*HEADER    PROTEIN BINDING                         04-SEP-09   2KNV              
*TITLE     NMR DIMER STRUCTURE OF THE UBA DOMAIN OF P62 (SQSTM1)                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SEQUESTOSOME-1;                                            
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: UBA DOMAIN, UNP RESIDUES 387-436;                          
*COMPND   5 SYNONYM: PHOSPHOTYROSINE-INDEPENDENT LIGAND FOR THE LCK SH2          
*COMPND   6 DOMAIN OF 62 KDA, UBIQUITIN-BINDING PROTEIN P62, EBI3-               
*COMPND   7 ASSOCIATED PROTEIN OF 60 KDA, P60, EBIAP;                            
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: SQSTM1;                                                        
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   9 EXPRESSION_SYSTEM_VARIANT: (DE3);                                    
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  11 EXPRESSION_SYSTEM_VECTOR: PGEX-4T-1                                  
*KEYWDS    UBIQUITIN BINDING, UBIQUITIN-ASSOCIATED DOMAIN, PAGET S               
*KEYWDS   2 DISEASE OF BONE, HELICAL BUNDLE, DIMER, PROTEIN BINDING              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    J.E.LONG, M.S.SEARLE                                                  
*REVDAT   2   29-DEC-09 2KNV    1       NEW CONSTRAINT FILE                                     
*REVDAT   1   15-DEC-09 2KNV    0                                                


!START_OF_NOE_DATA
assign ( resid 49 and name HE# and segid "A   " ) ( resid 48 and name HG2 and segid "B   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ2 and segid "A   " ) ( resid 32 and name HD1# and segid "B   " ) 5.0 3.2 0.5
assign ( resid 49 and name HE# and segid "A   " ) ( resid 48 and name HB2 and segid "B   " ) 4.0 2.2 0.5
assign ( resid 49 and name HE# and segid "A   " ) ( resid 48 and name HB1 and segid "B   " ) 5.0 3.2 0.5
assign ( resid 26 and name HA1 and segid "A   " ) ( resid 35 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 26 and name HA2 and segid "A   " ) ( resid 35 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 49 and name HE# and segid "A   " ) ( resid 45 and name HA and segid "B   " ) 5.0 3.2 0.5
assign ( resid 49 and name HE# and segid "A   " ) ( resid 48 and name HA and segid "B   " ) 5.0 3.2 0.5
assign ( resid 25 and name HG1 and segid "A   " ) ( resid 35 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 25 and name HG2 and segid "A   " ) ( resid 35 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 25 and name HB1 and segid "A   " ) ( resid 35 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 25 and name HB2 and segid "A   " ) ( resid 35 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 47 and name HG2# and segid "A   " ) ( resid 47 and name HB and segid "B   " ) 5.0 3.2 0.5
assign ( resid 47 and name HD1# and segid "A   " ) ( resid 47 and name HB and segid "B   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ2 and segid "A   " ) ( resid 47 and name HG2# and segid "B   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ2 and segid "A   " ) ( resid 46 and name HG2# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 28 and name HH2 and segid "A   " ) ( resid 47 and name HG2# and segid "B   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ3 and segid "A   " ) ( resid 47 and name HG2# and segid "B   " ) 5.0 3.2 0.5
assign ( resid 28 and name HD1 and segid "A   " ) ( resid 35 and name HG1 and segid "B   " ) 5.0 3.2 0.5
assign ( resid 48 and name HG1 and segid "A   " ) ( resid 48 and name HB2 and segid "B   " ) 4.0 2.2 0.5
assign ( resid 48 and name HG2 and segid "A   " ) ( resid 48 and name HB2 and segid "B   " ) 4.0 2.2 0.5
assign ( resid 28 and name HD1 and segid "A   " ) ( resid 32 and name HD1# and segid "B   " ) 5.0 3.2 0.5
assign ( resid 28 and name HE3 and segid "A   " ) ( resid 28 and name HZ3 and segid "B   " ) 4.0 2.2 0.5
assign ( resid 28 and name HE3 and segid "A   " ) ( resid 28 and name HB# and segid "B   " ) 4.0 2.2 0.5
assign ( resid 49 and name HE# and segid "B   " ) ( resid 48 and name HG2 and segid "A   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ2 and segid "B   " ) ( resid 32 and name HD1# and segid "A   " ) 5.0 3.2 0.5
assign ( resid 49 and name HE# and segid "B   " ) ( resid 48 and name HB2 and segid "A   " ) 4.0 2.2 0.5
assign ( resid 49 and name HE# and segid "B   " ) ( resid 48 and name HB1 and segid "A   " ) 5.0 3.2 0.5
assign ( resid 26 and name HA1 and segid "B   " ) ( resid 35 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 26 and name HA2 and segid "B   " ) ( resid 35 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 49 and name HE# and segid "B   " ) ( resid 45 and name HA and segid "A   " ) 5.0 3.2 0.5
assign ( resid 49 and name HE# and segid "B   " ) ( resid 48 and name HA and segid "A   " ) 5.0 3.2 0.5
assign ( resid 25 and name HG1 and segid "B   " ) ( resid 35 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 25 and name HG2 and segid "B   " ) ( resid 35 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 25 and name HB1 and segid "B   " ) ( resid 35 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 25 and name HB2 and segid "B   " ) ( resid 35 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 47 and name HG2# and segid "B   " ) ( resid 47 and name HB and segid "A   " ) 5.0 3.2 0.5
assign ( resid 47 and name HD1# and segid "B   " ) ( resid 47 and name HB and segid "A   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ2 and segid "B   " ) ( resid 47 and name HG2# and segid "A   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ2 and segid "B   " ) ( resid 46 and name HG2# and segid "A   " ) 4.0 2.2 0.5
assign ( resid 28 and name HH2 and segid "B   " ) ( resid 47 and name HG2# and segid "A   " ) 5.0 3.2 0.5
assign ( resid 28 and name HZ3 and segid "B   " ) ( resid 47 and name HG2# and segid "A   " ) 5.0 3.2 0.5
assign ( resid 28 and name HD1 and segid "B   " ) ( resid 35 and name HG1 and segid "A   " ) 5.0 3.2 0.5
assign ( resid 48 and name HG1 and segid "B   " ) ( resid 48 and name HB2 and segid "A   " ) 4.0 2.2 0.5
assign ( resid 48 and name HG2 and segid "B   " ) ( resid 48 and name HB2 and segid "A   " ) 4.0 2.2 0.5
assign ( resid 28 and name HD1 and segid "B   " ) ( resid 32 and name HD1# and segid "A   " ) 5.0 3.2 0.5
assign ( resid 28 and name HE3 and segid "B   " ) ( resid 28 and name HZ3 and segid "A   " ) 4.0 2.2 0.5
assign ( resid 28 and name HE3 and segid "B   " ) ( resid 28 and name HB# and segid "A   " ) 4.0 2.2 0.5
!START_OF_HB_DATA
!START_OF_TOR_DATA
assign (segid "A  " and resid 1 and name c ) (segid "A  " and resid 2 and name n ) (segid "A  " and resid 2 and name ca ) (segid "A  " and resid 2 and name c ) 1.0 -94.320 30 2
assign (segid "A  " and resid 2 and name n ) (segid "A  " and resid 2 and name ca ) (segid "A  " and resid 2 and name c ) (segid "A  " and resid 3 and name n ) 1.0 127.790 30 2
assign (segid "A  " and resid 2 and name c ) (segid "A  " and resid 3 and name n ) (segid "A  " and resid 3 and name ca ) (segid "A  " and resid 3 and name c ) 1.0 -64.800 30 2
assign (segid "A  " and resid 3 and name n ) (segid "A  " and resid 3 and name ca ) (segid "A  " and resid 3 and name c ) (segid "A  " and resid 4 and name n ) 1.0 148.840 30 2
assign (segid "A  " and resid 6 and name c ) (segid "A  " and resid 7 and name n ) (segid "A  " and resid 7 and name ca ) (segid "A  " and resid 7 and name c ) 1.0 -76.790 30 2
assign (segid "A  " and resid 7 and name n ) (segid "A  " and resid 7 and name ca ) (segid "A  " and resid 7 and name c ) (segid "A  " and resid 8 and name n ) 1.0 122.530 30 2
assign (segid "A  " and resid 7 and name c ) (segid "A  " and resid 8 and name n ) (segid "A  " and resid 8 and name ca ) (segid "A  " and resid 8 and name c ) 1.0 -59.840 30 2
assign (segid "A  " and resid 8 and name n ) (segid "A  " and resid 8 and name ca ) (segid "A  " and resid 8 and name c ) (segid "A  " and resid 9 and name n ) 1.0 -31.200 30 2
assign (segid "A  " and resid 8 and name c ) (segid "A  " and resid 9 and name n ) (segid "A  " and resid 9 and name ca ) (segid "A  " and resid 9 and name c ) 1.0 -63.000 30 2
assign (segid "A  " and resid 9 and name n ) (segid "A  " and resid 9 and name ca ) (segid "A  " and resid 9 and name c ) (segid "A  " and resid 10 and name n ) 1.0 -39.780 30 2
assign (segid "A  " and resid 9 and name c ) (segid "A  " and resid 10 and name n ) (segid "A  " and resid 10 and name ca ) (segid "A  " and resid 10 and name c ) 1.0 -67.520 30 2
assign (segid "A  " and resid 10 and name n ) (segid "A  " and resid 10 and name ca ) (segid "A  " and resid 10 and name c ) (segid "A  " and resid 11 and name n ) 1.0 -42.150 30 2
assign (segid "A  " and resid 10 and name c ) (segid "A  " and resid 11 and name n ) (segid "A  " and resid 11 and name ca ) (segid "A  " and resid 11 and name c ) 1.0 -65.900 30 2
assign (segid "A  " and resid 11 and name n ) (segid "A  " and resid 11 and name ca ) (segid "A  " and resid 11 and name c ) (segid "A  " and resid 12 and name n ) 1.0 -38.640 30 2
assign (segid "A  " and resid 11 and name c ) (segid "A  " and resid 12 and name n ) (segid "A  " and resid 12 and name ca ) (segid "A  " and resid 12 and name c ) 1.0 -63.600 30 2
assign (segid "A  " and resid 12 and name n ) (segid "A  " and resid 12 and name ca ) (segid "A  " and resid 12 and name c ) (segid "A  " and resid 13 and name n ) 1.0 -43.950 30 2
assign (segid "A  " and resid 12 and name c ) (segid "A  " and resid 13 and name n ) (segid "A  " and resid 13 and name ca ) (segid "A  " and resid 13 and name c ) 1.0 -64.370 30 2
assign (segid "A  " and resid 13 and name n ) (segid "A  " and resid 13 and name ca ) (segid "A  " and resid 13 and name c ) (segid "A  " and resid 14 and name n ) 1.0 -40.570 30 2
assign (segid "A  " and resid 13 and name c ) (segid "A  " and resid 14 and name n ) (segid "A  " and resid 14 and name ca ) (segid "A  " and resid 14 and name c ) 1.0 -62.210 30 2
assign (segid "A  " and resid 14 and name n ) (segid "A  " and resid 14 and name ca ) (segid "A  " and resid 14 and name c ) (segid "A  " and resid 15 and name n ) 1.0 -46.540 30 2
assign (segid "A  " and resid 14 and name c ) (segid "A  " and resid 15 and name n ) (segid "A  " and resid 15 and name ca ) (segid "A  " and resid 15 and name c ) 1.0 -63.260 30 2
assign (segid "A  " and resid 15 and name n ) (segid "A  " and resid 15 and name ca ) (segid "A  " and resid 15 and name c ) (segid "A  " and resid 16 and name n ) 1.0 -41.400 30 2
assign (segid "A  " and resid 15 and name c ) (segid "A  " and resid 16 and name n ) (segid "A  " and resid 16 and name ca ) (segid "A  " and resid 16 and name c ) 1.0 -65.180 30 2
assign (segid "A  " and resid 16 and name n ) (segid "A  " and resid 16 and name ca ) (segid "A  " and resid 16 and name c ) (segid "A  " and resid 17 and name n ) 1.0 -42.720 30 2
assign (segid "A  " and resid 16 and name c ) (segid "A  " and resid 17 and name n ) (segid "A  " and resid 17 and name ca ) (segid "A  " and resid 17 and name c ) 1.0 -69.870 30 2
assign (segid "A  " and resid 17 and name n ) (segid "A  " and resid 17 and name ca ) (segid "A  " and resid 17 and name c ) (segid "A  " and resid 18 and name n ) 1.0 -38.240 30 2
assign (segid "A  " and resid 17 and name c ) (segid "A  " and resid 18 and name n ) (segid "A  " and resid 18 and name ca ) (segid "A  " and resid 18 and name c ) 1.0 -65.190 30 2
assign (segid "A  " and resid 18 and name n ) (segid "A  " and resid 18 and name ca ) (segid "A  " and resid 18 and name c ) (segid "A  " and resid 19 and name n ) 1.0 -39.270 30 2
assign (segid "A  " and resid 18 and name c ) (segid "A  " and resid 19 and name n ) (segid "A  " and resid 19 and name ca ) (segid "A  " and resid 19 and name c ) 1.0 -68.420 30 2
assign (segid "A  " and resid 19 and name n ) (segid "A  " and resid 19 and name ca ) (segid "A  " and resid 19 and name c ) (segid "A  " and resid 20 and name n ) 1.0 -21.000 30 2
assign (segid "A  " and resid 19 and name c ) (segid "A  " and resid 20 and name n ) (segid "A  " and resid 20 and name ca ) (segid "A  " and resid 20 and name c ) 1.0 -92.050 30 2
assign (segid "A  " and resid 20 and name n ) (segid "A  " and resid 20 and name ca ) (segid "A  " and resid 20 and name c ) (segid "A  " and resid 21 and name n ) 1.0 -1.070 30 2
assign (segid "A  " and resid 20 and name c ) (segid "A  " and resid 21 and name n ) (segid "A  " and resid 21 and name ca ) (segid "A  " and resid 21 and name c ) 1.0 83.670 30 2
assign (segid "A  " and resid 21 and name n ) (segid "A  " and resid 21 and name ca ) (segid "A  " and resid 21 and name c ) (segid "A  " and resid 22 and name n ) 1.0 16.260 30 2
assign (segid "A  " and resid 21 and name c ) (segid "A  " and resid 22 and name n ) (segid "A  " and resid 22 and name ca ) (segid "A  " and resid 22 and name c ) 1.0 -106.530 30 2
assign (segid "A  " and resid 22 and name n ) (segid "A  " and resid 22 and name ca ) (segid "A  " and resid 22 and name c ) (segid "A  " and resid 23 and name n ) 1.0 154.230 30 2
assign (segid "A  " and resid 23 and name c ) (segid "A  " and resid 24 and name n ) (segid "A  " and resid 24 and name ca ) (segid "A  " and resid 24 and name c ) 1.0 -90.190 30 2
assign (segid "A  " and resid 24 and name n ) (segid "A  " and resid 24 and name ca ) (segid "A  " and resid 24 and name c ) (segid "A  " and resid 25 and name n ) 1.0 147.980 30 2
assign (segid "A  " and resid 27 and name c ) (segid "A  " and resid 28 and name n ) (segid "A  " and resid 28 and name ca ) (segid "A  " and resid 28 and name c ) 1.0 -65.380 30 2
assign (segid "A  " and resid 28 and name n ) (segid "A  " and resid 28 and name ca ) (segid "A  " and resid 28 and name c ) (segid "A  " and resid 29 and name n ) 1.0 -34.340 30 2
assign (segid "A  " and resid 28 and name c ) (segid "A  " and resid 29 and name n ) (segid "A  " and resid 29 and name ca ) (segid "A  " and resid 29 and name c ) 1.0 -62.410 30 2
assign (segid "A  " and resid 29 and name n ) (segid "A  " and resid 29 and name ca ) (segid "A  " and resid 29 and name c ) (segid "A  " and resid 30 and name n ) 1.0 -40.820 30 2
assign (segid "A  " and resid 29 and name c ) (segid "A  " and resid 30 and name n ) (segid "A  " and resid 30 and name ca ) (segid "A  " and resid 30 and name c ) 1.0 -63.570 30 2
assign (segid "A  " and resid 30 and name n ) (segid "A  " and resid 30 and name ca ) (segid "A  " and resid 30 and name c ) (segid "A  " and resid 31 and name n ) 1.0 -41.260 30 2
assign (segid "A  " and resid 30 and name c ) (segid "A  " and resid 31 and name n ) (segid "A  " and resid 31 and name ca ) (segid "A  " and resid 31 and name c ) 1.0 -64.160 30 2
assign (segid "A  " and resid 31 and name n ) (segid "A  " and resid 31 and name ca ) (segid "A  " and resid 31 and name c ) (segid "A  " and resid 32 and name n ) 1.0 -35.730 30 2
assign (segid "A  " and resid 31 and name c ) (segid "A  " and resid 32 and name n ) (segid "A  " and resid 32 and name ca ) (segid "A  " and resid 32 and name c ) 1.0 -63.480 30 2
assign (segid "A  " and resid 32 and name n ) (segid "A  " and resid 32 and name ca ) (segid "A  " and resid 32 and name c ) (segid "A  " and resid 33 and name n ) 1.0 -45.590 30 2
assign (segid "A  " and resid 32 and name c ) (segid "A  " and resid 33 and name n ) (segid "A  " and resid 33 and name ca ) (segid "A  " and resid 33 and name c ) 1.0 -61.820 30 2
assign (segid "A  " and resid 33 and name n ) (segid "A  " and resid 33 and name ca ) (segid "A  " and resid 33 and name c ) (segid "A  " and resid 34 and name n ) 1.0 -39.160 30 2
assign (segid "A  " and resid 33 and name c ) (segid "A  " and resid 34 and name n ) (segid "A  " and resid 34 and name ca ) (segid "A  " and resid 34 and name c ) 1.0 -63.570 30 2
assign (segid "A  " and resid 34 and name n ) (segid "A  " and resid 34 and name ca ) (segid "A  " and resid 34 and name c ) (segid "A  " and resid 35 and name n ) 1.0 -41.300 30 2
assign (segid "A  " and resid 34 and name c ) (segid "A  " and resid 35 and name n ) (segid "A  " and resid 35 and name ca ) (segid "A  " and resid 35 and name c ) 1.0 -68.850 30 2
assign (segid "A  " and resid 35 and name n ) (segid "A  " and resid 35 and name ca ) (segid "A  " and resid 35 and name c ) (segid "A  " and resid 36 and name n ) 1.0 -33.020 30 2
assign (segid "A  " and resid 35 and name c ) (segid "A  " and resid 36 and name n ) (segid "A  " and resid 36 and name ca ) (segid "A  " and resid 36 and name c ) 1.0 -99.210 30 2
assign (segid "A  " and resid 36 and name n ) (segid "A  " and resid 36 and name ca ) (segid "A  " and resid 36 and name c ) (segid "A  " and resid 37 and name n ) 1.0 6.470 30 2
assign (segid "A  " and resid 39 and name c ) (segid "A  " and resid 40 and name n ) (segid "A  " and resid 40 and name ca ) (segid "A  " and resid 40 and name c ) 1.0 -58.730 30 2
assign (segid "A  " and resid 40 and name n ) (segid "A  " and resid 40 and name ca ) (segid "A  " and resid 40 and name c ) (segid "A  " and resid 41 and name n ) 1.0 -34.270 30 2
assign (segid "A  " and resid 40 and name c ) (segid "A  " and resid 41 and name n ) (segid "A  " and resid 41 and name ca ) (segid "A  " and resid 41 and name c ) 1.0 -64.020 30 2
assign (segid "A  " and resid 41 and name n ) (segid "A  " and resid 41 and name ca ) (segid "A  " and resid 41 and name c ) (segid "A  " and resid 42 and name n ) 1.0 -38.210 30 2
assign (segid "A  " and resid 41 and name c ) (segid "A  " and resid 42 and name n ) (segid "A  " and resid 42 and name ca ) (segid "A  " and resid 42 and name c ) 1.0 -68.800 30 2
