   6   0.894   7.135   1.040
   42    HB2  CYS   6           HB2      CYS   6  -1.005   4.859   0.406
   43    HB3  CYS   6           HB1      CYS   6   0.680   5.006  -0.092
   44    H    CYS   7           H        CYS   7  -2.564   7.196   0.395
   45    HA   CYS   7           HA       CYS   7  -2.201   7.848  -2.435
   46    HB2  CYS   7           HB2      CYS   7  -4.446   7.290  -0.635
   47    HB3  CYS   7           HB1      CYS   7  -4.781   8.556  -1.810
   48    H    THR   8           H        THR   8  -3.733   9.650   0.260
   49    HA   THR   8           HA       THR   8  -3.653  12.169  -1.087
   50    HB   THR   8           HB       THR   8  -5.049  11.535   0.960
   51    HG1  THR   8           HG1      THR   8  -4.513  13.736   0.085
   52   HG21  THR   8          HG21      THR   8  -2.601  12.413   2.491
   53   HG22  THR   8          HG22      THR   8  -2.946  10.710   2.188
   54   HG23  THR   8          HG23      THR   8  -4.080  11.689   3.120
   55    H    SER   9           H        SER   9  -1.378  10.617   1.156
   56    HA   SER   9           HA       SER   9   0.646  12.636   0.314
   57    HB2  SER   9           HB2      SER   9   1.387  12.088   2.896
   58    HB3  SER   9           HB1      SER   9   0.495  13.516   2.394
   59    HG   SER   9           HG       SER   9  -0.553  12.378   4.087
   60    H    ILE  10           H        ILE  10   2.774  11.613   1.818
   61    HA   ILE  10           HA       ILE  10   3.196   9.036   0.414
   62    HB   ILE  10           HB       ILE  10   5.346  10.430   1.968
   63   HG12  ILE  10          HG12      ILE  10   4.107  12.211   0.705
   64   HG13  ILE  10          HG11      ILE  10   5.753  11.974   0.122
   65   HG21  ILE  10          HG21      ILE  10   5.965   8.381   0.886
   66   HG22  ILE  10          HG22      ILE  10   6.623   9.682  -0.107
   67   HG23  ILE  10          HG23      ILE  10   5.152   8.849  -0.607
   68   HD11  ILE  10          HD11      ILE  10   4.793  10.385  -1.608
   69   HD12  ILE  10          HD12      ILE  10   4.352  12.079  -1.823
   70   HD13  ILE  10          HD13      ILE  10   3.194  10.947  -1.122
   71    H    CYS  11           H        CYS  11   4.248   7.261   1.618
   72    HA   CYS  11           HA       CYS  11   4.040   7.370   4.564
   73    HB2  CYS  11           HB2      CYS  11   2.571   5.416   4.686
   74    HB3  CYS  11           HB1      CYS  11   1.775   6.688   3.756
   75    H    SER  12           H        SER  12   4.501   4.815   5.248
   76    HA   SER  12           HA       SER  12   7.103   4.249   3.936
   77    HB2  SER  12           HB2      SER  12   6.945   2.472   5.986
   78    HB3  SER  12           HB1      SER  12   7.576   4.106   6.164
   79    HG   SER  12           HG       SER  12   5.601   4.772   6.913
   80    H    LEU  13           H        LEU  13   7.142   2.698   2.374
   81    HA   LEU  13           HA       LEU  13   4.900   1.091   1.718
   82    HB2  LEU  13           HB2      LEU  13   6.307  -0.025   0.137
   83    HB3  LEU  13           HB1      LEU  13   6.838   1.653   0.193
   84    HG   LEU  13           HG       LEU  13   8.124  -0.513   1.868
   85   HD11  LEU  13          HD11      LEU  13   9.840   0.251  -0.237
   86   HD12  LEU  13          HD12      LEU  13   8.277  -0.075  -0.987
   87   HD13  LEU  13          HD13      LEU  13   9.065  -1.318  -0.014
   88   HD21  LEU  13          HD21      LEU  13   8.696   2.358   1.177