assign (segid "A  " and resid 42 and name n ) (segid "A  " and resid 42 and name ca ) (segid "A  " and resid 42 and name c ) (segid "A  " and resid 43 and name n ) 1.0 -39.470 30 2
assign (segid "A  " and resid 42 and name c ) (segid "A  " and resid 43 and name n ) (segid "A  " and resid 43 and name ca ) (segid "A  " and resid 43 and name c ) 1.0 -61.850 30 2
assign (segid "A  " and resid 43 and name n ) (segid "A  " and resid 43 and name ca ) (segid "A  " and resid 43 and name c ) (segid "A  " and resid 44 and name n ) 1.0 -43.240 30 2
assign (segid "A  " and resid 43 and name c ) (segid "A  " and resid 44 and name n ) (segid "A  " and resid 44 and name ca ) (segid "A  " and resid 44 and name c ) 1.0 -61.460 30 2
assign (segid "A  " and resid 44 and name n ) (segid "A  " and resid 44 and name ca ) (segid "A  " and resid 44 and name c ) (segid "A  " and resid 45 and name n ) 1.0 -39.770 30 2
assign (segid "A  " and resid 44 and name c ) (segid "A  " and resid 45 and name n ) (segid "A  " and resid 45 and name ca ) (segid "A  " and resid 45 and name c ) 1.0 -65.530 30 2
assign (segid "A  " and resid 45 and name n ) (segid "A  " and resid 45 and name ca ) (segid "A  " and resid 45 and name c ) (segid "A  " and resid 46 and name n ) 1.0 -38.030 30 2
assign (segid "A  " and resid 45 and name c ) (segid "A  " and resid 46 and name n ) (segid "A  " and resid 46 and name ca ) (segid "A  " and resid 46 and name c ) 1.0 -65.430 30 2
assign (segid "A  " and resid 46 and name n ) (segid "A  " and resid 46 and name ca ) (segid "A  " and resid 46 and name c ) (segid "A  " and resid 47 and name n ) 1.0 -36.310 30 2
assign (segid "A  " and resid 46 and name c ) (segid "A  " and resid 47 and name n ) (segid "A  " and resid 47 and name ca ) (segid "A  " and resid 47 and name c ) 1.0 -95.100 30 2
assign (segid "A  " and resid 47 and name n ) (segid "A  " and resid 47 and name ca ) (segid "A  " and resid 47 and name c ) (segid "A  " and resid 48 and name n ) 1.0 8.320 30 2
assign (segid "B   " and resid 1 and name c ) (segid "B   " and resid 2 and name n ) (segid "B   " and resid 2 and name ca ) (segid "B   " and resid 2 and name c ) 1.0 -94.320 30 2
assign (segid "B   " and resid 2 and name n ) (segid "B   " and resid 2 and name ca ) (segid "B   " and resid 2 and name c ) (segid "B   " and resid 3 and name n ) 1.0 127.790 30 2
assign (segid "B   " and resid 2 and name c ) (segid "B   " and resid 3 and name n ) (segid "B   " and resid 3 and name ca ) (segid "B   " and resid 3 and name c ) 1.0 -64.800 30 2
assign (segid "B   " and resid 3 and name n ) (segid "B   " and resid 3 and name ca ) (segid "B   " and resid 3 and name c ) (segid "B   " and resid 4 and name n ) 1.0 148.840 30 2
assign (segid "B   " and resid 6 and name c ) (segid "B   " and resid 7 and name n ) (segid "B   " and resid 7 and name ca ) (segid "B   " and resid 7 and name c ) 1.0 -76.790 30 2
assign (segid "B   " and resid 7 and name n ) (segid "B   " and resid 7 and name ca ) (segid "B   " and resid 7 and name c ) (segid "B   " and resid 8 and name n ) 1.0 122.530 30 2
assign (segid "B   " and resid 7 and name c ) (segid "B   " and resid 8 and name n ) (segid "B   " and resid 8 and name ca ) (segid "B   " and resid 8 and name c ) 1.0 -59.840 30 2
assign (segid "B   " and resid 8 and name n ) (segid "B   " and resid 8 and name ca ) (segid "B   " and resid 8 and name c ) (segid "B   " and resid 9 and name n ) 1.0 -31.200 30 2
assign (segid "B   " and resid 8 and name c ) (segid "B   " and resid 9 and name n ) (segid "B   " and resid 9 and name ca ) (segid "B   " and resid 9 and name c ) 1.0 -63.000 30 2
assign (segid "B   " and resid 9 and name n ) (segid "B   " and resid 9 and name ca ) (segid "B   " and resid 9 and name c ) (segid "B   " and resid 10 and name n ) 1.0 -39.780 30 2
assign (segid "B   " and resid 9 and name c ) (segid "B   " and resid 10 and name n ) (segid "B   " and resid 10 and name ca ) (segid "B   " and resid 10 and name c ) 1.0 -67.520 30 2
assign (segid "B   " and resid 10 and name n ) (segid "B   " and resid 10 and name ca ) (segid "B   " and resid 10 and name c ) (segid "B   " and resid 11 and name n ) 1.0 -42.150 30 2
assign (segid "B   " and resid 10 and name c ) (segid "B   " and resid 11 and name n ) (segid "B   " and resid 11 and name ca ) (segid "B   " and resid 11 and name c ) 1.0 -65.900 30 2
assign (segid "B   " and resid 11 and name n ) (segid "B   " and resid 11 and name ca ) (segid "B   " and resid 11 and name c ) (segid "B   " and resid 12 and name n ) 1.0 -38.640 30 2
assign (segid "B   " and resid 11 and name c ) (segid "B   " and resid 12 and name n ) (segid "B   " and resid 12 and name ca ) (segid "B   " and resid 12 and name c ) 1.0 -63.600 30 2
assign (segid "B   " and resid 12 and name n ) (segid "B   " and resid 12 and name ca ) (segid "B   " and resid 12 and name c ) (segid "B   " and resid 13 and name n ) 1.0 -43.950 30 2
assign (segid "B   " and resid 12 and name c ) (segid "B   " and resid 13 and name n ) (segid "B   " and resid 13 and name ca ) (segid "B   " and resid 13 and name c ) 1.0 -64.370 30 2
assign (segid "B   " and resid 13 and name n ) (segid "B   " and resid 13 and name ca ) (segid "B   " and resid 13 and name c ) (segid "B   " and resid 14 and name n ) 1.0 -40.570 30 2
assign (segid "B   " and resid 13 and name c ) (segid "B   " and resid 14 and name n ) (segid "B   " and resid 14 and name ca ) (segid "B   " and resid 14 and name c ) 1.0 -62.210 30 2
assign (segid "B   " and resid 14 and name n ) (segid "B   " and resid 14 and name ca ) (segid "B   " and resid 14 and name c ) (segid "B   " and resid 15 and name n ) 1.0 -46.540 30 2
assign (segid "B   " and resid 14 and name c ) (segid "B   " and resid 15 and name n ) (segid "B   " and resid 15 and name ca ) (segid "B   " and resid 15 and name c ) 1.0 -63.260 30 2
assign (segid "B   " and resid 15 and name n ) (segid "B   " and resid 15 and name ca ) (segid "B   " and resid 15 and name c ) (segid "B   " and resid 16 and name n ) 1.0 -41.400 30 2
assign (segid "B   " and resid 15 and name c ) (segid "B   " and resid 16 and name n ) (segid "B   " and resid 16 and name ca ) (segid "B   " and resid 16 and name c ) 1.0 -65.180 30 2
assign (segid "B   " and resid 16 and name n ) (segid "B   " and resid 16 and name ca ) (segid "B   " and resid 16 and name c ) (segid "B   " and resid 17 and name n ) 1.0 -42.720 30 2
assign (segid "B   " and resid 16 and name c ) (segid "B   " and resid 17 and name n ) (segid "B   " and resid 17 and name ca ) (segid "B   " and resid 17 and name c ) 1.0 -69.870 30 2
assign (segid "B   " and resid 17 and name n ) (segid "B   " and resid 17 and name ca ) (segid "B   " and resid 17 and name c ) (segid "B   " and resid 18 and name n ) 1.0 -38.240 30 2
assign (segid "B   " and resid 17 and name c ) (segid "B   " and resid 18 and name n ) (segid "B   " and resid 18 and name ca ) (segid "B   " and resid 18 and name c ) 1.0 -65.190 30 2
assign (segid "B   " and resid 18 and name n ) (segid "B   " and resid 18 and name ca ) (segid "B   " and resid 18 and name c ) (segid "B   " and resid 19 and name n ) 1.0 -39.270 30 2
assign (segid "B   " and resid 18 and name c ) (segid "B   " and resid 19 and name n ) (segid "B   " and resid 19 and name ca ) (segid "B   " and resid 19 and name c ) 1.0 -68.420 30 2
assign (segid "B   " and resid 19 and name n ) (segid "B   " and resid 19 and name ca ) (segid "B   " and resid 19 and name c ) (segid "B   " and resid 20 and name n ) 1.0 -21.000 30 2
assign (segid "B   " and resid 19 and name c ) (segid "B   " and resid 20 and name n ) (segid "B   " and resid 20 and name ca ) (segid "B   " and resid 20 and name c ) 1.0 -92.050 30 2
assign (segid "B   " and resid 20 and name n ) (segid "B   " and resid 20 and name ca ) (segid "B   " and resid 20 and name c ) (segid "B   " and resid 21 and name n ) 1.0 -1.070 30 2
assign (segid "B   " and resid 20 and name c ) (segid "B   " and resid 21 and name n ) (segid "B   " and resid 21 and name ca ) (segid "B   " and resid 21 and name c ) 1.0 83.670 30 2
assign (segid "B   " and resid 21 and name n ) (segid "B   " and resid 21 and name ca ) (segid "B   " and resid 21 and name c ) (segid "B   " and resid 22 and name n ) 1.0 16.260 30 2
assign (segid "B   " and resid 21 and name c ) (segid "B   " and resid 22 and name n ) (segid "B   " and resid 22 and name ca ) (segid "B   " and resid 22 and name c ) 1.0 -106.530 30 2
assign (segid "B   " and resid 22 and name n ) (segid "B   " and resid 22 and name ca ) (segid "B   " and resid 22 and name c ) (segid "B   " and resid 23 and name n ) 1.0 154.230 30 2
assign (segid "B   " and resid 23 and name c ) (segid "B   " and resid 24 and name n ) (segid "B   " and resid 24 and name ca ) (segid "B   " and resid 24 and name c ) 1.0 -90.190 30 2
assign (segid "B   " and resid 24 and name n ) (segid "B   " and resid 24 and name ca ) (segid "B   " and resid 24 and name c ) (segid "B   " and resid 25 and name n ) 1.0 147.980 30 2
assign (segid "B   " and resid 27 and name c ) (segid "B   " and resid 28 and name n ) (segid "B   " and resid 28 and name ca ) (segid "B   " and resid 28 and name c ) 1.0 -65.380 30 2
assign (segid "B   " and resid 28 and name n ) (segid "B   " and resid 28 and name ca ) (segid "B   " and resid 28 and name c ) (segid "B   " and resid 29 and name n ) 1.0 -34.340 30 2
assign (segid "B   " and resid 28 and name c ) (segid "B   " and resid 29 and name n ) (segid "B   " and resid 29 and name ca ) (segid "B   " and resid 29 and name c ) 1.0 -62.410 30 2
assign (segid "B   " and resid 29 and name n ) (segid "B   " and resid 29 and name ca ) (segid "B   " and resid 29 and name c ) (segid "B   " and resid 30 and name n ) 1.0 -40.820 30 2
assign (segid "B   " and resid 29 and name c ) (segid "B   " and resid 30 and name n ) (segid "B   " and resid 30 and name ca ) (segid "B   " and resid 30 and name c ) 1.0 -63.570 30 2
assign (segid "B   " and resid 30 and name n ) (segid "B   " and resid 30 and name ca ) (segid "B   " and resid 30 and name c ) (segid "B   " and resid 31 and name n ) 1.0 -41.260 30 2
assign (segid "B   " and resid 30 and name c ) (segid "B   " and resid 31 and name n ) (segid "B   " and resid 31 and name ca ) (segid "B   " and resid 31 and name c ) 1.0 -64.160 30 2
assign (segid "B   " and resid 31 and name n ) (segid "B   " and resid 31 and name ca ) (segid "B   " and resid 31 and name c ) (segid "B   " and resid 32 and name n ) 1.0 -35.730 30 2
assign (segid "B   " and resid 31 and name c ) (segid "B   " and resid 32 and name n ) (segid "B   " and resid 32 and name ca ) (segid "B   " and resid 32 and name c ) 1.0 -63.480 30 2
assign (segid "B   " and resid 32 and name n ) (segid "B   " and resid 32 and name ca ) (segid "B   " and resid 32 and name c ) (segid "B   " and resid 33 and name n ) 1.0 -45.590 30 2
assign (segid "B   " and resid 32 and name c ) (segid "B   " and resid 33 and name n ) (segid "B   " and resid 33 and name ca ) (segid "B   " and resid 33 and name c ) 1.0 -61.820 30 2
assign (segid "B   " and resid 33 and name n ) (segid "B   " and resid 33 and name ca ) (segid "B   " and resid 33 and name c ) (segid "B   " and resid 34 and name n ) 1.0 -39.160 30 2
assign (segid "B   " and resid 33 and name c ) (segid "B   " and resid 34 and name n ) (segid "B   " and resid 34 and name ca ) (segid "B   " and resid 34 and name c ) 1.0 -63.570 30 2
assign (segid "B   " and resid 34 and name n ) (segid "B   " and resid 34 and name ca ) (segid "B   " and resid 34 and name c ) (segid "B   " and resid 35 and name n ) 1.0 -41.300 30 2
assign (segid "B   " and resid 34 and name c ) (segid "B   " and resid 35 and name n ) (segid "B   " and resid 35 and name ca ) (segid "B   " and resid 35 and name c ) 1.0 -68.850 30 2
assign (segid "B   " and resid 35 and name n ) (segid "B   " and resid 35 and name ca ) (segid "B   " and resid 35 and name c ) (segid "B   " and resid 36 and name n ) 1.0 -33.020 30 2
assign (segid "B   " and resid 35 and name c ) (segid "B   " and resid 36 and name n ) (segid "B   " and resid 36 and name ca ) (segid "B   " and resid 36 and name c ) 1.0 -99.210 30 2
assign (segid "B   " and resid 36 and name n ) (segid "B   " and resid 36 and name ca ) (segid "B   " and resid 36 and name c ) (segid "B   " and resid 37 and name n ) 1.0 6.470 30 2
assign (segid "B   " and resid 39 and name c ) (segid "B   " and resid 40 and name n ) (segid "B   " and resid 40 and name ca ) (segid "B   " and resid 40 and name c ) 1.0 -58.730 30 2
assign (segid "B   " and resid 40 and name n ) (segid "B   " and resid 40 and name ca ) (segid "B   " and resid 40 and name c ) (segid "B   " and resid 41 and name n ) 1.0 -34.270 30 2
assign (segid "B   " and resid 40 and name c ) (segid "B   " and resid 41 and name n ) (segid "B   " and resid 41 and name ca ) (segid "B   " and resid 41 and name c ) 1.0 -64.020 30 2
assign (segid "B   " and resid 41 and name n ) (segid "B   " and resid 41 and name ca ) (segid "B   " and resid 41 and name c ) (segid "B   " and resid 42 and name n ) 1.0 -38.210 30 2
assign (segid "B   " and resid 41 and name c ) (segid "B   " and resid 42 and name n ) (segid "B   " and resid 42 and name ca ) (segid "B   " and resid 42 and name c ) 1.0 -68.800 30 2
assign (segid "B   " and resid 42 and name n ) (segid "B   " and resid 42 and name ca ) (segid "B   " and resid 42 and name c ) (segid "B   " and resid 43 and name n ) 1.0 -39.470 30 2
assign (segid "B   " and resid 42 and name c ) (segid "B   " and resid 43 and name n ) (segid "B   " and resid 43 and name ca ) (segid "B   " and resid 43 and name c ) 1.0 -61.850 30 2
assign (segid "B   " and resid 43 and name n ) (segid "B   " and resid 43 and name ca ) (segid "B   " and resid 43 and name c ) (segid "B   " and resid 44 and name n ) 1.0 -43.240 30 2
assign (segid "B   " and resid 43 and name c ) (segid "B   " and resid 44 and name n ) (segid "B   " and resid 44 and name ca ) (segid "B   " and resid 44 and name c ) 1.0 -61.460 30 2
assign (segid "B   " and resid 44 and name n ) (segid "B   " and resid 44 and name ca ) (segid "B   " and resid 44 and name c ) (segid "B   " and resid 45 and name n ) 1.0 -39.770 30 2
assign (segid "B   " and resid 44 and name c ) (segid "B   " and resid 45 and name n ) (segid "B   " and resid 45 and name ca ) (segid "B   " and resid 45 and name c ) 1.0 -65.530 30 2
assign (segid "B   " and resid 45 and name n ) (segid "B   " and resid 45 and name ca ) (segid "B   " and resid 45 and name c ) (segid "B   " and resid 46 and name n ) 1.0 -38.030 30 2
assign (segid "B   " and resid 45 and name c ) (segid "B   " and resid 46 and name n ) (segid "B   " and resid 46 and name ca ) (segid "B   " and resid 46 and name c ) 1.0 -65.430 30 2
assign (segid "B   " and resid 46 and name n ) (segid "B   " and resid 46 and name ca ) (segid "B   " and resid 46 and name c ) (segid "B   " and resid 47 and name n ) 1.0 -36.310 30 2
assign (segid "B   " and resid 46 and name c ) (segid "B   " and resid 47 and name n ) (segid "B   " and resid 47 and name ca ) (segid "B   " and resid 47 and name c ) 1.0 -95.100 30 2
assign (segid "B   " and resid 47 and name n ) (segid "B   " and resid 47 and name ca ) (segid "B   " and resid 47 and name c ) (segid "B   " and resid 48 and name n ) 1.0 8.320 30 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1  18.156  19.216  -2.791
    2    H2   GLY   1           2HT      GLY   1  18.583  19.813  -4.315
    3    H3   GLY   1           3HT      GLY   1  19.780  19.472  -3.176
    4    HA2  GLY   1           1HA      GLY   1  17.972  17.432  -4.341
    5    HA3  GLY   1           2HA      GLY   1  19.586  17.775  -4.948
    6    H    SER   2           H        SER   2  21.080  16.425  -4.261
    7    HA   SER   2           HA       SER   2  20.699  15.118  -1.659
    8    HB2  SER   2           2HB      SER   2  22.472  14.135  -3.893
    9    HB3  SER   2           1HB      SER   2  21.903  13.236  -2.487
   10    HG   SER   2           HG       SER   2  20.727  12.724  -4.388
   11    HA   PRO   3           HA       PRO   3  24.329  17.657  -0.746
   12    HB2  PRO   3           2HB      PRO   3  23.997  17.718   1.919
   13    HB3  PRO   3           1HB      PRO   3  22.990  18.695   0.842
   14    HG2  PRO   3           2HG      PRO   3  22.367  16.092   2.185
   15    HG3  PRO   3           1HG      PRO   3  21.338  17.522   1.983
   16    HD2  PRO   3           2HD      PRO   3  21.194  15.290   0.389
   17    HD3  PRO   3           1HD      PRO   3  20.699  16.912  -0.131
   18    HA   PRO   4           HA       PRO   4  27.271  14.532   0.381
   19    HB2  PRO   4           2HB      PRO   4  28.728  16.461   2.050
   20    HB3  PRO   4           1HB      PRO   4  29.244  15.652   0.569
   21    HG2  PRO   4           2HG      PRO   4  28.672  18.277   0.627
   22    HG3  PRO   4           1HG      PRO   4  28.324  17.272  -0.790
   23    HD2  PRO   4           2HD      PRO   4  26.467  18.243   1.350
   24    HD3  PRO   4           1HD      PRO   4  26.210  18.146  -0.406
   25    H    GLU   5           H        GLU   5  25.359  16.092   2.662
   26    HA   GLU   5           HA       GLU   5  26.393  14.714   4.986
   27    HB2  GLU   5           2HB      GLU   5  23.753  16.148   4.906
   28    HB3  GLU   5           1HB      GLU   5  24.863  15.961   6.253
   29    HG2  GLU   5           2HG      GLU   5  25.176  17.764   3.871
   30    HG3  GLU   5           1HG      GLU   5  24.908  18.230   5.548
   31    H    ALA   6           H        ALA   6  24.435  13.941   2.408
   32    HA   ALA   6           HA       ALA   6  22.679  12.147   3.891
   33    HB1  ALA   6           1HB      ALA   6  22.844  12.699   0.928
   34    HB2  ALA   6           2HB      ALA   6  21.718  13.454   2.058
   35    HB3  ALA   6           3HB      ALA   6  21.613  11.725   1.734
   36    H    ASP   7           H        ASP   7  23.014  10.016   4.074
   37    HA   ASP   7           HA       ASP   7  25.509   8.896   3.319
   38    HB2  ASP   7           2HB      ASP   7  24.109   8.214   5.320
   39    HB3  ASP   7           1HB      ASP   7  23.054   7.367   4.191
   40    HA   PRO   8           HA       PRO   8  24.530   7.833  -0.882
   41    HB2  PRO   8           2HB      PRO   8  26.575   6.037  -1.236
   42    HB3  PRO   8           1HB      PRO   8  26.757   7.789  -1.345
   43    HG2  PRO   8           2HG      PRO   8  27.372   5.962   0.942
   44    HG3  PRO   8           1HG      PRO   8  28.303   7.340   0.326
   45    HD2  PRO   8           2HD      PRO   8  26.772   7.538   2.524
   46    HD3  PRO   8           1HD      PRO   8  26.944   8.890   1.386
   47    H    ARG   9           H        ARG   9  24.831   5.469   1.689
   48    HA   ARG   9           HA       ARG   9  23.718   3.346   0.042
   49    HB2  ARG   9           2HB      ARG   9  24.358   3.401   2.997
   50    HB3  ARG   9           1HB      ARG   9  23.873   1.979   2.083
   51    HG2  ARG   9           2HG      ARG   9  25.893   1.829   0.987
   52    HG3  ARG   9           1HG      ARG   9  26.271   3.538   1.240
   53    HD2  ARG   9           2HD      ARG   9  26.159   1.460   3.423
   54    HD3  ARG   9           1HD      ARG   9  27.639   1.998   2.629
   55    HE   ARG   9           HE       ARG   9  26.201   4.214   3.664
   56   HH11  ARG   9          1HH1      ARG   9  28.166   1.504   4.698
   57   HH12  ARG   9          2HH1      ARG   9  28.783   2.325   6.097
   58   HH21  ARG   9          1HH2      ARG   9  27.015   5.298   5.499
   59   HH22  ARG   9          2HH2      ARG   9  28.141   4.478   6.548
   60    H    LEU  10           H        LEU  10  22.706   5.690   2.383
   61    HA   LEU  10           HA       LEU  10  20.221   4.523   3.080
   62    HB2  LEU  10           2HB      LEU  10  21.322   6.268   4.421
   63    HB3  LEU  10           1HB      LEU  10  21.078   7.418   3.123
   64    HG   LEU  10           HG       LEU  10  18.605   7.118   3.418
   65   HD11  LEU  10          1HD1      LEU  10  17.840   6.147   5.545
   66   HD12  LEU  10          2HD1      LEU  10  19.485   5.601   5.872
   67   HD13  LEU  10          3HD1      LEU  10  18.596   4.951   4.494
   68   HD21  LEU  10          3HD2      LEU  10  20.157   8.094   5.814
   69   HD22  LEU  10          1HD2      LEU  10  18.486   8.505   5.428
   70   HD23  LEU  10          2HD2      LEU  10  19.791   9.028   4.363
   71    H    ILE  11           H        ILE  11  21.183   6.881   0.613
   72    HA   ILE  11           HA       ILE  11  18.519   7.287  -0.333
   73    HB   ILE  11           HB       ILE  11  20.296   8.975  -0.642
   74   HG12  ILE  11          2HG1      ILE  11  19.227   8.017  -3.301
   75   HG13  ILE  11          1HG1      ILE  11  18.247   8.851  -2.101
   76   HG21  ILE  11          1HG2      ILE  11  21.959   8.686  -2.432
   77   HG22  ILE  11          2HG2      ILE  11  21.428   7.018  -2.634
   78   HG23  ILE  11          3HG2      ILE  11  22.174   7.527  -1.121
   79   HD11  ILE  11          3HD1      ILE  11  19.674  10.809  -2.279
   80   HD12  ILE  11          1HD1      ILE  11  19.021  10.356  -3.853
   81   HD13  ILE  11          2HD1      ILE  11  20.694   9.972  -3.448
   82    H    GLU  12           H        GLU  12  21.026   4.976  -0.994
   83    HA   GLU  12           HA       GLU  12  20.071   4.100  -3.518
   84    HB2  GLU  12           2HB      GLU  12  22.030   3.128  -1.514
   85    HB3  GLU  12           1HB      GLU  12  21.400   1.941  -2.651
   86    HG2  GLU  12           2HG      GLU  12  22.594   4.562  -3.508
   87    HG3  GLU  12           1HG      GLU  12  23.534   3.082  -3.323
   88    H    SER  13           H        SER  13  18.856   3.695  -0.381
   89    HA   SER  13           HA       SER  13  17.697   1.110  -0.696
   90    HB2  SER  13           2HB      SER  13  16.828   3.342   1.158
   91    HB3  SER  13           1HB      SER  13  16.442   1.629   1.322
   92    HG   SER  13           HG       SER  13  19.136   2.188   1.130
   93    H    LEU  14           H        LEU  14  16.865   4.300  -1.709
   94    HA   LEU  14           HA       LEU  14  14.087   3.715  -2.217
   95    HB2  LEU  14           2HB      LEU  14  15.847   6.047  -2.979
   96    HB3  LEU  14           1HB      LEU  14  14.159   5.931  -3.437
   97    HG   LEU  14           HG       LEU  14  13.966   5.573  -0.755
   98   HD11  LEU  14          1HD1      LEU  14  15.400   7.242   0.323
   99   HD12  LEU  14          2HD1      LEU  14  16.246   7.495  -1.205
  100   HD13  LEU  14          3HD1      LEU  14  16.344   5.934  -0.388
  101   HD21  LEU  14          3HD2      LEU  14  14.018   8.203  -2.228
  102   HD22  LEU  14          1HD2      LEU  14  13.240   7.903  -0.674
  103   HD23  LEU  14          2HD2      LEU  14  12.648   7.100  -2.128
  104    H    SER  15           H        SER  15  17.026   4.166  -4.145
  105    HA   SER  15           HA       SER  15  15.863   3.738  -6.669
  106    HB2  SER  15           2HB      SER  15  18.521   2.902  -6.841
  107    HB3  SER  15           1HB      SER  15  17.914   4.533  -7.132
  108    HG   SER  15           HG       SER  15  19.654   4.101  -5.431
  109    H    GLN  16           H        GLN  16  17.123   1.550  -4.240
  110    HA   GLN  16           HA       GLN  16  17.313  -0.772  -5.811
  111    HB2  GLN  16           2HB      GLN  16  18.324  -0.567  -3.581
  112    HB3  GLN  16           1HB      GLN  16  16.722  -0.522  -2.857
  113    HG2  GLN  16           2HG      GLN  16  17.642  -2.710  -2.581
  114    HG3  GLN  16           1HG      GLN  16  16.310  -2.799  -3.729
  115   HE21  GLN  16          1HE2      GLN  16  16.752  -3.213  -5.910
  116   HE22  GLN  16          2HE2      GLN  16  18.283  -3.826  -6.431
  117    H    MET  17           H        MET  17  14.638   0.688  -4.074
  118    HA   MET  17           HA       MET  17  12.828  -1.472  -4.322
  119    HB2  MET  17           2HB      MET  17  12.362   1.491  -3.949
  120    HB3  MET  17           1HB      MET  17  11.081   0.288  -3.888
  121    HG2  MET  17           2HG      MET  17  13.481   0.297  -2.079
  122    HG3  MET  17           1HG      MET  17  11.926   1.014  -1.669
  123    HE1  MET  17           3HE      MET  17   9.937  -0.201  -0.810
  124    HE2  MET  17           1HE      MET  17   9.601  -1.915  -1.045
  125    HE3  MET  17           2HE      MET  17   9.657  -0.827  -2.433
  126    H    LEU  18           H        LEU  18  13.475   1.377  -6.310
  127    HA   LEU  18           HA       LEU  18  11.378   1.024  -8.141
  128    HB2  LEU  18           2HB      LEU  18  12.889   3.051  -7.814
  129    HB3  LEU  18           1HB      LEU  18  14.059   2.217  -8.817
  130    HG   LEU  18           HG       LEU  18  12.426   2.194 -10.673
  131   HD11  LEU  18          1HD1      LEU  18  10.729   3.749  -8.736
  132   HD12  LEU  18          2HD1      LEU  18  10.349   2.204  -9.496
  133   HD13  LEU  18          3HD1      LEU  18  10.431   3.670 -10.472
  134   HD21  LEU  18          3HD2      LEU  18  14.054   3.991 -10.533
  135   HD22  LEU  18          1HD2      LEU  18  12.971   4.914  -9.490
  136   HD23  LEU  18          2HD2      LEU  18  12.524   4.597 -11.168
  137    H    SER  19           H        SER  19  14.680  -0.244  -8.108
  138    HA   SER  19           HA       SER  19  14.506  -1.477 -10.674
  139    HB2  SER  19           2HB      SER  19  16.438  -1.510  -8.411
  140    HB3  SER  19           1HB      SER  19  16.507  -2.850  -9.555
  141    HG   SER  19           HG       SER  19  17.445  -1.563 -10.907
  142    H    MET  20           H        MET  20  13.432  -2.352  -7.529
  143    HA   MET  20           HA       MET  20  13.371  -5.181  -7.977
  144    HB2  MET  20           2HB      MET  20  12.684  -3.354  -5.809
  145    HB3  MET  20           1HB      MET  20  11.523  -4.661  -5.979
  146    HG2  MET  20           2HG      MET  20  14.494  -4.971  -5.616
  147    HG3  MET  20           1HG      MET  20  13.258  -5.233  -4.388
  148    HE1  MET  20           3HE      MET  20  10.935  -6.754  -5.920
  149    HE2  MET  20           1HE      MET  20  11.584  -7.226  -4.347
  150    HE3  MET  20           2HE      MET  20  11.424  -8.423  -5.632
  151    H    GLY  21           H        GLY  21  11.392  -2.539  -8.827
  152    HA2  GLY  21           2HA      GLY  21   9.739  -2.909 -10.567
  153    HA3  GLY  21           1HA      GLY  21   9.336  -4.429  -9.775
  154    H    PHE  22           H        PHE  22   9.951  -1.767  -7.729
  155    HA   PHE  22           HA       PHE  22   7.111  -1.640  -7.043
  156    HB2  PHE  22           2HB      PHE  22   9.416  -1.788  -5.484
  157    HB3  PHE  22           1HB      PHE  22   8.930  -0.104  -5.357
  158    HD1  PHE  22           2HD      PHE  22   6.568   0.405  -4.588
  159    HD2  PHE  22           1HD      PHE  22   8.349  -3.445  -4.259
  160    HE1  PHE  22           2HE      PHE  22   4.908  -0.211  -2.884
  161    HE2  PHE  22           1HE      PHE  22   6.694  -4.070  -2.550
  162    HZ   PHE  22           HZ       PHE  22   4.969  -2.454  -1.859
  163    H    SER  23           H        SER  23   5.941   0.014  -7.701
  164    HA   SER  23           HA       SER  23   7.244   2.594  -8.158
  165    HB2  SER  23           2HB      SER  23   5.466   2.699 -10.140
  166    HB3  SER  23           1HB      SER  23   7.075   2.010 -10.369
  167    HG   SER  23           HG       SER  23   4.667   0.592  -9.844
  168    H    ASP  24           H        ASP  24   5.813   4.415  -8.021
  169    HA   ASP  24           HA       ASP  24   3.312   3.826  -6.577
  170    HB2  ASP  24           2HB      ASP  24   3.677   5.953  -5.329
  171    HB3  ASP  24           1HB      ASP  24   4.891   4.723  -4.997
  172    H    GLU  25           H        GLU  25   1.525   5.049  -7.030
  173    HA   GLU  25           HA       GLU  25   1.688   6.572  -9.526
  174    HB2  GLU  25           2HB      GLU  25  -0.991   6.378  -8.951
  175    HB3  GLU  25           1HB      GLU  25  -0.096   5.293 -10.003
  176    HG2  GLU  25           2HG      GLU  25  -1.416   3.998  -8.476
  177    HG3  GLU  25           1HG      GLU  25   0.289   3.790  -8.078
  178    H    GLY  26           H        GLY  26   0.252   6.766  -6.281
  179    HA2  GLY  26           2HA      GLY  26  -0.134   9.659  -6.615
  180    HA3  GLY  26           1HA      GLY  26  -0.773   8.666  -5.312
  181    H    GLY  27           H        GLY  27   2.194   7.564  -5.540
  182    HA2  GLY  27           2HA      GLY  27   4.294   8.253  -4.717
  183    HA3  GLY  27           1HA      GLY  27   3.541   9.709  -4.081
  184    H    TRP  28           H        TRP  28   2.166   6.535  -3.541
  185    HA   TRP  28           HA       TRP  28   2.239   6.952  -0.722
  186    HB2  TRP  28           2HB      TRP  28   1.031   4.923  -0.511
  187    HB3  TRP  28           1HB      TRP  28   0.425   5.711  -1.960
  188    HD1  TRP  28           HD       TRP  28   1.489   4.641  -4.354
  189    HE1  TRP  28           1HE      TRP  28   1.928   2.167  -4.907
  190    HE3  TRP  28           3HE      TRP  28   1.613   2.755   0.394
  191    HZ2  TRP  28           2HZ      TRP  28   2.271  -0.270  -3.511
  192    HZ3  TRP  28           3HZ      TRP  28   1.998   0.349   0.700
  193    HH2  TRP  28           HH       TRP  28   2.322  -1.134  -1.214
  194    H    LEU  29           H        LEU  29   4.378   5.475  -2.959
  195    HA   LEU  29           HA       LEU  29   5.655   3.616  -1.282
  196    HB2  LEU  29           2HB      LEU  29   5.981   3.594  -3.679
  197    HB3  LEU  29           1HB      LEU  29   6.718   5.181  -3.633
  198    HG   LEU  29           HG       LEU  29   8.625   4.270  -2.381
  199   HD11  LEU  29          1HD1      LEU  29   8.795   1.723  -2.354
  200   HD12  LEU  29          2HD1      LEU  29   7.042   1.727  -2.559
  201   HD13  LEU  29          3HD1      LEU  29   7.767   2.489  -1.142
  202   HD21  LEU  29          3HD2      LEU  29   8.038   2.684  -4.879
  203   HD22  LEU  29          1HD2      LEU  29   9.626   3.034  -4.194
  204   HD23  LEU  29          2HD2      LEU  29   8.641   4.341  -4.847
  205    H    THR  30           H        THR  30   6.575   6.990  -2.052
  206    HA   THR  30           HA       THR  30   8.766   7.049  -0.286
  207    HB   THR  30           HB       THR  30   8.608   8.697  -2.046
  208    HG1  THR  30           1HG      THR  30   9.199   9.246   0.449
  209   HG21  THR  30          3HG2      THR  30   6.257   9.889  -0.577
  210   HG22  THR  30          1HG2      THR  30   6.125   8.908  -2.037
  211   HG23  THR  30          2HG2      THR  30   6.970  10.455  -2.088
  212    H    ARG  31           H        ARG  31   5.349   7.538   0.221
  213    HA   ARG  31           HA       ARG  31   5.585   8.780   2.784
  214    HB2  ARG  31           2HB      ARG  31   3.240   7.255   1.623
  215    HB3  ARG  31           1HB      ARG  31   3.187   8.333   3.010
  216    HG2  ARG  31           2HG      ARG  31   4.116   9.358   0.364
  217    HG3  ARG  31           1HG      ARG  31   2.392   9.172   0.687
  218    HD2  ARG  31           2HD      ARG  31   4.164  10.638   2.610
  219    HD3  ARG  31           1HD      ARG  31   3.532  11.445   1.175
  220    HE   ARG  31           HE       ARG  31   1.714  10.137   3.089
  221   HH11  ARG  31          1HH1      ARG  31   2.734  12.999   1.333
  222   HH12  ARG  31          2HH1      ARG  31   1.374  13.941   1.848
  223   HH21  ARG  31          1HH2      ARG  31  -0.079  11.380   3.732
  224   HH22  ARG  31          2HH2      ARG  31  -0.214  13.031   3.207
  225    H    LEU  32           H        LEU  32   5.094   5.492   1.617
  226    HA   LEU  32           HA       LEU  32   4.773   4.234   4.120
  227    HB2  LEU  32           2HB      LEU  32   4.420   3.417   1.626
  228    HB3  LEU  32           1HB      LEU  32   6.061   2.826   1.817
  229    HG   LEU  32           HG       LEU  32   5.151   1.670   3.952
  230   HD11  LEU  32          1HD1      LEU  32   3.021   2.766   4.088
  231   HD12  LEU  32          2HD1      LEU  32   2.753   1.061   3.718
  232   HD13  LEU  32          3HD1      LEU  32   2.611   2.274   2.445
  233   HD21  LEU  32          3HD2      LEU  32   4.516  -0.277   2.656
  234   HD22  LEU  32          1HD2      LEU  32   5.895   0.529   1.907
  235   HD23  LEU  32          2HD2      LEU  32   4.282   0.727   1.222
  236    H    LEU  33           H        LEU  33   7.577   5.134   2.230
  237    HA   LEU  33           HA       LEU  33   9.494   3.642   3.715
  238    HB2  LEU  33           2HB      LEU  33   9.777   6.063   1.949
  239    HB3  LEU  33           1HB      LEU  33  11.130   5.161   2.604
  240    HG   LEU  33           HG       LEU  33   9.047   4.033   0.726
  241   HD11  LEU  33          1HD1      LEU  33  10.823   4.101  -0.956
  242   HD12  LEU  33          2HD1      LEU  33  11.879   4.923   0.193
  243   HD13  LEU  33          3HD1      LEU  33  10.410   5.715  -0.378
  244   HD21  LEU  33          3HD2      LEU  33  10.020   2.328   2.165
  245   HD22  LEU  33          1HD2      LEU  33  11.643   2.876   1.748
  246   HD23  LEU  33          2HD2      LEU  33  10.612   2.150   0.514
  247    H    GLN  34           H        GLN  34   7.759   6.479   4.378
  248    HA   GLN  34           HA       GLN  34   9.781   7.465   6.240
  249    HB2  GLN  34           2HB      GLN  34   7.191   8.621   5.232
  250    HB3  GLN  34           1HB      GLN  34   8.080   9.336   6.571
  251    HG2  GLN  34           2HG      GLN  34   9.118   8.938   3.769
  252    HG3  GLN  34           1HG      GLN  34   8.580  10.460   4.473
  253   HE21  GLN  34          1HE2      GLN  34  11.064   8.021   4.484
  254   HE22  GLN  34          2HE2      GLN  34  12.258   8.959   5.313
  255    H    THR  35           H        THR  35   6.896   5.609   6.204
  256    HA   THR  35           HA       THR  35   6.499   5.996   9.073
  257    HB   THR  35           HB       THR  35   4.472   4.511   8.688
  258    HG1  THR  35           1HG      THR  35   3.827   4.149   6.598
  259   HG21  THR  35          3HG2      THR  35   4.706   7.170   7.287
  260   HG22  THR  35          1HG2      THR  35   4.194   6.872   8.947
  261   HG23  THR  35          2HG2      THR  35   3.177   6.351   7.603
  262    H    LYS  36           H        LYS  36   7.171   3.447   6.708
  263    HA   LYS  36           HA       LYS  36   7.780   1.609   8.918
  264    HB2  LYS  36           2HB      LYS  36   6.751   1.299   6.183
  265    HB3  LYS  36           1HB      LYS  36   7.947   0.097   6.650
  266    HG2  LYS  36           2HG      LYS  36   6.596  -0.834   8.243
  267    HG3  LYS  36           1HG      LYS  36   5.727   0.675   8.539
  268    HD2  LYS  36           2HD      LYS  36   5.475  -0.776   5.928
  269    HD3  LYS  36           1HD      LYS  36   4.496  -1.236   7.324
  270    HE2  LYS  36           2HE      LYS  36   4.633   1.559   6.208
  271    HE3  LYS  36           1HE      LYS  36   3.404   0.379   5.754