   89   HD22  LEU  13          HD22      LEU  13  10.035   1.276   1.558
   90   HD23  LEU  13          HD23      LEU  13   8.765   1.561   2.748
   91    H    TYR  14           H        TYR  14   7.705   0.401   3.743
   92    HA   TYR  14           HA       TYR  14   7.127  -2.381   4.104
   93    HB2  TYR  14           HB2      TYR  14   8.430  -2.119   6.267
   94    HB3  TYR  14           HB1      TYR  14   9.287  -1.609   4.815
   95    HD1  TYR  14           HD1      TYR  14   7.442  -0.429   7.805
   96    HD2  TYR  14           HD2      TYR  14   9.869   0.696   4.442
   97    HE1  TYR  14           HE1      TYR  14   7.760   1.827   8.788
   98    HE2  TYR  14           HE2      TYR  14  10.185   2.952   5.423
   99    HH   TYR  14           HH       TYR  14   9.085   3.712   8.670
  100    H    GLN  15           H        GLN  15   5.707   0.510   5.309
  101    HA   GLN  15           HA       GLN  15   4.338  -0.704   7.557
  102    HB2  GLN  15           HB2      GLN  15   3.611   1.429   7.979
  103    HB3  GLN  15           HB1      GLN  15   4.894   1.855   6.861
  104    HG2  GLN  15           HG2      GLN  15   3.148   3.007   5.885
  105    HG3  GLN  15           HG1      GLN  15   2.963   1.458   5.064
  106   HE21  GLN  15          HE21      GLN  15   1.479   3.655   7.340
  107   HE22  GLN  15          HE22      GLN  15   0.089   2.727   7.633
  108    H    LEU  16           H        LEU  16   3.773  -0.262   4.155
  109    HA   LEU  16           HA       LEU  16   0.969  -0.813   4.091
  110    HB2  LEU  16           HB2      LEU  16   3.222  -0.950   2.112
  111    HB3  LEU  16           HB1      LEU  16   1.670  -1.676   1.695
  112    HG   LEU  16           HG       LEU  16   0.562   0.483   2.262
  113   HD11  LEU  16          HD11      LEU  16   1.826   1.779   3.637
  114   HD12  LEU  16          HD12      LEU  16   2.499   2.382   2.124
  115   HD13  LEU  16          HD13      LEU  16   3.341   1.122   3.021
  116   HD21  LEU  16          HD21      LEU  16   0.959   1.392   0.157
  117   HD22  LEU  16          HD22      LEU  16   1.621  -0.229  -0.063
  118   HD23  LEU  16          HD23      LEU  16   2.699   1.129   0.264
  119    H    GLU  17           H        GLU  17   3.821  -2.838   4.321
  120    HA   GLU  17           HA       GLU  17   2.851  -5.336   3.537
  121    HB2  GLU  17           HB2      GLU  17   5.065  -5.406   4.282
  122    HB3  GLU  17           HB1      GLU  17   4.720  -4.437   5.713
  123    HG2  GLU  17           HG2      GLU  17   4.053  -6.247   6.946
  124    HG3  GLU  17           HG1      GLU  17   3.353  -7.070   5.552
  125    H    ASN  18           H        ASN  18   1.928  -3.347   6.226
  126    HA   ASN  18           HA       ASN  18   0.612  -5.329   7.820
  127    HB2  ASN  18           HB2      ASN  18   1.195  -2.726   8.200
  128    HB3  ASN  18           HB1      ASN  18  -0.501  -2.573   7.738
  129   HD21  ASN  18          HD21      ASN  18  -1.887  -2.683   9.503
  130   HD22  ASN  18          HD22      ASN  18  -1.596  -3.564  10.923
  131    H    TYR  19           H        TYR  19  -0.464  -3.315   5.142
  132    HA   TYR  19           HA       TYR  19  -3.243  -4.006   5.302
  133    HB2  TYR  19           HB2      TYR  19  -1.792  -3.335   2.742
  134    HB3  TYR  19           HB1      TYR  19  -3.468  -2.993   3.167
  135    HD1  TYR  19           HD2      TYR  19  -2.423  -2.264   6.156
  136    HD2  TYR  19           HD1      TYR  19  -1.576  -0.880   2.176