  272    HZ1  LYS  36           3HZ      LYS  36   2.535   0.379   7.922
  273    HZ2  LYS  36           1HZ      LYS  36   2.788   2.013   7.554
  274    HZ3  LYS  36           2HZ      LYS  36   3.868   1.188   8.564
  275    H    ASN  37           H        ASN  37   9.432   3.844   7.506
  276    HA   ASN  37           HA       ASN  37  11.635   4.283   7.176
  277    HB2  ASN  37           2HB      ASN  37  11.856   2.757   9.216
  278    HB3  ASN  37           1HB      ASN  37  12.256   1.470   8.084
  279   HD21  ASN  37          1HD2      ASN  37  14.332   1.147   8.654
  280   HD22  ASN  37          2HD2      ASN  37  15.584   2.333   8.480
  281    H    TYR  38           H        TYR  38  13.713   3.134   6.066
  282    HA   TYR  38           HA       TYR  38  12.772   2.380   3.421
  283    HB2  TYR  38           2HB      TYR  38  15.564   2.940   4.445
  284    HB3  TYR  38           1HB      TYR  38  15.139   2.661   2.763
  285    HD1  TYR  38           1HD      TYR  38  13.428   4.299   1.720
  286    HD2  TYR  38           2HD      TYR  38  15.579   5.101   5.299
  287    HE1  TYR  38           1HE      TYR  38  13.014   6.705   1.422
  288    HE2  TYR  38           2HE      TYR  38  15.181   7.506   5.007
  289    HH   TYR  38           HH       TYR  38  14.475   9.096   3.578
  290    H    ASP  39           H        ASP  39  12.618   0.543   5.745
  291    HA   ASP  39           HA       ASP  39  14.599  -1.486   5.324
  292    HB2  ASP  39           2HB      ASP  39  12.358  -1.032   7.168
  293    HB3  ASP  39           1HB      ASP  39  12.597  -2.718   6.727
  294    H    ILE  40           H        ILE  40  14.538  -2.241   3.298
  295    HA   ILE  40           HA       ILE  40  12.304  -2.751   1.714
  296    HB   ILE  40           HB       ILE  40  14.936  -4.232   1.635
  297   HG12  ILE  40          2HG1      ILE  40  14.176  -1.726   0.123
  298   HG13  ILE  40          1HG1      ILE  40  15.107  -1.709   1.615
  299   HG21  ILE  40          1HG2      ILE  40  13.191  -5.268   0.278
  300   HG22  ILE  40          2HG2      ILE  40  14.433  -4.538  -0.740
  301   HG23  ILE  40          3HG2      ILE  40  12.884  -3.725  -0.520
  302   HD11  ILE  40          3HD1      ILE  40  15.928  -3.072  -0.939
  303   HD12  ILE  40          1HD1      ILE  40  16.877  -2.986   0.545
  304   HD13  ILE  40          2HD1      ILE  40  16.524  -1.516  -0.365
  305    H    GLY  41           H        GLY  41  14.000  -4.830   4.013
  306    HA2  GLY  41           2HA      GLY  41  12.660  -7.236   3.400
  307    HA3  GLY  41           1HA      GLY  41  13.479  -6.876   4.911
  308    H    ALA  42           H        ALA  42  11.680  -4.477   5.278
  309    HA   ALA  42           HA       ALA  42   9.511  -5.957   6.545
  310    HB1  ALA  42           1HB      ALA  42   9.028  -3.870   7.716
  311    HB2  ALA  42           2HB      ALA  42  10.238  -3.034   6.743
  312    HB3  ALA  42           3HB      ALA  42  10.734  -4.297   7.870
  313    H    ALA  43           H        ALA  43   9.989  -3.363   4.192
  314    HA   ALA  43           HA       ALA  43   7.285  -2.762   3.723
  315    HB1  ALA  43           1HB      ALA  43   9.619  -2.479   1.839
  316    HB2  ALA  43           2HB      ALA  43   9.134  -1.302   3.059
  317    HB3  ALA  43           3HB      ALA  43   8.064  -1.658   1.702
  318    H    LEU  44           H        LEU  44   9.445  -5.115   2.205
  319    HA   LEU  44           HA       LEU  44   7.717  -5.883   0.114
  320    HB2  LEU  44           2HB      LEU  44  10.251  -6.400   0.577
  321    HB3  LEU  44           1HB      LEU  44   9.615  -7.818   1.385
  322    HG   LEU  44           HG       LEU  44   8.426  -8.380  -0.776
  323   HD11  LEU  44          1HD1      LEU  44   9.365  -7.360  -2.816
  324   HD12  LEU  44          2HD1      LEU  44  10.237  -6.205  -1.809
  325   HD13  LEU  44          3HD1      LEU  44   8.472  -6.206  -1.828
  326   HD21  LEU  44          3HD2      LEU  44  10.409  -9.575  -0.121
  327   HD22  LEU  44          1HD2      LEU  44  11.436  -8.274  -0.715
  328   HD23  LEU  44          2HD2      LEU  44  10.493  -9.237  -1.849
  329    H    ASP  45           H        ASP  45   7.991  -6.887   3.450
  330    HA   ASP  45           HA       ASP  45   6.254  -9.154   3.209
  331    HB2  ASP  45           2HB      ASP  45   7.960  -9.082   4.946
  332    HB3  ASP  45           1HB      ASP  45   7.233  -7.633   5.636
  333    H    THR  46           H        THR  46   5.850  -5.759   3.771
  334    HA   THR  46           HA       THR  46   3.396  -5.730   5.121
  335    HB   THR  46           HB       THR  46   4.240  -3.671   3.080
  336    HG1  THR  46           1HG      THR  46   5.576  -4.480   5.267
  337   HG21  THR  46          3HG2      THR  46   3.070  -2.122   4.554
  338   HG22  THR  46          1HG2      THR  46   2.709  -3.436   5.675
  339   HG23  THR  46          2HG2      THR  46   1.992  -3.428   4.064
  340    H    ILE  47           H        ILE  47   4.123  -6.204   1.714
  341    HA   ILE  47           HA       ILE  47   1.231  -6.251   1.164
  342    HB   ILE  47           HB       ILE  47   1.758  -5.974  -1.197
  343   HG12  ILE  47          2HG1      ILE  47   4.644  -5.552  -0.452
  344   HG13  ILE  47          1HG1      ILE  47   4.044  -7.143  -0.920
  345   HG21  ILE  47          1HG2      ILE  47   3.161  -3.933   0.527
  346   HG22  ILE  47          2HG2      ILE  47   1.429  -3.991   0.208
  347   HG23  ILE  47          3HG2      ILE  47   2.557  -3.675  -1.110
  348   HD11  ILE  47          3HD1      ILE  47   3.986  -4.637  -2.581
  349   HD12  ILE  47          1HD1      ILE  47   3.287  -6.186  -3.052
  350   HD13  ILE  47          2HD1      ILE  47   5.028  -6.041  -2.817
  351    H    GLN  48           H        GLN  48   3.375  -8.353   2.121
  352    HA   GLN  48           HA       GLN  48   3.478 -10.618   2.136
  353    HB2  GLN  48           2HB      GLN  48   0.888 -10.140   1.257
  354    HB3  GLN  48           1HB      GLN  48   1.541 -11.247   0.060
  355    HG2  GLN  48           2HG      GLN  48   1.744 -11.790   3.000
  356    HG3  GLN  48           1HG      GLN  48   0.331 -12.251   2.051
  357   HE21  GLN  48          1HE2      GLN  48   3.657 -12.905   2.742
  358   HE22  GLN  48          2HE2      GLN  48   3.766 -14.373   1.836
  359    H    TYR  49           H        TYR  49   3.023  -9.367  -1.165
  360    HA   TYR  49           HA       TYR  49   4.243 -11.396  -2.600
  361    HB2  TYR  49           2HB      TYR  49   4.198  -8.425  -3.134
  362    HB3  TYR  49           1HB      TYR  49   4.743  -9.620  -4.302
  363    HD1  TYR  49           2HD      TYR  49   3.070 -11.397  -5.056
  364    HD2  TYR  49           1HD      TYR  49   1.919  -7.892  -2.937
  365    HE1  TYR  49           2HE      TYR  49   0.760 -11.681  -5.846
  366    HE2  TYR  49           1HE      TYR  49  -0.392  -8.168  -3.720
  367    HH   TYR  49           HH       TYR  49  -1.795  -9.358  -4.949
  368    H    SER  50           H        SER  50   6.100 -12.265  -1.862
  369    HA   SER  50           HA       SER  50   8.416 -10.471  -1.573
  370    HB2  SER  50           2HB      SER  50   8.238 -13.303  -0.546
  371    HB3  SER  50           1HB      SER  50   9.381 -12.044  -0.076
  372    HG   SER  50           HG       SER  50   6.664 -11.515   0.284
  373    H    LYS  51           H        LYS  51   7.148 -13.313  -3.152
  374    HA   LYS  51           HA       LYS  51   9.581 -13.441  -4.804
  375    HB2  LYS  51           2HB      LYS  51   7.700 -15.632  -3.936
  376    HB3  LYS  51           1HB      LYS  51   8.804 -15.825  -5.290
  377    HG2  LYS  51           2HG      LYS  51  10.670 -15.242  -3.693
  378    HG3  LYS  51           1HG      LYS  51   9.483 -15.402  -2.397
  379    HD2  LYS  51           2HD      LYS  51  10.540 -17.498  -2.524
  380    HD3  LYS  51           1HD      LYS  51   8.993 -17.713  -3.344
  381    HE2  LYS  51           2HE      LYS  51  10.110 -17.412  -5.508
  382    HE3  LYS  51           1HE      LYS  51  11.654 -17.219  -4.680
  383    HZ1  LYS  51           3HZ      LYS  51  11.437 -19.458  -5.473
  384    HZ2  LYS  51           1HZ      LYS  51   9.955 -19.653  -4.681
  385    HZ3  LYS  51           2HZ      LYS  51  11.376 -19.472  -3.785
  386    H    HIS  52           H        HIS  52   6.099 -14.219  -4.933
  387    HA   HIS  52           HA       HIS  52   5.760 -12.695  -7.337
  388    HB2  HIS  52           2HB      HIS  52   6.754 -14.921  -8.082
  389    HB3  HIS  52           1HB      HIS  52   5.257 -15.664  -7.527
  390    HD1  HIS  52           1HD      HIS  52   5.814 -12.516  -9.604
  391    HD2  HIS  52           2HD      HIS  52   3.866 -16.188  -9.787
  392    HE1  HIS  52           1HE      HIS  52   4.556 -12.510 -11.780
  393    HE2  HIS  52           2HE      HIS  52   3.559 -14.814 -11.955
  394    H1   GLY   1           1HT      GLY   1 -19.839  19.973   2.386
  395    H2   GLY   1           2HT      GLY   1 -18.347  19.809   1.613
  396    H3   GLY   1           3HT      GLY   1 -18.422  20.474   3.164
  397    HA2  GLY   1           1HA      GLY   1 -17.630  18.228   3.309
  398    HA3  GLY   1           2HA      GLY   1 -19.220  18.359   4.044
  399    H    SER   2           H        SER   2 -20.725  16.949   3.402
  400    HA   SER   2           HA       SER   2 -20.159  15.376   0.983
  401    HB2  SER   2           2HB      SER   2 -22.130  14.540   3.086
  402    HB3  SER   2           1HB      SER   2 -21.184  13.534   1.989
  403    HG   SER   2           HG       SER   2 -20.379  14.837   4.354
  404    HA   PRO   3           HA       PRO   3 -23.691  17.844  -0.472
  405    HB2  PRO   3           2HB      PRO   3 -22.918  16.743  -3.082
  406    HB3  PRO   3           1HB      PRO   3 -23.026  18.428  -2.568
  407    HG2  PRO   3           2HG      PRO   3 -20.661  17.225  -3.028
  408    HG3  PRO   3           1HG      PRO   3 -20.862  18.467  -1.778
  409    HD2  PRO   3           2HD      PRO   3 -20.734  15.487  -1.486
  410    HD3  PRO   3           1HD      PRO   3 -19.996  16.753  -0.481
  411    HA   PRO   4           HA       PRO   4 -26.653  14.517  -0.611
  412    HB2  PRO   4           2HB      PRO   4 -28.363  16.395  -2.121
  413    HB3  PRO   4           1HB      PRO   4 -28.667  15.583  -0.582
  414    HG2  PRO   4           2HG      PRO   4 -28.130  18.198  -0.686
  415    HG3  PRO   4           1HG      PRO   4 -27.526  17.184   0.639
  416    HD2  PRO   4           2HD      PRO   4 -26.078  18.222  -1.775
  417    HD3  PRO   4           1HD      PRO   4 -25.522  18.093  -0.094
  418    H    GLU   5           H        GLU   5 -25.157  15.849  -3.307
  419    HA   GLU   5           HA       GLU   5 -26.621  14.303  -5.272
  420    HB2  GLU   5           2HB      GLU   5 -24.369  16.273  -5.382
  421    HB3  GLU   5           1HB      GLU   5 -24.660  15.213  -6.754
  422    HG2  GLU   5           2HG      GLU   5 -26.553  17.218  -5.565
  423    HG3  GLU   5           1HG      GLU   5 -25.764  17.292  -7.139
  424    H    ALA   6           H        ALA   6 -24.182  13.693  -3.069
  425    HA   ALA   6           HA       ALA   6 -22.727  11.797  -4.731
  426    HB1  ALA   6           1HB      ALA   6 -22.402  12.451  -1.803
  427    HB2  ALA   6           2HB      ALA   6 -21.495  13.189  -3.126
  428    HB3  ALA   6           3HB      ALA   6 -21.311  11.469  -2.781
  429    H    ASP   7           H        ASP   7 -22.899   9.597  -4.595
  430    HA   ASP   7           HA       ASP   7 -25.300   8.488  -3.584
  431    HB2  ASP   7           2HB      ASP   7 -23.880   7.609  -5.524
  432    HB3  ASP   7           1HB      ASP   7 -22.835   6.905  -4.295
  433    HA   PRO   8           HA       PRO   8 -24.074   8.100   0.670
  434    HB2  PRO   8           2HB      PRO   8 -26.120   6.430   1.414
  435    HB3  PRO   8           1HB      PRO   8 -26.276   8.183   1.260
  436    HG2  PRO   8           2HG      PRO   8 -27.055   6.038  -0.669
  437    HG3  PRO   8           1HG      PRO   8 -27.917   7.525  -0.233
  438    HD2  PRO   8           2HD      PRO   8 -26.505   7.306  -2.514
  439    HD3  PRO   8           1HD      PRO   8 -26.610   8.835  -1.616
  440    H    ARG   9           H        ARG   9 -24.424   5.455  -1.555
  441    HA   ARG   9           HA       ARG   9 -23.289   3.557   0.350
  442    HB2  ARG   9           2HB      ARG   9 -24.041   3.145  -2.545
  443    HB3  ARG   9           1HB      ARG   9 -23.623   1.891  -1.385
  444    HG2  ARG   9           2HG      ARG   9 -25.618   2.108  -0.227
  445    HG3  ARG   9           1HG      ARG   9 -25.918   3.730  -0.859
  446    HD2  ARG   9           2HD      ARG   9 -26.009   1.169  -2.447
  447    HD3  ARG   9           1HD      ARG   9 -27.410   2.069  -1.866
  448    HE   ARG   9           HE       ARG   9 -25.937   3.874  -3.349
  449   HH11  ARG   9          1HH1      ARG   9 -27.437   0.764  -3.949
  450   HH12  ARG   9          2HH1      ARG   9 -27.778   1.109  -5.614
  451   HH21  ARG   9          1HH2      ARG   9 -26.397   4.340  -5.531
  452   HH22  ARG   9          2HH2      ARG   9 -27.198   3.145  -6.516
  453    H    LEU  10           H        LEU  10 -22.354   5.598  -2.261
  454    HA   LEU  10           HA       LEU  10 -19.928   4.247  -2.930
  455    HB2  LEU  10           2HB      LEU  10 -21.105   5.797  -4.460
  456    HB3  LEU  10           1HB      LEU  10 -20.728   7.123  -3.379
  457    HG   LEU  10           HG       LEU  10 -18.292   6.666  -3.789
  458   HD11  LEU  10          1HD1      LEU  10 -17.702   5.353  -5.760
  459   HD12  LEU  10          2HD1      LEU  10 -19.391   4.877  -5.948
  460   HD13  LEU  10          3HD1      LEU  10 -18.480   4.360  -4.529
  461   HD21  LEU  10          3HD2      LEU  10 -20.018   7.373  -6.160
  462   HD22  LEU  10          1HD2      LEU  10 -18.288   7.694  -6.030
  463   HD23  LEU  10          2HD2      LEU  10 -19.415   8.481  -4.927
  464    H    ILE  11           H        ILE  11 -20.821   6.873  -0.746
  465    HA   ILE  11           HA       ILE  11 -18.135   7.480   0.003
  466    HB   ILE  11           HB       ILE  11 -19.996   9.107   0.219
  467   HG12  ILE  11          2HG1      ILE  11 -18.667   8.505   2.870
  468   HG13  ILE  11          1HG1      ILE  11 -17.875   9.319   1.524
  469   HG21  ILE  11          1HG2      ILE  11 -21.484   8.931   2.210
  470   HG22  ILE  11          2HG2      ILE  11 -20.888   7.292   2.455
  471   HG23  ILE  11          3HG2      ILE  11 -21.776   7.694   0.988
  472   HD11  ILE  11          3HD1      ILE  11 -19.508  11.134   1.676
  473   HD12  ILE  11          1HD1      ILE  11 -18.628  10.907   3.188
  474   HD13  ILE  11          2HD1      ILE  11 -20.280  10.311   3.033
  475    H    GLU  12           H        GLU  12 -20.469   5.130   0.966
  476    HA   GLU  12           HA       GLU  12 -19.339   4.537   3.517
  477    HB2  GLU  12           2HB      GLU  12 -21.335   3.163   1.751
  478    HB3  GLU  12           1HB      GLU  12 -20.719   2.377   3.198
  479    HG2  GLU  12           2HG      GLU  12 -22.143   5.023   3.099
  480    HG3  GLU  12           1HG      GLU  12 -22.837   3.490   3.625
  481    H    SER  13           H        SER  13 -18.384   3.847   0.341
  482    HA   SER  13           HA       SER  13 -17.223   1.302   0.691
  483    HB2  SER  13           2HB      SER  13 -16.277   3.510  -1.152
  484    HB3  SER  13           1HB      SER  13 -15.972   1.780  -1.330
  485    HG   SER  13           HG       SER  13 -18.608   2.207  -1.100
  486    H    LEU  14           H        LEU  14 -16.255   4.501   1.598
  487    HA   LEU  14           HA       LEU  14 -13.524   3.772   2.213
  488    HB2  LEU  14           2HB      LEU  14 -15.123   6.255   2.865
  489    HB3  LEU  14           1HB      LEU  14 -13.414   6.054   3.204
  490    HG   LEU  14           HG       LEU  14 -13.368   5.578   0.569
  491   HD11  LEU  14          1HD1      LEU  14 -14.873   7.150  -0.571
  492   HD12  LEU  14          2HD1      LEU  14 -15.683   7.470   0.964
  493   HD13  LEU  14          3HD1      LEU  14 -15.752   5.860   0.247
  494   HD21  LEU  14          3HD2      LEU  14 -13.431   8.331   1.804
  495   HD22  LEU  14          1HD2      LEU  14 -12.660   7.885   0.280
  496   HD23  LEU  14          2HD2      LEU  14 -12.045   7.240   1.803
  497    H    SER  15           H        SER  15 -16.530   4.451   3.937
  498    HA   SER  15           HA       SER  15 -15.583   4.192   6.555
  499    HB2  SER  15           2HB      SER  15 -18.346   3.295   5.816
  500    HB3  SER  15           1HB      SER  15 -17.815   4.264   7.191
  501    HG   SER  15           HG       SER  15 -18.956   5.302   5.265
  502    H    GLN  16           H        GLN  16 -16.805   1.799   4.264
  503    HA   GLN  16           HA       GLN  16 -16.954  -0.420   5.944
  504    HB2  GLN  16           2HB      GLN  16 -17.886  -0.474   3.715
  505    HB3  GLN  16           1HB      GLN  16 -16.301  -0.221   3.000
  506    HG2  GLN  16           2HG      GLN  16 -16.927  -2.512   2.725
  507    HG3  GLN  16           1HG      GLN  16 -15.591  -2.417   3.869
  508   HE21  GLN  16          1HE2      GLN  16 -15.949  -2.921   6.016
  509   HE22  GLN  16          2HE2      GLN  16 -17.375  -3.747   6.551
  510    H    MET  17           H        MET  17 -14.206   1.005   4.267
  511    HA   MET  17           HA       MET  17 -12.341  -1.055   4.709
  512    HB2  MET  17           2HB      MET  17 -12.147   1.872   4.129