  137    HE1  TYR  19           HE2      TYR  19  -1.739  -0.062   7.068
  138    HE2  TYR  19           HE1      TYR  19  -0.894   1.324   3.089
  139    HH   TYR  19           HH       TYR  19  -0.573   2.536   4.916
  140    H    CYS  20           H        CYS  20  -0.534  -5.858   4.457
  141    HA   CYS  20           HA       CYS  20  -2.036  -7.637   2.644
  142    HB2  CYS  20           HB2      CYS  20   0.814  -7.322   3.462
  143    HB3  CYS  20           HB1      CYS  20   0.286  -8.936   2.981
  144    H    ASN  21           H        ASN  21  -1.540  -7.267   5.968
  145    HA   ASN  21           HA       ASN  21  -1.939 -10.173   6.492
  146    HB2  ASN  21           HB2      ASN  21  -0.787  -7.901   8.023
  147    HB3  ASN  21           HB1      ASN  21  -1.691  -9.091   8.959
  148   HD21  ASN  21          HD21      ASN  21  -0.766 -11.198   9.220
  149   HD22  ASN  21          HD22      ASN  21   0.771 -11.609   8.628
  150    H1   PHE   1           HT1      PHE   1   9.966   1.428  -6.323
  151    H2   PHE   1           HT2      PHE   1   9.359   0.047  -5.542
  152    H3   PHE   1           HT3      PHE   1  10.717   0.854  -4.915
  153    HA   PHE   1           HA       PHE   1   7.968   1.964  -5.077
  154    HB2  PHE   1           HB2      PHE   1   8.423   0.135  -3.363
  155    HB3  PHE   1           HB1      PHE   1   9.581   1.241  -2.623
  156    HD1  PHE   1           HD2      PHE   1   8.654   3.709  -2.228
  157    HD2  PHE   1           HD1      PHE   1   6.212   0.196  -2.622
  158    HE1  PHE   1           HE2      PHE   1   6.804   4.862  -1.043
  159    HE2  PHE   1           HE1      PHE   1   4.363   1.347  -1.435
  160    HZ   PHE   1           HZ       PHE   1   4.658   3.682  -0.646
  161    H    VAL   2           H        VAL   2   7.920   4.165  -4.912
  162    HA   VAL   2           HA       VAL   2  10.457   5.530  -4.102
  163    HB   VAL   2           HB       VAL   2   9.371   7.442  -5.563
  164   HG11  VAL   2          HG11      VAL   2  10.586   6.560  -7.526
  165   HG12  VAL   2          HG12      VAL   2  10.640   4.966  -6.774
  166   HG13  VAL   2          HG13      VAL   2  11.512   6.314  -6.046
  167   HG21  VAL   2          HG21      VAL   2   8.314   5.069  -7.075
  168   HG22  VAL   2          HG22      VAL   2   7.861   6.768  -7.215
  169   HG23  VAL   2          HG23      VAL   2   7.316   5.821  -5.831
  170    H    ASN   3           H        ASN   3   9.796   7.983  -3.532
  171    HA   ASN   3           HA       ASN   3   7.625   7.737  -1.501
  172    HB2  ASN   3           HB2      ASN   3  10.157   9.338  -1.667
  173    HB3  ASN   3           HB1      ASN   3   8.816   9.959  -0.704
  174   HD21  ASN   3          HD21      ASN   3  11.442   8.871   0.271
  175   HD22  ASN   3          HD22      ASN   3  11.044   7.583   1.300
  176    H    GLN   4           H        GLN   4   5.903   8.208  -3.002
  177    HA   GLN   4           HA       GLN   4   5.535  11.088  -3.436
  178    HB2  GLN   4           HB2      GLN   4   4.945  10.687  -5.873
  179    HB3  GLN   4           HB1      GLN   4   6.663  10.569  -5.496
  180    HG2  GLN   4           HG2      GLN   4   6.428   8.101  -5.303
  181    HG3  GLN   4           HG1      GLN   4   4.732   8.247  -5.766
  182   HE21  GLN   4          HE21      GLN   4   4.731   7.360  -7.869
  183   HE22  GLN   4          HE22      GLN   4   5.716   7.919  -9.134