  513    HB3  MET  17           1HB      MET  17 -10.698   1.019   4.654
  514    HG2  MET  17           2HG      MET  17 -12.392   0.351   2.259
  515    HG3  MET  17           1HG      MET  17 -10.819   1.145   2.238
  516    HE1  MET  17           3HE      MET  17 -11.316  -1.342   0.417
  517    HE2  MET  17           1HE      MET  17  -9.862  -2.293   0.725
  518    HE3  MET  17           2HE      MET  17  -9.753  -0.538   0.573
  519    H    LEU  18           H        LEU  18 -13.242   1.785   6.593
  520    HA   LEU  18           HA       LEU  18 -11.355   1.476   8.655
  521    HB2  LEU  18           2HB      LEU  18 -12.659   3.543   8.229
  522    HB3  LEU  18           1HB      LEU  18 -14.104   2.724   8.786
  523    HG   LEU  18           HG       LEU  18 -13.012   2.452  11.024
  524   HD11  LEU  18          1HD1      LEU  18 -10.965   4.313   9.828
  525   HD12  LEU  18          2HD1      LEU  18 -10.693   2.645  10.329
  526   HD13  LEU  18          3HD1      LEU  18 -11.084   3.873  11.531
  527   HD21  LEU  18          3HD2      LEU  18 -14.629   4.224  10.594
  528   HD22  LEU  18          1HD2      LEU  18 -13.339   5.276  10.011
  529   HD23  LEU  18          2HD2      LEU  18 -13.373   4.772  11.702
  530    H    SER  19           H        SER  19 -14.626   0.214   8.213
  531    HA   SER  19           HA       SER  19 -14.876  -0.966  10.774
  532    HB2  SER  19           2HB      SER  19 -16.253  -2.011   8.308
  533    HB3  SER  19           1HB      SER  19 -16.858  -1.943   9.964
  534    HG   SER  19           HG       SER  19 -16.968   0.319   9.768
  535    H    MET  20           H        MET  20 -13.237  -1.902   7.895
  536    HA   MET  20           HA       MET  20 -13.006  -4.694   8.637
  537    HB2  MET  20           2HB      MET  20 -11.928  -3.036   6.363
  538    HB3  MET  20           1HB      MET  20 -11.374  -4.683   6.638
  539    HG2  MET  20           2HG      MET  20 -14.266  -3.941   6.258
  540    HG3  MET  20           1HG      MET  20 -13.195  -4.435   4.947
  541    HE1  MET  20           3HE      MET  20 -11.534  -6.737   5.609
  542    HE2  MET  20           1HE      MET  20 -12.712  -6.824   4.300
  543    HE3  MET  20           2HE      MET  20 -12.592  -8.141   5.470
  544    H    GLY  21           H        GLY  21 -11.555  -1.855   9.548
  545    HA2  GLY  21           2HA      GLY  21  -9.902  -1.736  11.224
  546    HA3  GLY  21           1HA      GLY  21  -9.333  -3.328  10.744
  547    H    PHE  22           H        PHE  22  -9.834  -1.615   7.980
  548    HA   PHE  22           HA       PHE  22  -7.011  -1.292   7.566
  549    HB2  PHE  22           2HB      PHE  22  -9.003  -1.879   5.864
  550    HB3  PHE  22           1HB      PHE  22  -8.947  -0.140   5.622
  551    HD1  PHE  22           2HD      PHE  22  -6.213   0.597   5.622
  552    HD2  PHE  22           1HD      PHE  22  -7.979  -2.989   4.168
  553    HE1  PHE  22           2HE      PHE  22  -4.324   0.304   4.075
  554    HE2  PHE  22           1HE      PHE  22  -6.092  -3.295   2.617
  555    HZ   PHE  22           HZ       PHE  22  -4.263  -1.647   2.566
  556    H    SER  23           H        SER  23  -5.882   0.429   8.005
  557    HA   SER  23           HA       SER  23  -7.027   3.080   7.796
  558    HB2  SER  23           2HB      SER  23  -5.762   3.415  10.169
  559    HB3  SER  23           1HB      SER  23  -7.486   3.048  10.040
  560    HG   SER  23           HG       SER  23  -6.933   0.829  10.278
  561    H    ASP  24           H        ASP  24  -5.471   4.622   7.321
  562    HA   ASP  24           HA       ASP  24  -2.805   3.511   6.827
  563    HB2  ASP  24           2HB      ASP  24  -2.563   5.491   5.258
  564    HB3  ASP  24           1HB      ASP  24  -3.708   4.249   4.775
  565    H    GLU  25           H        GLU  25  -0.965   4.761   7.191
  566    HA   GLU  25           HA       GLU  25  -1.246   6.615   9.452
  567    HB2  GLU  25           2HB      GLU  25   1.472   5.962   9.087
  568    HB3  GLU  25           1HB      GLU  25   0.404   5.405  10.364
  569    HG2  GLU  25           2HG      GLU  25   1.372   3.476   9.441
  570    HG3  GLU  25           1HG      GLU  25  -0.277   3.530   8.824
  571    H    GLY  26           H        GLY  26   0.403   6.129   6.366
  572    HA2  GLY  26           2HA      GLY  26   1.355   8.878   6.369
  573    HA3  GLY  26           1HA      GLY  26   1.696   7.657   5.154
  574    H    GLY  27           H        GLY  27  -1.528   7.496   5.681
  575    HA2  GLY  27           2HA      GLY  27  -3.404   8.416   4.701
  576    HA3  GLY  27           1HA      GLY  27  -2.423   9.779   4.191
  577    H    TRP  28           H        TRP  28  -1.906   6.359   3.428
  578    HA   TRP  28           HA       TRP  28  -1.979   7.103   0.610
  579    HB2  TRP  28           2HB      TRP  28  -0.842   4.973   0.175
  580    HB3  TRP  28           1HB      TRP  28   0.041   5.989   1.306
  581    HD1  TRP  28           HD       TRP  28  -0.069   5.203   3.946
  582    HE1  TRP  28           1HE      TRP  28  -0.217   2.835   4.936
  583    HE3  TRP  28           3HE      TRP  28  -1.750   2.720  -0.185
  584    HZ2  TRP  28           2HZ      TRP  28  -0.958   0.236   4.066
  585    HZ3  TRP  28           3HZ      TRP  28  -2.149   0.297  -0.029
  586    HH2  TRP  28           HH       TRP  28  -1.762  -0.917   2.049
  587    H    LEU  29           H        LEU  29  -3.973   5.514   2.873
  588    HA   LEU  29           HA       LEU  29  -5.168   3.622   1.083
  589    HB2  LEU  29           2HB      LEU  29  -5.332   3.277   3.473
  590    HB3  LEU  29           1HB      LEU  29  -6.150   4.812   3.678
  591    HG   LEU  29           HG       LEU  29  -8.064   3.905   2.352
  592   HD11  LEU  29          1HD1      LEU  29  -6.919   2.173   1.104
  593   HD12  LEU  29          2HD1      LEU  29  -8.225   1.476   2.063
  594   HD13  LEU  29          3HD1      LEU  29  -6.553   1.310   2.599
  595   HD21  LEU  29          3HD2      LEU  29  -7.278   2.424   4.852
  596   HD22  LEU  29          1HD2      LEU  29  -8.901   2.453   4.159
  597   HD23  LEU  29          2HD2      LEU  29  -8.168   3.944   4.755
  598    H    THR  30           H        THR  30  -5.994   6.880   2.174
  599    HA   THR  30           HA       THR  30  -8.401   7.098   0.704
  600    HB   THR  30           HB       THR  30  -7.802   8.585   2.612
  601    HG1  THR  30           1HG      THR  30  -8.511   9.718   0.107
  602   HG21  THR  30          3HG2      THR  30  -5.918   9.862   0.627
  603   HG22  THR  30          1HG2      THR  30  -5.453   8.980   2.080
  604   HG23  THR  30          2HG2      THR  30  -6.324  10.508   2.216
  605    H    ARG  31           H        ARG  31  -5.185   7.023  -0.270
  606    HA   ARG  31           HA       ARG  31  -5.602   8.585  -2.701
  607    HB2  ARG  31           2HB      ARG  31  -3.136   7.097  -1.774
  608    HB3  ARG  31           1HB      ARG  31  -3.224   8.254  -3.096
  609    HG2  ARG  31           2HG      ARG  31  -3.791   8.940  -0.222
  610    HG3  ARG  31           1HG      ARG  31  -2.224   9.153  -1.005
  611    HD2  ARG  31           2HD      ARG  31  -4.799  10.418  -1.925
  612    HD3  ARG  31           1HD      ARG  31  -3.574  11.221  -0.947
  613    HE   ARG  31           HE       ARG  31  -3.355  10.482  -3.770
  614   HH11  ARG  31          1HH1      ARG  31  -1.921  11.931  -0.925
  615   HH12  ARG  31          2HH1      ARG  31  -0.642  12.696  -1.808
  616   HH21  ARG  31          1HH2      ARG  31  -1.683  11.484  -4.934
  617   HH22  ARG  31          2HH2      ARG  31  -0.506  12.447  -4.095
  618    H    LEU  32           H        LEU  32  -4.826   5.294  -1.662
  619    HA   LEU  32           HA       LEU  32  -4.620   4.099  -4.179
  620    HB2  LEU  32           2HB      LEU  32  -4.021   3.181  -1.858
  621    HB3  LEU  32           1HB      LEU  32  -5.707   2.713  -1.741
  622    HG   LEU  32           HG       LEU  32  -5.344   1.415  -3.909
  623   HD11  LEU  32          1HD1      LEU  32  -2.984   0.725  -4.288
  624   HD12  LEU  32          2HD1      LEU  32  -2.481   1.983  -3.158
  625   HD13  LEU  32          3HD1      LEU  32  -3.302   2.421  -4.658
  626   HD21  LEU  32          3HD2      LEU  32  -4.313  -0.486  -2.712
  627   HD22  LEU  32          1HD2      LEU  32  -5.583   0.301  -1.777
  628   HD23  LEU  32          2HD2      LEU  32  -3.889   0.606  -1.394
  629    H    LEU  33           H        LEU  33  -7.411   4.792  -2.176
  630    HA   LEU  33           HA       LEU  33  -9.286   3.247  -3.635
  631    HB2  LEU  33           2HB      LEU  33  -9.622   5.618  -1.810
  632    HB3  LEU  33           1HB      LEU  33 -10.968   4.722  -2.485
  633    HG   LEU  33           HG       LEU  33  -8.849   3.503  -0.718
  634   HD11  LEU  33          1HD1      LEU  33 -10.516   3.574   1.055
  635   HD12  LEU  33          2HD1      LEU  33 -11.623   4.443  -0.009
  636   HD13  LEU  33          3HD1      LEU  33 -10.113   5.199   0.497
  637   HD21  LEU  33          3HD2      LEU  33  -9.939   1.895  -2.163
  638   HD22  LEU  33          1HD2      LEU  33 -11.525   2.498  -1.675
  639   HD23  LEU  33          2HD2      LEU  33 -10.490   1.684  -0.502
  640    H    GLN  34           H        GLN  34  -7.691   6.125  -4.423
  641    HA   GLN  34           HA       GLN  34  -9.847   7.080  -6.140
  642    HB2  GLN  34           2HB      GLN  34  -7.105   8.272  -5.689
  643    HB3  GLN  34           1HB      GLN  34  -8.453   9.035  -6.521
  644    HG2  GLN  34           2HG      GLN  34  -8.309   8.332  -3.601
  645    HG3  GLN  34           1HG      GLN  34  -8.224   9.947  -4.304
  646   HE21  GLN  34          1HE2      GLN  34 -10.087   8.761  -2.369
  647   HE22  GLN  34          2HE2      GLN  34 -11.672   8.987  -3.036
  648    H    THR  35           H        THR  35  -6.531   5.859  -6.345
  649    HA   THR  35           HA       THR  35  -6.458   5.999  -9.210
  650    HB   THR  35           HB       THR  35  -4.398   4.335  -8.519
  651    HG1  THR  35           1HG      THR  35  -3.584   5.128  -6.531
  652   HG21  THR  35          3HG2      THR  35  -4.486   7.356  -8.455
  653   HG22  THR  35          1HG2      THR  35  -4.180   6.342  -9.865
  654   HG23  THR  35          2HG2      THR  35  -3.015   6.390  -8.543
  655    H    LYS  36           H        LYS  36  -6.778   3.380  -6.816
  656    HA   LYS  36           HA       LYS  36  -7.194   1.470  -8.995
  657    HB2  LYS  36           2HB      LYS  36  -5.690   1.078  -6.912
  658    HB3  LYS  36           1HB      LYS  36  -7.203   0.761  -6.075
  659    HG2  LYS  36           2HG      LYS  36  -7.691  -1.092  -7.484
  660    HG3  LYS  36           1HG      LYS  36  -6.366  -0.688  -8.577
  661    HD2  LYS  36           2HD      LYS  36  -4.757  -1.174  -6.803
  662    HD3  LYS  36           1HD      LYS  36  -6.085  -1.554  -5.700
  663    HE2  LYS  36           2HE      LYS  36  -5.030  -3.564  -6.690
  664    HE3  LYS  36           1HE      LYS  36  -6.745  -3.422  -7.060
  665    HZ1  LYS  36           3HZ      LYS  36  -6.243  -2.680  -9.247
  666    HZ2  LYS  36           1HZ      LYS  36  -5.337  -4.081  -8.970
  667    HZ3  LYS  36           2HZ      LYS  36  -4.590  -2.566  -8.909
  668    H    ASN  37           H        ASN  37  -9.080   3.608  -7.630
  669    HA   ASN  37           HA       ASN  37 -11.334   3.886  -7.487
  670    HB2  ASN  37           2HB      ASN  37 -11.406   2.426  -9.515
  671    HB3  ASN  37           1HB      ASN  37 -11.550   1.027  -8.461
  672   HD21  ASN  37          1HD2      ASN  37 -13.539   0.321  -8.935
  673   HD22  ASN  37          2HD2      ASN  37 -14.980   1.262  -8.751
  674    H    TYR  38           H        TYR  38 -13.318   2.922  -6.321
  675    HA   TYR  38           HA       TYR  38 -12.446   2.123  -3.692
  676    HB2  TYR  38           2HB      TYR  38 -15.222   2.643  -4.783
  677    HB3  TYR  38           1HB      TYR  38 -14.828   2.393  -3.088
  678    HD1  TYR  38           1HD      TYR  38 -13.191   4.045  -2.003
  679    HD2  TYR  38           2HD      TYR  38 -15.153   4.796  -5.703
  680    HE1  TYR  38           1HE      TYR  38 -12.754   6.448  -1.740
  681    HE2  TYR  38           2HE      TYR  38 -14.719   7.205  -5.451
  682    HH   TYR  38           HH       TYR  38 -14.256   8.816  -3.660
  683    H    ASP  39           H        ASP  39 -11.917   0.178  -5.632
  684    HA   ASP  39           HA       ASP  39 -13.935  -1.891  -5.429
  685    HB2  ASP  39           2HB      ASP  39 -11.516  -1.425  -7.025
  686    HB3  ASP  39           1HB      ASP  39 -11.696  -3.094  -6.499
  687    H    ILE  40           H        ILE  40 -14.024  -2.340  -3.261
  688    HA   ILE  40           HA       ILE  40 -11.961  -2.710  -1.468
  689    HB   ILE  40           HB       ILE  40 -14.548  -4.261  -1.500
  690   HG12  ILE  40          2HG1      ILE  40 -13.992  -1.623  -0.133
  691   HG13  ILE  40          1HG1      ILE  40 -14.788  -1.755  -1.698
  692   HG21  ILE  40          1HG2      ILE  40 -12.893  -5.123   0.078
  693   HG22  ILE  40          2HG2      ILE  40 -14.259  -4.387   0.914
  694   HG23  ILE  40          3HG2      ILE  40 -12.730  -3.519   0.787
  695   HD11  ILE  40          3HD1      ILE  40 -15.790  -2.942   0.884
  696   HD12  ILE  40          1HD1      ILE  40 -16.598  -3.024  -0.684
  697   HD13  ILE  40          2HD1      ILE  40 -16.387  -1.469   0.121
  698    H    GLY  41           H        GLY  41 -13.505  -5.170  -3.522
  699    HA2  GLY  41           2HA      GLY  41 -12.067  -7.386  -2.578
  700    HA3  GLY  41           1HA      GLY  41 -12.837  -7.269  -4.152
  701    H    ALA  42           H        ALA  42 -11.325  -5.061  -5.114
  702    HA   ALA  42           HA       ALA  42  -9.046  -6.460  -6.099
  703    HB1  ALA  42           1HB      ALA  42  -8.609  -4.492  -7.403
  704    HB2  ALA  42           2HB      ALA  42  -9.682  -3.530  -6.389
  705    HB3  ALA  42           3HB      ALA  42 -10.346  -4.801  -7.416
  706    H    ALA  43           H        ALA  43  -9.536  -3.857  -3.770
  707    HA   ALA  43           HA       ALA  43  -6.823  -3.203  -3.366
  708    HB1  ALA  43           1HB      ALA  43  -9.148  -2.899  -1.467
  709    HB2  ALA  43           2HB      ALA  43  -8.644  -1.730  -2.685
  710    HB3  ALA  43           3HB      ALA  43  -7.585  -2.094  -1.324
  711    H    LEU  44           H        LEU  44  -8.948  -5.546  -1.791
  712    HA   LEU  44           HA       LEU  44  -7.175  -6.299   0.275
  713    HB2  LEU  44           2HB      LEU  44  -9.677  -7.294  -0.882
  714    HB3  LEU  44           1HB      LEU  44  -8.654  -8.567  -0.248
  715    HG   LEU  44           HG       LEU  44  -8.588  -7.356   1.939
  716   HD11  LEU  44          1HD1      LEU  44 -10.715  -5.636   0.670
  717   HD12  LEU  44          2HD1      LEU  44  -9.085  -5.113   1.099
  718   HD13  LEU  44          3HD1      LEU  44 -10.215  -5.601   2.362
  719   HD21  LEU  44          3HD2      LEU  44 -10.868  -7.980   2.596
  720   HD22  LEU  44          1HD2      LEU  44 -10.121  -9.211   1.574
  721   HD23  LEU  44          2HD2      LEU  44 -11.316  -8.107   0.895
  722    H    ASP  45           H        ASP  45  -7.488  -7.300  -3.056
  723    HA   ASP  45           HA       ASP  45  -5.721  -9.556  -2.826
  724    HB2  ASP  45           2HB      ASP  45  -7.506  -9.452  -4.526
  725    HB3  ASP  45           1HB      ASP  45  -6.694  -8.089  -5.288
  726    H    THR  46           H        THR  46  -5.342  -6.180  -3.265
  727    HA   THR  46           HA       THR  46  -2.958  -6.100  -4.752
  728    HB   THR  46           HB       THR  46  -3.765  -4.120  -2.620
  729    HG1  THR  46           1HG      THR  46  -5.245  -4.847  -4.616
  730   HG21  THR  46          3HG2      THR  46  -2.610  -2.502  -4.029
  731   HG22  THR  46          1HG2      THR  46  -2.232  -3.766  -5.201
  732   HG23  THR  46          2HG2      THR  46  -1.516  -3.812  -3.590
  733    H    ILE  47           H        ILE  47  -3.558  -6.652  -1.330
  734    HA   ILE  47           HA       ILE  47  -0.646  -6.836  -0.929
  735    HB   ILE  47           HB       ILE  47  -1.040  -6.451   1.466
  736   HG12  ILE  47          2HG1      ILE  47  -3.897  -5.885   0.636
  737   HG13  ILE  47          1HG1      ILE  47  -3.376  -7.299   1.540
  738   HG21  ILE  47          1HG2      ILE  47  -2.264  -4.268  -0.210
  739   HG22  ILE  47          2HG2      ILE  47  -0.537  -4.610  -0.136
  740   HG23  ILE  47          3HG2      ILE  47  -1.395  -4.091   1.314
  741   HD11  ILE  47          3HD1      ILE  47  -4.333  -5.720   3.052
  742   HD12  ILE  47          1HD1      ILE  47  -3.285  -4.436   2.447
  743   HD13  ILE  47          2HD1      ILE  47  -2.596  -5.790   3.344
  744    H    GLN  48           H        GLN  48  -3.203  -8.723  -1.487
  745    HA   GLN  48           HA       GLN  48  -3.594 -10.948  -1.355
  746    HB2  GLN  48           2HB      GLN  48  -0.792 -10.862  -0.321
  747    HB3  GLN  48           1HB      GLN  48  -1.710 -12.359  -0.226
  748    HG2  GLN  48           2HG      GLN  48  -1.148 -10.800  -2.730
  749    HG3  GLN  48           1HG      GLN  48  -0.329 -12.278  -2.226
  750   HE21  GLN  48          1HE2      GLN  48  -1.963 -11.633  -4.610
  751   HE22  GLN  48          2HE2      GLN  48  -3.197 -12.851  -4.650
  752    H    TYR  49           H        TYR  49  -3.129  -9.114   1.465
  753    HA   TYR  49           HA       TYR  49  -3.810 -11.193   3.318
  754    HB2  TYR  49           2HB      TYR  49  -3.659  -8.193   3.632
  755    HB3  TYR  49           1HB      TYR  49  -4.042  -9.294   4.951
  756    HD1  TYR  49           2HD      TYR  49  -2.281 -11.316   5.162
  757    HD2  TYR  49           1HD      TYR  49  -1.452  -7.511   3.453
  758    HE1  TYR  49           2HE      TYR  49   0.119 -11.655   5.587
  759    HE2  TYR  49           1HE      TYR  49   0.951  -7.838   3.873
  760    HH   TYR  49           HH       TYR  49   2.501  -9.130   4.802
  761    H    SER  50           H        SER  50  -5.695 -11.821   1.934
  762    HA   SER  50           HA       SER  50  -8.082 -10.221   2.576
  763    HB2  SER  50           2HB      SER  50  -7.990 -12.474   0.577
  764    HB3  SER  50           1HB      SER  50  -9.118 -11.122   0.660
  765    HG   SER  50           HG       SER  50  -6.748 -10.051   0.405
  766    H    LYS  51           H        LYS  51  -6.434 -13.128   3.256
  767    HA   LYS  51           HA       LYS  51  -8.822 -14.478   4.253
  768    HB2  LYS  51           2HB      LYS  51  -5.954 -15.370   3.933
  769    HB3  LYS  51           1HB      LYS  51  -7.178 -16.348   4.727
  770    HG2  LYS  51           2HG      LYS  51  -8.072 -15.424   2.139
  771    HG3  LYS  51           1HG      LYS  51  -6.557 -16.321   2.029
  772    HD2  LYS  51           2HD      LYS  51  -8.354 -17.880   1.796
  773    HD3  LYS  51           1HD      LYS  51  -7.623 -18.132   3.381
  774    HE2  LYS  51           2HE      LYS  51  -9.419 -16.673   4.338
  775    HE3  LYS  51           1HE      LYS  51 -10.185 -16.681   2.751
  776    HZ1  LYS  51           3HZ      LYS  51  -9.710 -19.006   4.524
  777    HZ2  LYS  51           1HZ      LYS  51 -10.239 -19.140   2.923
  778    HZ3  LYS  51           2HZ      LYS  51 -11.198 -18.351   4.066
  779    H    HIS  52           H        HIS  52  -5.636 -13.429   5.446
  780    HA   HIS  52           HA       HIS  52  -6.766 -12.794   8.010
  781    HB2  HIS  52           2HB      HIS  52  -6.202 -15.313   8.032
  782    HB3  HIS  52           1HB      HIS  52  -4.517 -14.804   7.977
  783    HD1  HIS  52           1HD      HIS  52  -3.468 -14.617  10.206
  784    HD2  HIS  52           2HD      HIS  52  -7.566 -13.944  10.363
  785    HE1  HIS  52           1HE      HIS  52  -4.006 -14.281  12.638
  786    HE2  HIS  52           2HE      HIS  52  -6.448 -13.684  12.680
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1  19.482  20.008  -2.821
    2    H2   GLY   1           2HT      GLY   1  18.041  19.374  -2.202
    3    H3   GLY   1           3HT      GLY   1  18.169  19.731  -3.850
    4    HA2  GLY   1           1HA      GLY   1  18.351  17.375  -3.568
    5    HA3  GLY   1           2HA      GLY   1  19.895  18.036  -4.083
    6    H    SER   2           H        SER   2  20.035  15.640  -2.953
    7    HA   SER   2           HA       SER   2  20.311  15.740  -0.106
    8    HB2  SER   2           2HB      SER   2  21.571  13.489  -0.666
    9    HB3  SER   2           1HB      SER   2  19.818  13.598  -0.837
   10    HG   SER   2           HG       SER   2  21.714  13.976  -2.920
   11    HA   PRO   3           HA       PRO   3  24.442  17.452  -0.265
   12    HB2  PRO   3           2HB      PRO   3  24.792  17.724   2.380
   13    HB3  PRO   3           1HB      PRO   3  23.682  18.770   1.490
   14    HG2  PRO   3           2HG      PRO   3  23.080  16.377   3.176
   15    HG3  PRO   3           1HG      PRO   3  22.232  17.930   3.095
   16    HD2  PRO   3           2HD      PRO   3  21.403  15.657   1.799
   17    HD3  PRO   3           1HD      PRO   3  21.016  17.303   1.262
   18    HA   PRO   4           HA       PRO   4  27.296  14.117   0.341
   19    HB2  PRO   4           2HB      PRO   4  28.905  15.905   2.098
   20    HB3  PRO   4           1HB      PRO   4  29.393  14.999   0.663
   21    HG2  PRO   4           2HG      PRO   4  29.039  17.628   0.541
   22    HG3  PRO   4           1HG      PRO   4  28.521  16.580  -0.791
   23    HD2  PRO   4           2HD      PRO   4  26.877  17.900   1.329
   24    HD3  PRO   4           1HD      PRO   4  26.510  17.643  -0.390
   25    H    GLU   5           H        GLU   5  25.954  15.756   3.067
   26    HA   GLU   5           HA       GLU   5  26.955  14.057   5.111
   27    HB2  GLU   5           2HB      GLU   5  24.737  16.067   4.934
   28    HB3  GLU   5           1HB      GLU   5  24.890  15.045   6.358
   29    HG2  GLU   5           2HG      GLU   5  26.947  16.962   5.285
   30    HG3  GLU   5           1HG      GLU   5  25.986  17.148   6.753
   31    H    ALA   6           H        ALA   6  24.486  13.692   2.765
   32    HA   ALA   6           HA       ALA   6  22.958  11.755   4.269
   33    HB1  ALA   6           1HB      ALA   6  22.824  12.514   1.348
   34    HB2  ALA   6           2HB      ALA   6  21.824  13.175   2.642
   35    HB3  ALA   6           3HB      ALA   6  21.675  11.477   2.194
   36    H    ASP   7           H        ASP   7  23.221   9.613   4.257
   37    HA   ASP   7           HA       ASP   7  25.609   8.483   3.270
   38    HB2  ASP   7           2HB      ASP   7  24.240   7.695   5.259
   39    HB3  ASP   7           1HB      ASP   7  23.155   6.938   4.100
   40    HA   PRO   8           HA       PRO   8  24.409   7.819  -0.949
   41    HB2  PRO   8           2HB      PRO   8  26.428   6.067  -1.567
   42    HB3  PRO   8           1HB      PRO   8  26.611   7.824  -1.532
   43    HG2  PRO   8           2HG      PRO   8  27.352   5.800   0.542
   44    HG3  PRO   8           1HG      PRO   8  28.234   7.245   0.014
   45    HD2  PRO   8           2HD      PRO   8  26.808   7.198   2.295
   46    HD3  PRO   8           1HD      PRO   8  26.941   8.661   1.298
   47    H    ARG   9           H        ARG   9  24.713   5.317   1.440
   48    HA   ARG   9           HA       ARG   9  23.581   3.290  -0.320
   49    HB2  ARG   9           2HB      ARG   9  24.289   3.186   2.615
   50    HB3  ARG   9           1HB      ARG   9  23.734   1.819   1.659
   51    HG2  ARG   9           2HG      ARG   9  25.717   1.687   0.468
   52    HG3  ARG   9           1HG      ARG   9  26.170   3.353   0.846
   53    HD2  ARG   9           2HD      ARG   9  26.031   1.085   2.833
   54    HD3  ARG   9           1HD      ARG   9  27.510   1.693   2.088
   55    HE   ARG   9           HE       ARG   9  26.085   3.805   3.350
   56   HH11  ARG   9          1HH1      ARG   9  28.058   1.012   4.079
   57   HH12  ARG   9          2HH1      ARG   9  28.704   1.684   5.539
   58   HH21  ARG   9          1HH2      ARG   9  26.929   4.702   5.279
   59   HH22  ARG   9          2HH2      ARG   9  28.056   3.769   6.225
   60    H    LEU  10           H        LEU  10  22.660   5.196   2.505
   61    HA   LEU  10           HA       LEU  10  20.140   4.007   2.925
   62    HB2  LEU  10           2HB      LEU  10  21.176   6.751   3.610
   63    HB3  LEU  10           1HB      LEU  10  19.597   6.176   4.106
   64    HG   LEU  10           HG       LEU  10  22.244   4.957   4.909
   65   HD11  LEU  10          1HD1      LEU  10  21.745   5.832   7.117
   66   HD12  LEU  10          2HD1      LEU  10  20.249   6.546   6.516
   67   HD13  LEU  10          3HD1      LEU  10  21.805   7.142   5.936
   68   HD21  LEU  10          3HD2      LEU  10  19.411   4.257   5.677
   69   HD22  LEU  10          1HD2      LEU  10  20.856   3.635   6.474
   70   HD23  LEU  10          2HD2      LEU  10  20.549   3.249   4.783
   71    H    ILE  11           H        ILE  11  21.161   6.684   0.862
   72    HA   ILE  11           HA       ILE  11  18.485   7.401   0.137
   73    HB   ILE  11           HB       ILE  11  20.365   9.015   0.061
   74   HG12  ILE  11          2HG1      ILE  11  19.025   8.596  -2.621
   75   HG13  ILE  11          1HG1      ILE  11  18.263   9.360  -1.229
   76   HG21  ILE  11          1HG2      ILE  11  21.913   8.981  -1.841
   77   HG22  ILE  11          2HG2      ILE  11  21.254   7.424  -2.342
   78   HG23  ILE  11          3HG2      ILE  11  22.107   7.568  -0.805
   79   HD11  ILE  11          3HD1      ILE  11  19.900  11.150  -1.302
   80   HD12  ILE  11          1HD1      ILE  11  19.069  10.987  -2.848
   81   HD13  ILE  11          2HD1      ILE  11  20.711  10.372  -2.662
   82    H    GLU  12           H        GLU  12  20.756   5.040  -0.934
   83    HA   GLU  12           HA       GLU  12  19.658   4.711  -3.559
   84    HB2  GLU  12           2HB      GLU  12  21.731   3.340  -1.931
   85    HB3  GLU  12           1HB      GLU  12  20.986   2.417  -3.231
   86    HG2  GLU  12           2HG      GLU  12  22.425   5.045  -3.484
   87    HG3  GLU  12           1HG      GLU  12  22.993   3.467  -4.029
   88    H    SER  13           H        SER  13  18.648   3.756  -0.464
   89    HA   SER  13           HA       SER  13  17.454   1.275  -1.003
   90    HB2  SER  13           2HB      SER  13  16.596   3.438   0.939
   91    HB3  SER  13           1HB      SER  13  16.001   1.777   0.950
   92    HG   SER  13           HG       SER  13  18.347   1.223   1.108
   93    H    LEU  14           H        LEU  14  16.508   4.536  -1.767
   94    HA   LEU  14           HA       LEU  14  13.791   3.933  -2.427
   95    HB2  LEU  14           2HB      LEU  14  15.616   6.256  -2.964
   96    HB3  LEU  14           1HB      LEU  14  14.037   6.170  -3.716
   97    HG   LEU  14           HG       LEU  14  14.497   6.128  -0.732
   98   HD11  LEU  14          1HD1      LEU  14  13.666   8.442  -0.787
   99   HD12  LEU  14          2HD1      LEU  14  13.702   8.401  -2.548
  100   HD13  LEU  14          3HD1      LEU  14  15.203   8.260  -1.632
  101   HD21  LEU  14          3HD2      LEU  14  12.013   6.398  -2.418
  102   HD22  LEU  14          1HD2      LEU  14  12.078   6.654  -0.675
  103   HD23  LEU  14          2HD2      LEU  14  12.431   5.062  -1.345
  104    H    SER  15           H        SER  15  16.774   4.422  -4.278
  105    HA   SER  15           HA       SER  15  15.703   3.986  -6.830
  106    HB2  SER  15           2HB      SER  15  18.474   3.096  -6.478
  107    HB3  SER  15           1HB      SER  15  17.826   4.382  -7.499
  108    HG   SER  15           HG       SER  15  19.266   4.962  -5.625
  109    H    GLN  16           H        GLN  16  17.021   1.792  -4.416
  110    HA   GLN  16           HA       GLN  16  17.177  -0.532  -5.947
  111    HB2  GLN  16           2HB      GLN  16  18.150  -0.335  -3.709
  112    HB3  GLN  16           1HB      GLN  16  16.543  -0.240  -3.002
  113    HG2  GLN  16           2HG      GLN  16  17.455  -2.449  -2.701
  114    HG3  GLN  16           1HG      GLN  16  16.072  -2.507  -3.792
  115   HE21  GLN  16          1HE2      GLN  16  16.388  -2.963  -5.951
  116   HE22  GLN  16          2HE2      GLN  16  17.860  -3.649  -6.547
  117    H    MET  17           H        MET  17  14.446   0.855  -4.172
  118    HA   MET  17           HA       MET  17  12.674  -1.318  -4.578
  119    HB2  MET  17           2HB      MET  17  12.075   1.610  -4.095
  120    HB3  MET  17           1HB      MET  17  10.883   0.319  -4.037
  121    HG2  MET  17           2HG      MET  17  13.276   0.598  -2.232
  122    HG3  MET  17           1HG      MET  17  11.605   0.964  -1.809
  123    HE1  MET  17           3HE      MET  17   9.747  -0.756  -1.468
  124    HE2  MET  17           1HE      MET  17   9.907  -2.498  -1.685
  125    HE3  MET  17           2HE      MET  17   9.943  -1.425  -3.087
  126    H    LEU  18           H        LEU  18  13.347   1.626  -6.394
  127    HA   LEU  18           HA       LEU  18  11.314   1.312  -8.331
  128    HB2  LEU  18           2HB      LEU  18  12.450   3.440  -7.956
  129    HB3  LEU  18           1HB      LEU  18  13.966   2.748  -8.503
  130    HG   LEU  18           HG       LEU  18  12.922   2.410 -10.756
  131   HD11  LEU  18          1HD1      LEU  18  10.713   4.099  -9.591
  132   HD12  LEU  18          2HD1      LEU  18  10.584   2.397 -10.036
  133   HD13  LEU  18          3HD1      LEU  18  10.871   3.614 -11.279
  134   HD21  LEU  18          3HD2      LEU  18  14.368   4.321 -10.263
  135   HD22  LEU  18          1HD2      LEU  18  12.964   5.243  -9.727
  136   HD23  LEU  18          2HD2      LEU  18  13.101   4.744 -11.414
  137    H    SER  19           H        SER  19  14.696   0.281  -8.200
  138    HA   SER  19           HA       SER  19  14.778  -0.806 -10.816
  139    HB2  SER  19           2HB      SER  19  16.471  -1.407  -8.379
  140    HB3  SER  19           1HB      SER  19  16.839  -1.947 -10.014
  141    HG   SER  19           HG       SER  19  16.508   0.560 -10.337
  142    H    MET  20           H        MET  20  13.287  -1.881  -7.966
  143    HA   MET  20           HA       MET  20  13.378  -4.696  -8.693
  144    HB2  MET  20           2HB      MET  20  13.467  -3.740  -6.290
  145    HB3  MET  20           1HB      MET  20  11.732  -3.516  -6.469
  146    HG2  MET  20           2HG      MET  20  11.458  -5.904  -6.875
  147    HG3  MET  20           1HG      MET  20  13.198  -6.135  -6.720
  148    HE1  MET  20           3HE      MET  20  13.882  -4.136  -4.244
  149    HE2  MET  20           1HE      MET  20  14.550  -5.744  -4.532
  150    HE3  MET  20           2HE      MET  20  13.841  -5.351  -2.967
  151    H    GLY  21           H        GLY  21  11.688  -2.063  -9.654
  152    HA2  GLY  21           2HA      GLY  21   9.952  -2.077 -11.221
  153    HA3  GLY  21           1HA      GLY  21   9.564  -3.723 -10.746
  154    H    PHE  22           H        PHE  22   9.946  -1.528  -8.143
  155    HA   PHE  22           HA       PHE  22   7.024  -1.446  -7.864
  156    HB2  PHE  22           2HB      PHE  22   8.579  -2.628  -6.119
  157    HB3  PHE  22           1HB      PHE  22   8.872  -0.987  -5.556
  158    HD1  PHE  22           1HD      PHE  22   5.836  -2.822  -6.725
  159    HD2  PHE  22           2HD      PHE  22   7.684  -0.549  -3.637
  160    HE1  PHE  22           1HE      PHE  22   3.750  -2.910  -5.414
  161    HE2  PHE  22           2HE      PHE  22   5.606  -0.634  -2.325
  162    HZ   PHE  22           HZ       PHE  22   3.634  -1.818  -3.217
  163    H    SER  23           H        SER  23   6.066   0.443  -8.040
  164    HA   SER  23           HA       SER  23   7.440   2.864  -7.189
  165    HB2  SER  23           2HB      SER  23   6.376   3.810  -9.491
  166    HB3  SER  23           1HB      SER  23   8.044   3.252  -9.353
  167    HG   SER  23           HG       SER  23   7.118   1.123  -9.959
  168    H    ASP  24           H        ASP  24   5.864   4.780  -7.352
  169    HA   ASP  24           HA       ASP  24   3.155   3.819  -6.748
  170    HB2  ASP  24           2HB      ASP  24   2.980   5.764  -5.160
  171    HB3  ASP  24           1HB      ASP  24   4.081   4.492  -4.662
  172    H    GLU  25           H        GLU  25   1.425   5.293  -7.147
  173    HA   GLU  25           HA       GLU  25   1.979   7.028  -9.451
  174    HB2  GLU  25           2HB      GLU  25  -0.815   6.736  -9.032
  175    HB3  GLU  25           1HB      GLU  25   0.153   6.108 -10.355
  176    HG2  GLU  25           2HG      GLU  25  -0.927   4.241  -9.515
  177    HG3  GLU  25           1HG      GLU  25   0.677   4.149  -8.794
  178    H    GLY  26           H        GLY  26   0.071   6.884  -6.460
  179    HA2  GLY  26           2HA      GLY  26  -0.363   9.768  -6.532
  180    HA3  GLY  26           1HA      GLY  26  -1.007   8.643  -5.346
  181    H    GLY  27           H        GLY  27   2.197   7.970  -5.720
  182    HA2  GLY  27           2HA      GLY  27   4.122   8.527  -4.577
  183    HA3  GLY  27           1HA      GLY  27   3.340  10.016  -4.073
  184    H    TRP  28           H        TRP  28   2.479   6.613  -3.510
  185    HA   TRP  28           HA       TRP  28   2.250   7.258  -0.679
  186    HB2  TRP  28           2HB      TRP  28   0.980   5.212  -0.442
  187    HB3  TRP  28           1HB      TRP  28   0.308   6.210  -1.724
  188    HD1  TRP  28           HD       TRP  28   0.973   5.325  -4.315
  189    HE1  TRP  28           1HE      TRP  28   1.131   2.900  -5.159
  190    HE3  TRP  28           3HE      TRP  28   1.507   2.946   0.170
  191    HZ2  TRP  28           2HZ      TRP  28   1.431   0.307  -4.060
  192    HZ3  TRP  28           3HZ      TRP  28   1.713   0.497   0.196
  193    HH2  TRP  28           HH       TRP  28   1.684  -0.800  -1.878
  194    H    LEU  29           H        LEU  29   4.254   5.433  -2.841
  195    HA   LEU  29           HA       LEU  29   5.302   3.614  -0.913
  196    HB2  LEU  29           2HB      LEU  29   5.488   3.125  -3.276
  197    HB3  LEU  29           1HB      LEU  29   6.409   4.592  -3.545
  198    HG   LEU  29           HG       LEU  29   8.259   3.674  -2.201
  199   HD11  LEU  29          1HD1      LEU  29   7.045   2.221  -0.710
  200   HD12  LEU  29          2HD1      LEU  29   8.226   1.270  -1.614
  201   HD13  LEU  29          3HD1      LEU  29   6.520   1.218  -2.059
  202   HD21  LEU  29          3HD2      LEU  29   7.365   1.831  -4.412
  203   HD22  LEU  29          1HD2      LEU  29   9.013   2.024  -3.810
  204   HD23  LEU  29          2HD2      LEU  29   8.213   3.361  -4.635
  205    H    THR  30           H        THR  30   6.252   6.789  -2.102
  206    HA   THR  30           HA       THR  30   8.692   6.974  -0.706
  207    HB   THR  30           HB       THR  30   8.170   8.468  -2.563