  184    H    HIS   5           H        HIS   5   3.295  11.099  -4.939
  185    HA   HIS   5           HA       HIS   5   1.368   9.692  -3.204
  186    HB2  HIS   5           HB2      HIS   5   0.789  11.574  -5.502
  187    HB3  HIS   5           HB1      HIS   5  -0.300  11.122  -4.191
  188    HD2  HIS   5           HD2      HIS   5   3.028  13.227  -4.637
  189    HE1  HIS   5           HE1      HIS   5   1.130  14.357  -1.032
  190    HE2  HIS   5           HE2      HIS   5   3.072  14.856  -2.609
  191    H    LEU   6           H        LEU   6   0.191   7.930  -3.863
  192    HA   LEU   6           HA       LEU   6  -0.014   7.308  -6.731
  193    HB2  LEU   6           HB2      LEU   6   0.855   5.019  -6.455
  194    HB3  LEU   6           HB1      LEU   6   2.090   6.214  -6.105
  195    HG   LEU   6           HG       LEU   6   2.219   4.460  -4.442
  196   HD11  LEU   6          HD11      LEU   6   0.788   6.519  -2.839
  197   HD12  LEU   6          HD12      LEU   6   2.174   7.053  -3.793
  198   HD13  LEU   6          HD13      LEU   6   2.371   5.787  -2.583
  199   HD21  LEU   6          HD21      LEU   6   0.442   3.417  -3.515
  200   HD22  LEU   6          HD22      LEU   6  -0.490   4.184  -4.800
  201   HD23  LEU   6          HD23      LEU   6  -0.401   4.934  -3.206
  202    H    CYS   7           H        CYS   7  -1.719   5.792  -7.189
  203    HA   CYS   7           HA       CYS   7  -3.317   4.759  -4.940
  204    HB2  CYS   7           HB2      CYS   7  -4.406   6.840  -6.856
  205    HB3  CYS   7           HB1      CYS   7  -5.393   5.893  -5.745
  206    H    GLY   8           H        GLY   8  -5.299   3.567  -5.859
  207    HA2  GLY   8           HA2      GLY   8  -6.191   1.960  -7.310
  208    HA3  GLY   8           HA1      GLY   8  -5.453   2.870  -8.626
  209    H    SER   9           H        SER   9  -4.512   1.246  -9.803
  210    HA   SER   9           HA       SER   9  -3.328  -1.115  -8.837
  211    HB2  SER   9           HB2      SER   9  -2.505   0.486 -11.276
  212    HB3  SER   9           HB1      SER   9  -2.126  -1.209 -10.984
  213    HG   SER   9           HG       SER   9  -4.632   0.013 -11.450
  214    H    ASP  10           H        ASP  10  -2.196   2.125  -8.634
  215    HA   ASP  10           HA       ASP  10   0.617   1.456  -8.386
  216    HB2  ASP  10           HB2      ASP  10  -0.705   3.917  -7.242
  217    HB3  ASP  10           HB1      ASP  10   0.951   3.744  -7.824
  218    H    LEU  11           H        LEU  11  -2.103   1.760  -6.194
  219    HA   LEU  11           HA       LEU  11  -0.598   1.705  -3.758
  220    HB2  LEU  11           HB2      LEU  11  -3.341   0.501  -4.214
  221    HB3  LEU  11           HB1      LEU  11  -2.659   1.022  -2.674
  222    HG   LEU  11           HG       LEU  11  -2.974   2.937  -4.984
  223   HD11  LEU  11          HD11      LEU  11  -4.973   2.256  -2.812
  224   HD12  LEU  11          HD12      LEU  11  -5.204   2.084  -4.551
  225   HD13  LEU  11          HD13      LEU  11  -5.073   3.689  -3.833
  226   HD21  LEU  11          HD21      LEU  11  -1.756   3.080  -2.464
  227   HD22  LEU  11          HD22      LEU  11  -3.290   3.929  -2.268
  228   HD23  LEU  11          HD23      LEU  11  -2.155   4.437  -3.514
  229    H    VAL  12           H        VAL  12  -1.656  -0.776  -5.999
  230    HA   VAL  12           HA       VAL  12  -0.697  -2.905  -4.221
  231    HB   VAL  12           HB       VAL  12  -0.990  -4.368  -6.281
  232   HG11  VAL  12          HG11      VAL  12  -2.938  -4.822  -5.288
  233   HG12  VAL  12          HG12      VAL  12  -3.663  -3.375  -5.989
  234   HG13  VAL  12          HG13      VAL  12  -2.835  -3.283  -4.433
  235   HG21  VAL  12          HG21      VAL  12  -2.320  -1.852  -7.320
  236   HG22  VAL  12          HG22      VAL  12  -2.383  -3.440  -8.083
  237   HG23  VAL  12          HG23      VAL  12  -0.848  -2.585  -7.959
  238    H    GLU  13           H        GLU  13   0.389  -1.332  -7.258
  239    HA   GLU  13           HA       GLU  13   2.672  -2.798  -7.811
  240    HB2  GLU  13           HB2      GLU  13   2.300  -0.924  -9.212
  241    HB3  GLU  13           HB1      GLU  13   2.183   0.181  -7.844
  242    HG2  GLU  13           HG2      GLU  13   4.403   0.560  -7.864
  243    HG3  GLU  13           HG1      GLU  13   4.755  -1.168  -7.872
  244    H    ALA  14           H        ALA  14   2.005  -0.671  -5.182
  245    HA   ALA  14           HA       ALA  14   4.685  -0.720  -4.039
  246    HB1  ALA  14           HB1      ALA  14   3.687   1.188  -3.270
  247    HB2  ALA  14           HB2      ALA  14   3.024   0.119  -2.035
  248    HB3  ALA  14           HB3      ALA  14   2.066   0.520  -3.460
  249    H    LEU  15           H        LEU  15   1.524  -1.973  -3.036
  250    HA   LEU  15           HA       LEU  15   2.655  -3.700  -0.993
  251    HB2  LEU  15           HB2      LEU  15  -0.054  -3.180  -2.142
  252    HB3  LEU  15           HB1      LEU  15   0.190  -4.667  -1.226
  253    HG   LEU  15           HG       LEU  15   1.244  -2.145  -0.038
  254   HD11  LEU  15          HD11      LEU  15  -1.605  -2.761   0.543
  255   HD12  LEU  15          HD12      LEU  15  -1.276  -2.001  -1.014
  256   HD13  LEU  15          HD13      LEU  15  -0.782  -1.203   0.480
  257   HD21  LEU  15          HD21      LEU  15  -0.349  -3.839   1.667
  258   HD22  LEU  15          HD22      LEU  15   1.383  -3.520   1.746
  259   HD23  LEU  15          HD23      LEU  15   0.774  -4.833   0.739
  260    H    TYR  16           H        TYR  16   2.749  -3.946  -4.257
  261    HA   TYR  16           HA       TYR  16   2.121  -6.809  -4.486
  262    HB2  TYR  16           HB2      TYR  16   1.460  -5.884  -6.472
  263    HB3  TYR  16           HB1      TYR  16   2.569  -4.530  -6.323
  264    HD1  TYR  16           HD1      TYR  16   2.679  -8.243  -6.857
  265    HD2  TYR  16           HD2      TYR  16   4.333  -4.391  -7.798
  266    HE1  TYR  16           HE1      TYR  16   4.234  -9.306  -8.478
  267    HE2  TYR  16           HE2      TYR  16   5.887  -5.450  -9.418
  268    HH   TYR  16           HH       TYR  16   5.501  -8.560 -10.568
  269    H    LEU  17           H        LEU  17   4.948  -4.665  -4.715
  270    HA   LEU  17           HA       LEU  17   6.692  -7.037  -4.979
  271    HB2  LEU  17           HB2      LEU  17   8.415  -4.911  -4.776
  272    HB3  LEU  17           HB1      LEU  17   7.800  -5.576  -6.281
  273    HG   LEU  17           HG       LEU  17   5.850  -3.973  -6.082
  274   HD11  LEU  17          HD11      LEU  17   6.212  -2.018  -4.593
  275   HD12  LEU  17          HD12      LEU  17   7.635  -2.814  -3.921
  276   HD13  LEU  17          HD13      LEU  17   6.036  -3.517  -3.681
  277   HD21  LEU  17          HD21      LEU  17   7.199  -3.043  -7.636
  278   HD22  LEU  17          HD22      LEU  17   8.655  -3.395  -6.704
  279   HD23  LEU  17          HD23      LEU  17   7.708  -1.950  -6.349