  208    HG1  THR  30           1HG      THR  30   8.399  10.103  -0.254
  209   HG21  THR  30          3HG2      THR  30   6.173   9.773  -0.713
  210   HG22  THR  30          1HG2      THR  30   5.767   8.766  -2.102
  211   HG23  THR  30          2HG2      THR  30   6.598  10.304  -2.341
  212    H    ARG  31           H        ARG  31   5.427   7.267   0.359
  213    HA   ARG  31           HA       ARG  31   6.201   8.602   2.837
  214    HB2  ARG  31           2HB      ARG  31   3.515   7.828   1.701
  215    HB3  ARG  31           1HB      ARG  31   3.714   8.479   3.320
  216    HG2  ARG  31           2HG      ARG  31   4.563   9.891   0.804
  217    HG3  ARG  31           1HG      ARG  31   3.029  10.157   1.634
  218    HD2  ARG  31           2HD      ARG  31   5.760  10.575   2.862
  219    HD3  ARG  31           1HD      ARG  31   4.749  11.849   2.185
  220    HE   ARG  31           HE       ARG  31   4.347  10.437   4.697
  221   HH11  ARG  31          1HH1      ARG  31   3.044  12.652   2.314
  222   HH12  ARG  31          2HH1      ARG  31   1.922  13.376   3.416
  223   HH21  ARG  31          1HH2      ARG  31   2.864  11.387   6.149
  224   HH22  ARG  31          2HH2      ARG  31   1.810  12.654   5.594
  225    H    LEU  32           H        LEU  32   5.179   5.507   1.600
  226    HA   LEU  32           HA       LEU  32   4.522   4.209   3.988
  227    HB2  LEU  32           2HB      LEU  32   4.345   3.473   1.479
  228    HB3  LEU  32           1HB      LEU  32   5.927   2.777   1.766
  229    HG   LEU  32           HG       LEU  32   4.809   1.589   3.773
  230   HD11  LEU  32          1HD1      LEU  32   2.734   2.922   3.690
  231   HD12  LEU  32          2HD1      LEU  32   2.436   1.189   3.549
  232   HD13  LEU  32          3HD1      LEU  32   2.368   2.215   2.117
  233   HD21  LEU  32          3HD2      LEU  32   4.039  -0.229   2.286
  234   HD22  LEU  32          1HD2      LEU  32   5.619   0.410   1.826
  235   HD23  LEU  32          2HD2      LEU  32   4.181   0.866   0.913
  236    H    LEU  33           H        LEU  33   7.620   4.662   2.379
  237    HA   LEU  33           HA       LEU  33   9.104   3.042   4.189
  238    HB2  LEU  33           2HB      LEU  33  10.050   5.200   2.313
  239    HB3  LEU  33           1HB      LEU  33  11.077   4.026   3.118
  240    HG   LEU  33           HG       LEU  33   8.922   3.332   1.115
  241   HD11  LEU  33          1HD1      LEU  33  10.641   3.017  -0.493
  242   HD12  LEU  33          2HD1      LEU  33  11.904   3.296   0.705
  243   HD13  LEU  33          3HD1      LEU  33  10.864   4.624   0.194
  244   HD21  LEU  33          3HD2      LEU  33   9.419   1.566   2.759
  245   HD22  LEU  33          1HD2      LEU  33  11.119   1.637   2.300
  246   HD23  LEU  33          2HD2      LEU  33   9.907   1.122   1.126
  247    H    GLN  34           H        GLN  34   7.691   6.034   4.611
  248    HA   GLN  34           HA       GLN  34   9.771   7.079   6.357
  249    HB2  GLN  34           2HB      GLN  34   7.010   8.187   5.805
  250    HB3  GLN  34           1HB      GLN  34   8.313   9.015   6.648
  251    HG2  GLN  34           2HG      GLN  34   8.295   8.194   3.752
  252    HG3  GLN  34           1HG      GLN  34   8.102   9.829   4.380
  253   HE21  GLN  34          1HE2      GLN  34  10.103   8.674   2.559
  254   HE22  GLN  34          2HE2      GLN  34  11.645   9.001   3.279
  255    H    THR  35           H        THR  35   6.617   5.525   6.569
  256    HA   THR  35           HA       THR  35   6.688   5.761   9.481
  257    HB   THR  35           HB       THR  35   4.369   4.733   9.340
  258    HG1  THR  35           1HG      THR  35   3.436   5.137   7.138
  259   HG21  THR  35          3HG2      THR  35   4.945   7.375   8.005
  260   HG22  THR  35          1HG2      THR  35   4.634   7.092   9.715
  261   HG23  THR  35          2HG2      THR  35   3.344   6.859   8.536
  262    H    LYS  36           H        LYS  36   7.594   3.547   7.110
  263    HA   LYS  36           HA       LYS  36   7.585   1.390   9.120
  264    HB2  LYS  36           2HB      LYS  36   6.994   1.244   6.171
  265    HB3  LYS  36           1HB      LYS  36   7.508  -0.172   7.080
  266    HG2  LYS  36           2HG      LYS  36   5.446  -0.500   7.813
  267    HG3  LYS  36           1HG      LYS  36   5.376   1.139   8.470
  268    HD2  LYS  36           2HD      LYS  36   4.945   1.837   6.010
  269    HD3  LYS  36           1HD      LYS  36   4.523   0.136   5.778
  270    HE2  LYS  36           2HE      LYS  36   2.529   1.413   6.257
  271    HE3  LYS  36           1HE      LYS  36   2.877   0.332   7.603
  272    HZ1  LYS  36           3HZ      LYS  36   3.750   2.136   8.859
  273    HZ2  LYS  36           1HZ      LYS  36   2.236   2.620   8.273
  274    HZ3  LYS  36           2HZ      LYS  36   3.655   3.195   7.542
  275    H    ASN  37           H        ASN  37   9.483   3.512   7.822
  276    HA   ASN  37           HA       ASN  37  11.710   3.760   7.555
  277    HB2  ASN  37           2HB      ASN  37  11.798   2.140   9.519
  278    HB3  ASN  37           1HB      ASN  37  12.078   0.865   8.338
  279   HD21  ASN  37          1HD2      ASN  37  14.091   0.488   9.352
  280   HD22  ASN  37          2HD2      ASN  37  15.448   1.514   9.047
  281    H    TYR  38           H        TYR  38  13.608   2.904   6.250
  282    HA   TYR  38           HA       TYR  38  12.597   2.204   3.634
  283    HB2  TYR  38           2HB      TYR  38  15.392   2.825   4.622
  284    HB3  TYR  38           1HB      TYR  38  14.978   2.531   2.938
  285    HD1  TYR  38           2HD      TYR  38  14.752   4.884   5.726
  286    HD2  TYR  38           1HD      TYR  38  13.767   4.209   1.644
  287    HE1  TYR  38           2HE      TYR  38  14.266   7.275   5.453
  288    HE2  TYR  38           1HE      TYR  38  13.281   6.605   1.361
  289    HH   TYR  38           HH       TYR  38  14.199   8.944   3.609
  290    H    ASP  39           H        ASP  39  12.326   0.122   5.562
  291    HA   ASP  39           HA       ASP  39  14.445  -1.791   5.090
  292    HB2  ASP  39           2HB      ASP  39  13.121  -1.615   7.256
  293    HB3  ASP  39           1HB      ASP  39  11.774  -2.346   6.385
  294    H    ILE  40           H        ILE  40  14.559  -2.615   3.144
  295    HA   ILE  40           HA       ILE  40  12.500  -2.822   1.268
  296    HB   ILE  40           HB       ILE  40  14.997  -4.524   1.390
  297   HG12  ILE  40          2HG1      ILE  40  14.633  -1.866  -0.003
  298   HG13  ILE  40          1HG1      ILE  40  15.357  -2.026   1.593
  299   HG21  ILE  40          1HG2      ILE  40  13.378  -5.318  -0.239
  300   HG22  ILE  40          2HG2      ILE  40  14.758  -4.592  -1.059
  301   HG23  ILE  40          3HG2      ILE  40  13.243  -3.698  -0.925
  302   HD11  ILE  40          3HD1      ILE  40  16.392  -3.270  -0.943
  303   HD12  ILE  40          1HD1      ILE  40  17.134  -3.392   0.651
  304   HD13  ILE  40          2HD1      ILE  40  17.037  -1.829  -0.158
  305    H    GLY  41           H        GLY  41  13.711  -5.172   3.614
  306    HA2  GLY  41           2HA      GLY  41  12.300  -7.421   2.685
  307    HA3  GLY  41           1HA      GLY  41  12.899  -7.195   4.317
  308    H    ALA  42           H        ALA  42  11.515  -5.246   5.398
  309    HA   ALA  42           HA       ALA  42   9.023  -6.382   5.987
  310    HB1  ALA  42           1HB      ALA  42   8.560  -4.345   7.227
  311    HB2  ALA  42           2HB      ALA  42   9.902  -3.532   6.423
  312    HB3  ALA  42           3HB      ALA  42  10.215  -4.882   7.515
  313    H    ALA  43           H        ALA  43   9.925  -3.831   3.719
  314    HA   ALA  43           HA       ALA  43   7.362  -2.904   3.076
  315    HB1  ALA  43           1HB      ALA  43   9.423  -1.760   2.410
  316    HB2  ALA  43           2HB      ALA  43   8.356  -2.039   1.034
  317    HB3  ALA  43           3HB      ALA  43   9.773  -3.063   1.277
  318    H    LEU  44           H        LEU  44   9.322  -5.427   1.491
  319    HA   LEU  44           HA       LEU  44   7.339  -6.144  -0.414
  320    HB2  LEU  44           2HB      LEU  44   9.942  -7.174   0.477
  321    HB3  LEU  44           1HB      LEU  44   8.855  -8.401  -0.138
  322    HG   LEU  44           HG       LEU  44   8.657  -7.161  -2.258
  323   HD11  LEU  44          1HD1      LEU  44  10.717  -5.329  -1.049
  324   HD12  LEU  44          2HD1      LEU  44   9.041  -4.914  -1.405
  325   HD13  LEU  44          3HD1      LEU  44  10.156  -5.292  -2.719
  326   HD21  LEU  44          3HD2      LEU  44  10.271  -8.854  -2.314
  327   HD22  LEU  44          1HD2      LEU  44  11.373  -7.957  -1.268
  328   HD23  LEU  44          2HD2      LEU  44  11.113  -7.433  -2.932
  329    H    ASP  45           H        ASP  45   8.066  -7.196   2.832
  330    HA   ASP  45           HA       ASP  45   6.426  -9.516   2.833
  331    HB2  ASP  45           2HB      ASP  45   8.360  -8.852   4.412
  332    HB3  ASP  45           1HB      ASP  45   7.130  -7.957   5.302
  333    H    THR  46           H        THR  46   5.842  -6.147   3.517
  334    HA   THR  46           HA       THR  46   3.434  -6.378   4.935
  335    HB   THR  46           HB       THR  46   4.308  -4.132   3.104
  336    HG1  THR  46           1HG      THR  46   5.755  -4.636   4.873
  337   HG21  THR  46          3HG2      THR  46   2.824  -2.735   4.532
  338   HG22  THR  46          1HG2      THR  46   2.226  -4.209   5.291
  339   HG23  THR  46          2HG2      THR  46   1.945  -3.928   3.574
  340    H    ILE  47           H        ILE  47   4.074  -6.489   1.463
  341    HA   ILE  47           HA       ILE  47   1.174  -6.707   1.011
  342    HB   ILE  47           HB       ILE  47   1.622  -6.270  -1.357
  343   HG12  ILE  47          2HG1      ILE  47   4.470  -5.660  -0.569
  344   HG13  ILE  47          1HG1      ILE  47   3.988  -7.216  -1.237
  345   HG21  ILE  47          1HG2      ILE  47   2.345  -3.892  -1.100
  346   HG22  ILE  47          2HG2      ILE  47   2.735  -4.246   0.584
  347   HG23  ILE  47          3HG2      ILE  47   1.071  -4.382   0.016
  348   HD11  ILE  47          3HD1      ILE  47   3.205  -6.096  -3.263
  349   HD12  ILE  47          1HD1      ILE  47   4.912  -5.779  -2.952
  350   HD13  ILE  47          2HD1      ILE  47   3.706  -4.545  -2.591
  351    H    GLN  48           H        GLN  48   3.551  -8.698   1.686
  352    HA   GLN  48           HA       GLN  48   3.872 -10.923   1.530
  353    HB2  GLN  48           2HB      GLN  48   1.182 -10.681   0.301
  354    HB3  GLN  48           1HB      GLN  48   2.055 -12.186   0.051
  355    HG2  GLN  48           2HG      GLN  48   1.359 -10.954   2.708
  356    HG3  GLN  48           1HG      GLN  48   0.556 -12.327   1.950
  357   HE21  GLN  48          1HE2      GLN  48   0.987 -13.859   3.415
  358   HE22  GLN  48          2HE2      GLN  48   2.574 -14.402   3.835
  359    H    TYR  49           H        TYR  49   3.103  -9.392  -1.568
  360    HA   TYR  49           HA       TYR  49   4.361 -11.335  -3.196
  361    HB2  TYR  49           2HB      TYR  49   3.879  -8.400  -3.751
  362    HB3  TYR  49           1HB      TYR  49   4.344  -9.596  -4.953
  363    HD1  TYR  49           1HD      TYR  49   2.731 -11.608  -5.270
  364    HD2  TYR  49           2HD      TYR  49   1.631  -7.978  -3.342
  365    HE1  TYR  49           1HE      TYR  49   0.356 -12.109  -5.684
  366    HE2  TYR  49           2HE      TYR  49  -0.742  -8.471  -3.744
  367    HH   TYR  49           HH       TYR  49  -2.145  -9.771  -5.153
  368    H    SER  50           H        SER  50   6.298 -11.715  -1.948
  369    HA   SER  50           HA       SER  50   8.364  -9.654  -2.182
  370    HB2  SER  50           2HB      SER  50   8.725 -12.294  -0.784
  371    HB3  SER  50           1HB      SER  50   9.522 -10.753  -0.461
  372    HG   SER  50           HG       SER  50   6.974 -10.296  -0.112
  373    H    LYS  51           H        LYS  51   7.354 -12.586  -3.634
  374    HA   LYS  51           HA       LYS  51   9.964 -12.836  -4.970
  375    HB2  LYS  51           2HB      LYS  51   7.850 -14.961  -4.594
  376    HB3  LYS  51           1HB      LYS  51   9.397 -15.179  -5.400
  377    HG2  LYS  51           2HG      LYS  51  10.412 -14.425  -3.145
  378    HG3  LYS  51           1HG      LYS  51   8.819 -14.812  -2.492
  379    HD2  LYS  51           2HD      LYS  51  10.085 -16.773  -2.215
  380    HD3  LYS  51           1HD      LYS  51   9.079 -17.074  -3.631
  381    HE2  LYS  51           2HE      LYS  51  10.907 -16.638  -5.108
  382    HE3  LYS  51           1HE      LYS  51  11.916 -16.074  -3.779
  383    HZ1  LYS  51           3HZ      LYS  51  10.882 -18.842  -4.017
  384    HZ2  LYS  51           1HZ      LYS  51  12.001 -18.266  -2.888
  385    HZ3  LYS  51           2HZ      LYS  51  12.422 -18.361  -4.524
  386    H    HIS  52           H        HIS  52   6.607 -13.794  -5.646
  387    HA   HIS  52           HA       HIS  52   6.236 -12.061  -7.826
  388    HB2  HIS  52           2HB      HIS  52   7.942 -13.940  -8.646
  389    HB3  HIS  52           1HB      HIS  52   6.457 -14.871  -8.827
  390    HD1  HIS  52           1HD      HIS  52   4.827 -14.146 -10.689
  391    HD2  HIS  52           2HD      HIS  52   8.269 -11.835 -10.443
  392    HE1  HIS  52           1HE      HIS  52   4.882 -12.793 -12.806
  393    HE2  HIS  52           2HE      HIS  52   6.876 -11.268 -12.546
  394    H1   GLY   1           1HT      GLY   1 -19.141  19.559   1.660
  395    H2   GLY   1           2HT      GLY   1 -17.735  18.629   1.792
  396    H3   GLY   1           3HT      GLY   1 -18.141  19.724   3.017
  397    HA2  GLY   1           1HA      GLY   1 -18.649  17.487   3.724
  398    HA3  GLY   1           2HA      GLY   1 -20.119  18.435   3.538
  399    H    SER   2           H        SER   2 -21.065  16.213   3.410
  400    HA   SER   2           HA       SER   2 -20.757  15.064   0.720
  401    HB2  SER   2           2HB      SER   2 -22.097  13.758   3.093
  402    HB3  SER   2           1HB      SER   2 -21.542  12.990   1.606
  403    HG   SER   2           HG       SER   2 -20.043  13.961   3.782
  404    HA   PRO   3           HA       PRO   3 -24.864  16.987   0.313
  405    HB2  PRO   3           2HB      PRO   3 -24.699  17.514  -2.303
  406    HB3  PRO   3           1HB      PRO   3 -23.816  18.486  -1.122
  407    HG2  PRO   3           2HG      PRO   3 -22.821  16.271  -2.872
  408    HG3  PRO   3           1HG      PRO   3 -22.063  17.831  -2.500
  409    HD2  PRO   3           2HD      PRO   3 -21.411  15.468  -1.262
  410    HD3  PRO   3           1HD      PRO   3 -21.181  17.069  -0.533
  411    HA   PRO   4           HA       PRO   4 -27.325  13.631  -1.254
  412    HB2  PRO   4           2HB      PRO   4 -28.722  15.489  -3.093
  413    HB3  PRO   4           1HB      PRO   4 -29.381  14.473  -1.808
  414    HG2  PRO   4           2HG      PRO   4 -29.189  17.112  -1.493
  415    HG3  PRO   4           1HG      PRO   4 -28.857  16.007  -0.146
  416    HD2  PRO   4           2HD      PRO   4 -26.939  17.483  -1.908
  417    HD3  PRO   4           1HD      PRO   4 -26.872  17.204  -0.154
  418    H    GLU   5           H        GLU   5 -25.470  15.547  -3.367
  419    HA   GLU   5           HA       GLU   5 -25.977  14.214  -5.823
  420    HB2  GLU   5           2HB      GLU   5 -23.524  15.739  -4.930
  421    HB3  GLU   5           1HB      GLU   5 -23.932  15.326  -6.589
  422    HG2  GLU   5           2HG      GLU   5 -25.740  17.000  -4.881
  423    HG3  GLU   5           1HG      GLU   5 -24.412  17.698  -5.806
  424    H    ALA   6           H        ALA   6 -24.050  13.529  -3.043
  425    HA   ALA   6           HA       ALA   6 -22.425  11.544  -4.421
  426    HB1  ALA   6           1HB      ALA   6 -22.461  12.290  -1.498
  427    HB2  ALA   6           2HB      ALA   6 -21.399  13.001  -2.713
  428    HB3  ALA   6           3HB      ALA   6 -21.260  11.289  -2.312
  429    H    ASP   7           H        ASP   7 -22.748   9.410  -4.348
  430    HA   ASP   7           HA       ASP   7 -25.253   8.399  -3.460
  431    HB2  ASP   7           2HB      ASP   7 -23.859   7.565  -5.424
  432    HB3  ASP   7           1HB      ASP   7 -22.846   6.753  -4.237
  433    HA   PRO   8           HA       PRO   8 -24.142   7.635   0.780
  434    HB2  PRO   8           2HB      PRO   8 -26.182   5.879   1.331
  435    HB3  PRO   8           1HB      PRO   8 -26.355   7.636   1.323
  436    HG2  PRO   8           2HG      PRO   8 -27.064   5.650  -0.796
  437    HG3  PRO   8           1HG      PRO   8 -27.956   7.085  -0.258
  438    HD2  PRO   8           2HD      PRO   8 -26.499   7.078  -2.519
  439    HD3  PRO   8           1HD      PRO   8 -26.640   8.525  -1.498
  440    H    ARG   9           H        ARG   9 -24.567   5.122  -1.607
  441    HA   ARG   9           HA       ARG   9 -23.394   3.086   0.107
  442    HB2  ARG   9           2HB      ARG   9 -24.183   2.954  -2.810
  443    HB3  ARG   9           1HB      ARG   9 -23.740   1.587  -1.791
  444    HG2  ARG   9           2HG      ARG   9 -25.717   1.650  -0.618
  445    HG3  ARG   9           1HG      ARG   9 -26.001   3.355  -0.985
  446    HD2  ARG   9           2HD      ARG   9 -26.134   1.112  -2.990
  447    HD3  ARG   9           1HD      ARG   9 -27.526   1.821  -2.175