  280    H    VAL  18           H        VAL  18   5.436  -5.051  -2.525
  281    HA   VAL  18           HA       VAL  18   7.657  -5.567  -0.659
  282    HB   VAL  18           HB       VAL  18   6.418  -4.321   0.951
  283   HG11  VAL  18          HG11      VAL  18   5.389  -2.429  -0.663
  284   HG12  VAL  18          HG12      VAL  18   6.346  -3.321  -1.846
  285   HG13  VAL  18          HG13      VAL  18   7.125  -2.627  -0.424
  286   HG21  VAL  18          HG21      VAL  18   4.276  -5.388   0.829
  287   HG22  VAL  18          HG22      VAL  18   4.048  -4.867  -0.839
  288   HG23  VAL  18          HG23      VAL  18   4.008  -3.683   0.466
  289    H    CYS  19           H        CYS  19   4.355  -6.623  -1.235
  290    HA   CYS  19           HA       CYS  19   4.480  -8.645   0.894
  291    HB2  CYS  19           HB2      CYS  19   2.395  -8.118  -1.249
  292    HB3  CYS  19           HB1      CYS  19   2.213  -9.257   0.083
  293    H    GLY  20           H        GLY  20   4.257  -8.621  -2.673
  294    HA2  GLY  20           HA2      GLY  20   5.135 -10.156  -4.223
  295    HA3  GLY  20           HA1      GLY  20   6.001 -10.925  -2.892
  296    H    GLU  21           H        GLU  21   2.795 -10.694  -4.409
  297    HA   GLU  21           HA       GLU  21   0.988 -12.203  -4.373
  298    HB2  GLU  21           HB2      GLU  21   2.989 -13.374  -5.607
  299    HB3  GLU  21           HB1      GLU  21   3.026 -14.400  -4.174
  300    HG2  GLU  21           HG2      GLU  21   1.531 -15.573  -5.522
  301    HG3  GLU  21           HG1      GLU  21   0.426 -14.563  -4.588
  302    H    ARG  22           H        ARG  22   2.241 -11.373  -1.723
  303    HA   ARG  22           HA       ARG  22   1.813 -13.736  -0.024
  304    HB2  ARG  22           HB2      ARG  22   3.525 -11.840   0.389
  305    HB3  ARG  22           HB1      ARG  22   2.142 -10.898   0.949
  306    HG2  ARG  22           HG2      ARG  22   1.658 -12.468   2.689
  307    HG3  ARG  22           HG1      ARG  22   2.778 -13.655   2.020
  308    HD2  ARG  22           HD2      ARG  22   4.681 -12.320   2.599
  309    HD3  ARG  22           HD1      ARG  22   3.668 -10.926   2.977
  310    HE   ARG  22           HE       ARG  22   4.357 -12.949   4.836
  311   HH11  ARG  22          HH21      ARG  22   2.987 -10.353   5.522
  312   HH12  ARG  22          HH22      ARG  22   1.466 -10.909   6.138
  313   HH21  ARG  22          HH11      ARG  22   1.789 -14.094   4.806
  314   HH22  ARG  22          HH12      ARG  22   0.788 -13.026   5.733
  315    H    GLY  23           H        GLY  23  -0.299 -11.957  -1.653
  316    HA2  GLY  23           HA2      GLY  23  -2.696 -12.483  -0.939
  317    HA3  GLY  23           HA1      GLY  23  -2.245 -11.773   0.612
  318    H    ALA  24           H        ALA  24  -2.154  -9.520   0.799
  319    HA   ALA  24           HA       ALA  24  -2.560  -7.282   0.212
  320    HB1  ALA  24           HB1      ALA  24  -0.830  -7.883  -1.581
  321    HB2  ALA  24           HB2      ALA  24  -1.915  -6.546  -1.964
  322    HB3  ALA  24           HB3      ALA  24  -2.197  -8.140  -2.665
  323    H    PHE  25           H        PHE  25  -4.772  -7.331   0.801
  324    HA   PHE  25           HA       PHE  25  -6.630  -7.177  -1.470
  325    HB2  PHE  25           HB2      PHE  25  -8.201  -8.819  -0.533
  326    HB3  PHE  25           HB1      PHE  25  -6.650  -9.586  -0.878
  327    HD1  PHE  25           HD2      PHE  25  -4.910  -9.588   1.099
  328    HD2  PHE  25           HD1      PHE  25  -9.147  -9.065   1.593
  329    HE1  PHE  25           HE2      PHE  25  -4.717 -10.274   3.475
  330    HE2  PHE  25           HE1      PHE  25  -8.954  -9.751   3.971
  331    HZ   PHE  25           HZ       PHE  25  -6.739 -10.355   4.911
  332    H    TYR  26           H        TYR  26  -6.874  -4.987  -0.800
  333    HA   TYR  26           HA       TYR  26  -7.961  -4.543   1.933
  334    HB2  TYR  26           HB2      TYR  26  -7.656  -2.115   1.343
  335    HB3  TYR  26           HB1      TYR  26  -6.158  -3.046   1.318
  336    HD1  TYR  26           HD1      TYR  26  -8.873  -1.687  -0.846
  337    HD2  TYR  26           HD2      TYR  26  -4.882  -3.274  -0.673
  338    HE1  TYR  26           HE1      TYR  26  -8.520  -1.061  -3.222
  339    HE2  TYR  26           HE2      TYR  26  -4.530  -2.647  -3.048
  340    HH   TYR  26           HH       TYR  26  -6.234  -0.509  -4.657
  341    H    THR  27           H        THR  27  -9.137  -5.264  -1.069
  342    HA   THR  27           HA       THR  27 -11.358  -3.365  -1.154
  343    HB   THR  27           HB       THR  27 -10.452  -4.369  -3.226
  344    HG1  THR  27           HG1      THR  27 -12.985  -5.500  -3.005
  345   HG21  THR  27          HG21      THR  27 -10.369  -6.641  -3.618
  346   HG22  THR  27          HG22      THR  27 -11.744  -6.979  -2.567
  347   HG23  THR  27          HG23      THR  27 -10.160  -6.645  -1.867
  348    H    LYS  28           H        LYS  28 -13.446  -3.722  -0.413
  349    HA   LYS  28           HA       LYS  28 -14.432  -6.327   0.353
  350    HB2  LYS  28           HB2      LYS  28 -14.615  -5.762   2.824
  351    HB3  LYS  28           HB1      LYS  28 -12.983  -6.124   2.261
  352    HG2  LYS  28           HG2      LYS  28 -12.266  -3.961   2.517
  353    HG3  LYS  28           HG1      LYS  28 -13.839  -3.280   2.102
  354    HD2  LYS  28           HD2      LYS  28 -14.710  -4.030   4.313
  355    HD3  LYS  28           HD1      LYS  28 -13.094  -4.601   4.727
  356    HE2  LYS  28           HE2      LYS  28 -13.049  -1.860   3.735
  357    HE3  LYS  28           HE1      LYS  28 -14.087  -2.027   5.151
  358    HZ1  LYS  28           HZ1      LYS  28 -11.290  -3.006   4.966
  359    HZ2  LYS  28           HZ2      LYS  28 -12.291  -3.077   6.336
  360    HZ3  LYS  28           HZ3      LYS  28 -11.768  -1.574   5.740
  361    HA   PRO  29           HA       PRO  29 -17.533  -2.980  -0.315
  362    HB2  PRO  29           HB2      PRO  29 -18.824  -4.273  -2.369
  363    HB3  PRO  29           HB1      PRO  29 -17.454  -3.176  -2.610
  364    HG2  PRO  29           HG2      PRO  29 -17.523  -6.153  -2.760
  365    HG3  PRO  29           HG1      PRO  29 -16.433  -5.013  -3.568
  366    HD2  PRO  29           HD2      PRO  29 -15.813  -6.557  -1.278
  367    HD3  PRO  29           HD1      PRO  29 -14.875  -5.179  -1.895
  368    H    THR  30           H        THR  30 -18.076  -4.088   1.878
  369    HA   THR  30           HA       THR  30 -20.414  -5.921   1.519
  370    HB   THR  30           HB       THR  30 -19.881  -6.983   3.552
  371    HG1  THR  30           HG1      THR  30 -18.034  -4.912   4.106
  372   HG21  THR  30          HG21      THR  30 -17.146  -6.195   2.531
  373   HG22  THR  30          HG22      THR  30 -18.191  -7.336   1.684
  374   HG23  THR  30          HG23      THR  30 -17.614  -7.708   3.308