  448    HE   ARG   9           HE       ARG   9 -25.895   3.752  -3.561
  449   HH11  ARG   9          1HH1      ARG   9 -28.540   1.473  -3.845
  450   HH12  ARG   9          2HH1      ARG   9 -29.236   2.247  -5.231
  451   HH21  ARG   9          1HH2      ARG   9 -26.803   4.782  -5.386
  452   HH22  ARG   9          2HH2      ARG   9 -28.260   4.146  -6.100
  453    H    LEU  10           H        LEU  10 -22.459   5.342  -2.322
  454    HA   LEU  10           HA       LEU  10 -20.018   4.058  -3.075
  455    HB2  LEU  10           2HB      LEU  10 -21.094   5.640  -4.572
  456    HB3  LEU  10           1HB      LEU  10 -20.950   6.914  -3.378
  457    HG   LEU  10           HG       LEU  10 -18.421   6.598  -3.579
  458   HD11  LEU  10          1HD1      LEU  10 -17.616   5.648  -5.669
  459   HD12  LEU  10          2HD1      LEU  10 -19.262   5.195  -6.114
  460   HD13  LEU  10          3HD1      LEU  10 -18.482   4.432  -4.729
  461   HD21  LEU  10          3HD2      LEU  10 -19.991   7.627  -5.937
  462   HD22  LEU  10          1HD2      LEU  10 -18.319   8.032  -5.555
  463   HD23  LEU  10          2HD2      LEU  10 -19.616   8.526  -4.466
  464    H    ILE  11           H        ILE  11 -20.914   6.626  -0.819
  465    HA   ILE  11           HA       ILE  11 -18.243   7.156   0.020
  466    HB   ILE  11           HB       ILE  11 -20.137   8.778   0.250
  467   HG12  ILE  11          2HG1      ILE  11 -18.770   8.158   2.872
  468   HG13  ILE  11          1HG1      ILE  11 -17.971   8.939   1.511
  469   HG21  ILE  11          1HG2      ILE  11 -21.662   8.601   2.129
  470   HG22  ILE  11          2HG2      ILE  11 -20.939   7.063   2.599
  471   HG23  ILE  11          3HG2      ILE  11 -21.826   7.192   1.079
  472   HD11  ILE  11          3HD1      ILE  11 -19.498  10.804   1.657
  473   HD12  ILE  11          1HD1      ILE  11 -18.708  10.536   3.212
  474   HD13  ILE  11          2HD1      ILE  11 -20.375  10.011   2.967
  475    H    GLU  12           H        GLU  12 -20.624   4.810   0.849
  476    HA   GLU  12           HA       GLU  12 -19.656   4.116   3.423
  477    HB2  GLU  12           2HB      GLU  12 -21.568   2.950   1.479
  478    HB3  GLU  12           1HB      GLU  12 -20.876   1.849   2.662
  479    HG2  GLU  12           2HG      GLU  12 -22.401   4.373   3.256
  480    HG3  GLU  12           1HG      GLU  12 -22.977   2.719   3.462
  481    H    SER  13           H        SER  13 -18.436   3.550   0.302
  482    HA   SER  13           HA       SER  13 -17.168   1.054   0.762
  483    HB2  SER  13           2HB      SER  13 -16.309   3.244  -1.147
  484    HB3  SER  13           1HB      SER  13 -15.903   1.530  -1.252
  485    HG   SER  13           HG       SER  13 -18.587   1.914  -1.111
  486    H    LEU  14           H        LEU  14 -16.415   4.341   1.580
  487    HA   LEU  14           HA       LEU  14 -13.639   3.902   2.170
  488    HB2  LEU  14           2HB      LEU  14 -15.408   6.115   3.215
  489    HB3  LEU  14           1HB      LEU  14 -13.663   6.133   3.064
  490    HG   LEU  14           HG       LEU  14 -15.432   5.918   0.643
  491   HD11  LEU  14          1HD1      LEU  14 -15.282   8.330   0.387
  492   HD12  LEU  14          2HD1      LEU  14 -14.461   8.460   1.943
  493   HD13  LEU  14          3HD1      LEU  14 -16.135   7.907   1.872
  494   HD21  LEU  14          3HD2      LEU  14 -12.622   6.915   1.065
  495   HD22  LEU  14          1HD2      LEU  14 -13.485   6.881  -0.473
  496   HD23  LEU  14          2HD2      LEU  14 -13.088   5.373   0.349
  497    H    SER  15           H        SER  15 -16.616   4.273   4.053
  498    HA   SER  15           HA       SER  15 -15.465   3.881   6.593
  499    HB2  SER  15           2HB      SER  15 -18.167   3.020   6.633
  500    HB3  SER  15           1HB      SER  15 -17.527   4.590   7.121
  501    HG   SER  15           HG       SER  15 -19.200   4.436   5.323
  502    H    GLN  16           H        GLN  16 -16.598   1.692   4.126
  503    HA   GLN  16           HA       GLN  16 -16.931  -0.646   5.625
  504    HB2  GLN  16           2HB      GLN  16 -17.613  -0.428   3.265
  505    HB3  GLN  16           1HB      GLN  16 -15.923  -0.355   2.786
  506    HG2  GLN  16           2HG      GLN  16 -16.839  -2.557   2.376
  507    HG3  GLN  16           1HG      GLN  16 -15.586  -2.628   3.613
  508   HE21  GLN  16          1HE2      GLN  16 -16.331  -4.507   4.518
  509   HE22  GLN  16          2HE2      GLN  16 -17.798  -4.597   5.425
  510    H    MET  17           H        MET  17 -14.047   0.699   4.051
  511    HA   MET  17           HA       MET  17 -12.285  -1.403   4.697
  512    HB2  MET  17           2HB      MET  17 -11.696   1.536   4.250
  513    HB3  MET  17           1HB      MET  17 -10.489   0.257   4.278
  514    HG2  MET  17           2HG      MET  17 -12.760   0.474   2.312
  515    HG3  MET  17           1HG      MET  17 -11.089   0.943   2.003
  516    HE1  MET  17           3HE      MET  17  -9.242  -0.627   1.275
  517    HE2  MET  17           1HE      MET  17  -9.183  -2.340   1.686
  518    HE3  MET  17           2HE      MET  17  -9.176  -1.127   2.966
  519    H    LEU  18           H        LEU  18 -13.147   1.582   6.368
  520    HA   LEU  18           HA       LEU  18 -11.329   1.347   8.505
  521    HB2  LEU  18           2HB      LEU  18 -12.651   3.390   7.814
  522    HB3  LEU  18           1HB      LEU  18 -14.043   2.669   8.599
  523    HG   LEU  18           HG       LEU  18 -12.759   2.670  10.743
  524   HD11  LEU  18          1HD1      LEU  18 -10.798   4.327   9.162
  525   HD12  LEU  18          2HD1      LEU  18 -10.504   2.716   9.816
  526   HD13  LEU  18          3HD1      LEU  18 -10.770   4.076  10.907
  527   HD21  LEU  18          3HD2      LEU  18 -14.377   4.420  10.222
  528   HD22  LEU  18          1HD2      LEU  18 -13.115   5.353   9.414
  529   HD23  LEU  18          2HD2      LEU  18 -13.020   5.059  11.151
  530    H    SER  19           H        SER  19 -14.629   0.149   8.053
  531    HA   SER  19           HA       SER  19 -14.971  -0.824  10.697
  532    HB2  SER  19           2HB      SER  19 -16.392  -1.188   8.096
  533    HB3  SER  19           1HB      SER  19 -16.730  -2.329   9.396
  534    HG   SER  19           HG       SER  19 -17.161  -0.457  10.730
  535    H    MET  20           H        MET  20 -13.350  -2.083   7.911
  536    HA   MET  20           HA       MET  20 -13.291  -4.802   8.903
  537    HB2  MET  20           2HB      MET  20 -12.070  -3.403   6.538
  538    HB3  MET  20           1HB      MET  20 -11.560  -5.025   6.983
  539    HG2  MET  20           2HG      MET  20 -14.369  -4.194   6.293
  540    HG3  MET  20           1HG      MET  20 -13.256  -5.052   5.235
  541    HE1  MET  20           3HE      MET  20 -11.875  -7.098   7.403
  542    HE2  MET  20           1HE      MET  20 -12.321  -7.450   5.732
  543    HE3  MET  20           2HE      MET  20 -12.881  -8.501   7.031
  544    H    GLY  21           H        GLY  21 -11.663  -1.968   9.588
  545    HA2  GLY  21           2HA      GLY  21 -10.052  -1.810  11.316
  546    HA3  GLY  21           1HA      GLY  21  -9.561  -3.462  10.977
  547    H    PHE  22           H        PHE  22  -9.992  -1.207   8.370
  548    HA   PHE  22           HA       PHE  22  -7.083  -1.239   7.962
  549    HB2  PHE  22           2HB      PHE  22  -9.012  -2.048   6.243
  550    HB3  PHE  22           1HB      PHE  22  -8.857  -0.365   5.763
  551    HD1  PHE  22           2HD      PHE  22  -6.220   0.366   5.654
  552    HD2  PHE  22           1HD      PHE  22  -7.813  -3.523   4.990
  553    HE1  PHE  22           2HE      PHE  22  -4.248  -0.205   4.300
  554    HE2  PHE  22           1HE      PHE  22  -5.843  -4.105   3.634
  555    HZ   PHE  22           HZ       PHE  22  -4.055  -2.439   3.288
  556    H    SER  23           H        SER  23  -6.003   0.569   8.254
  557    HA   SER  23           HA       SER  23  -7.040   3.137   7.481
  558    HB2  SER  23           2HB      SER  23  -6.179   3.751  10.055
  559    HB3  SER  23           1HB      SER  23  -7.855   3.715   9.509
  560    HG   SER  23           HG       SER  23  -6.898   1.237  10.131
  561    H    ASP  24           H        ASP  24  -5.332   4.645   7.183
  562    HA   ASP  24           HA       ASP  24  -2.661   3.515   7.668
  563    HB2  ASP  24           2HB      ASP  24  -1.968   3.937   5.544
  564    HB3  ASP  24           1HB      ASP  24  -3.679   3.697   5.224
  565    H    GLU  25           H        GLU  25  -0.948   5.442   7.245
  566    HA   GLU  25           HA       GLU  25  -1.759   7.497   9.176
  567    HB2  GLU  25           2HB      GLU  25   1.108   7.033   8.486
  568    HB3  GLU  25           1HB      GLU  25   0.390   7.548  10.004
  569    HG2  GLU  25           2HG      GLU  25   0.949   5.453  10.612
  570    HG3  GLU  25           1HG      GLU  25  -0.621   5.089   9.902
  571    H    GLY  26           H        GLY  26   0.482   7.266   6.407
  572    HA2  GLY  26           2HA      GLY  26   0.748  10.064   6.100
  573    HA3  GLY  26           1HA      GLY  26   1.218   8.858   4.921
  574    H    GLY  27           H        GLY  27  -1.792   8.014   5.094
  575    HA2  GLY  27           2HA      GLY  27  -3.831   8.882   4.249
  576    HA3  GLY  27           1HA      GLY  27  -2.955  10.269   3.611
  577    H    TRP  28           H        TRP  28  -2.107   6.860   3.253
  578    HA   TRP  28           HA       TRP  28  -2.177   7.277   0.360
  579    HB2  TRP  28           2HB      TRP  28  -0.748   5.412   0.105
  580    HB3  TRP  28           1HB      TRP  28  -0.109   6.354   1.440
  581    HD1  TRP  28           HD       TRP  28  -0.157   5.225   3.866
  582    HE1  TRP  28           1HE      TRP  28  -0.404   2.777   4.617
  583    HE3  TRP  28           3HE      TRP  28  -1.897   3.199  -0.494
  584    HZ2  TRP  28           2HZ      TRP  28  -1.208   0.309   3.510
  585    HZ3  TRP  28           3HZ      TRP  28  -2.374   0.788  -0.566
  586    HH2  TRP  28           HH       TRP  28  -2.034  -0.628   1.393
  587    H    LEU  29           H        LEU  29  -3.907   5.590   2.839
  588    HA   LEU  29           HA       LEU  29  -5.065   3.598   1.156
  589    HB2  LEU  29           2HB      LEU  29  -5.071   3.405   3.604
  590    HB3  LEU  29           1HB      LEU  29  -6.105   4.815   3.719
  591    HG   LEU  29           HG       LEU  29  -7.863   3.547   2.470
  592   HD11  LEU  29          1HD1      LEU  29  -6.424   1.916   1.374
  593   HD12  LEU  29          2HD1      LEU  29  -7.666   1.121   2.340
  594   HD13  LEU  29          3HD1      LEU  29  -6.012   1.215   2.939
  595   HD21  LEU  29          3HD2      LEU  29  -6.865   2.500   5.107
  596   HD22  LEU  29          1HD2      LEU  29  -8.416   2.045   4.404
  597   HD23  LEU  29          2HD2      LEU  29  -8.099   3.729   4.822
  598    H    THR  30           H        THR  30  -6.082   6.804   2.230
  599    HA   THR  30           HA       THR  30  -8.548   6.795   0.805
  600    HB   THR  30           HB       THR  30  -8.162   8.277   2.746
  601    HG1  THR  30           1HG      THR  30  -9.366   9.891   1.919
  602   HG21  THR  30          3HG2      THR  30  -6.316   9.783   0.894
  603   HG22  THR  30          1HG2      THR  30  -5.826   8.864   2.320
  604   HG23  THR  30          2HG2      THR  30  -6.822  10.308   2.499
  605    H    ARG  31           H        ARG  31  -5.313   7.181  -0.137
  606    HA   ARG  31           HA       ARG  31  -5.911   8.768  -2.504
  607    HB2  ARG  31           2HB      ARG  31  -3.718   8.645  -0.905
  608    HB3  ARG  31           1HB      ARG  31  -3.238   7.544  -2.187
  609    HG2  ARG  31           2HG      ARG  31  -3.604   9.286  -3.848
  610    HG3  ARG  31           1HG      ARG  31  -4.128  10.395  -2.579
  611    HD2  ARG  31           2HD      ARG  31  -1.399   9.148  -2.861
  612    HD3  ARG  31           1HD      ARG  31  -1.820  10.829  -3.178
  613    HE   ARG  31           HE       ARG  31  -2.436  10.002  -0.496
  614   HH11  ARG  31          1HH1      ARG  31   0.126  11.129  -2.601
  615   HH12  ARG  31          2HH1      ARG  31   1.019  11.879  -1.315
  616   HH21  ARG  31          1HH2      ARG  31  -1.224  10.975   1.200
  617   HH22  ARG  31          2HH2      ARG  31   0.264  11.779   0.828
  618    H    LEU  32           H        LEU  32  -4.883   5.524  -1.602
  619    HA   LEU  32           HA       LEU  32  -4.478   4.445  -4.144
  620    HB2  LEU  32           2HB      LEU  32  -3.941   3.447  -1.857
  621    HB3  LEU  32           1HB      LEU  32  -5.616   2.940  -1.792
  622    HG   LEU  32           HG       LEU  32  -4.997   1.848  -4.133
  623   HD11  LEU  32          1HD1      LEU  32  -2.734   2.695  -4.227
  624   HD12  LEU  32          2HD1      LEU  32  -2.710   0.940  -4.059
  625   HD13  LEU  32          3HD1      LEU  32  -2.365   1.963  -2.666
  626   HD21  LEU  32          3HD2      LEU  32  -4.489  -0.240  -2.911
  627   HD22  LEU  32          1HD2      LEU  32  -5.877   0.625  -2.252
  628   HD23  LEU  32          2HD2      LEU  32  -4.321   0.702  -1.429
  629    H    LEU  33           H        LEU  33  -7.406   4.901  -2.273
  630    HA   LEU  33           HA       LEU  33  -9.082   3.324  -3.943
  631    HB2  LEU  33           2HB      LEU  33  -9.772   5.510  -1.983
  632    HB3  LEU  33           1HB      LEU  33 -10.928   4.418  -2.722
  633    HG   LEU  33           HG       LEU  33  -8.677   3.566  -0.900
  634   HD11  LEU  33          1HD1      LEU  33 -10.472   3.153   0.731
  635   HD12  LEU  33          2HD1      LEU  33 -11.628   3.897  -0.373
  636   HD13  LEU  33          3HD1      LEU  33 -10.321   4.860   0.319
  637   HD21  LEU  33          3HD2      LEU  33  -9.351   1.857  -2.523
  638   HD22  LEU  33          1HD2      LEU  33 -11.025   2.025  -1.997
  639   HD23  LEU  33          2HD2      LEU  33  -9.805   1.410  -0.879
  640    H    GLN  34           H        GLN  34  -7.624   6.300  -4.483
  641    HA   GLN  34           HA       GLN  34  -9.811   7.281  -6.165
  642    HB2  GLN  34           2HB      GLN  34  -7.114   8.591  -5.777
  643    HB3  GLN  34           1HB      GLN  34  -8.597   9.323  -6.369
  644    HG2  GLN  34           2HG      GLN  34  -8.050   8.389  -3.562
  645    HG3  GLN  34           1HG      GLN  34  -8.125  10.056  -4.120
  646   HE21  GLN  34          1HE2      GLN  34  -9.641   8.659  -2.060
  647   HE22  GLN  34          2HE2      GLN  34 -11.310   8.857  -2.482
  648    H    THR  35           H        THR  35  -6.509   6.063  -6.385
  649    HA   THR  35           HA       THR  35  -6.460   6.354  -9.265
  650    HB   THR  35           HB       THR  35  -4.244   4.996  -8.884
  651    HG1  THR  35           1HG      THR  35  -3.485   5.051  -6.827
  652   HG21  THR  35          3HG2      THR  35  -4.586   7.837  -7.918
  653   HG22  THR  35          1HG2      THR  35  -4.364   7.336  -9.596
  654   HG23  THR  35          2HG2      THR  35  -3.069   7.093  -8.424
  655    H    LYS  36           H        LYS  36  -6.990   3.802  -6.916
  656    HA   LYS  36           HA       LYS  36  -7.209   1.880  -9.136
  657    HB2  LYS  36           2HB      LYS  36  -6.677   1.392  -6.199
  658    HB3  LYS  36           1HB      LYS  36  -6.901   0.124  -7.399
  659    HG2  LYS  36           2HG      LYS  36  -4.939   0.918  -8.616
  660    HG3  LYS  36           1HG      LYS  36  -4.713   2.199  -7.425
  661    HD2  LYS  36           2HD      LYS  36  -4.269   0.589  -5.704
  662    HD3  LYS  36           1HD      LYS  36  -4.694  -0.745  -6.777
  663    HE2  LYS  36           2HE      LYS  36  -2.288  -0.573  -6.612
  664    HE3  LYS  36           1HE      LYS  36  -2.805  -0.140  -8.241
  665    HZ1  LYS  36           3HZ      LYS  36  -2.594   2.204  -7.631
  666    HZ2  LYS  36           1HZ      LYS  36  -1.130   1.384  -7.423
  667    HZ3  LYS  36           2HZ      LYS  36  -2.079   1.771  -6.084
  668    H    ASN  37           H        ASN  37  -9.158   3.854  -7.685
  669    HA   ASN  37           HA       ASN  37 -11.417   3.988  -7.471
  670    HB2  ASN  37           2HB      ASN  37 -11.452   2.506  -9.476
  671    HB3  ASN  37           1HB      ASN  37 -11.484   1.112  -8.406
  672   HD21  ASN  37          1HD2      ASN  37 -13.430   0.404  -9.214
  673   HD22  ASN  37          2HD2      ASN  37 -14.929   1.190  -8.858
  674    H    TYR  38           H        TYR  38 -13.296   3.004  -6.232
  675    HA   TYR  38           HA       TYR  38 -12.301   2.202  -3.627
  676    HB2  TYR  38           2HB      TYR  38 -15.186   2.697  -4.345
  677    HB3  TYR  38           1HB      TYR  38 -14.412   2.843  -2.772
  678    HD1  TYR  38           1HD      TYR  38 -12.931   4.785  -2.304
  679    HD2  TYR  38           2HD      TYR  38 -15.194   4.499  -5.891
  680    HE1  TYR  38           1HE      TYR  38 -12.615   7.193  -2.690
  681    HE2  TYR  38           2HE      TYR  38 -14.881   6.901  -6.289
  682    HH   TYR  38           HH       TYR  38 -12.609   8.732  -4.827
  683    H    ASP  39           H        ASP  39 -12.115   0.229  -5.685
  684    HA   ASP  39           HA       ASP  39 -14.275  -1.658  -5.276
  685    HB2  ASP  39           2HB      ASP  39 -13.056  -1.409  -7.475
  686    HB3  ASP  39           1HB      ASP  39 -11.640  -2.110  -6.699
  687    H    ILE  40           H        ILE  40 -14.352  -2.667  -3.399
  688    HA   ILE  40           HA       ILE  40 -12.225  -2.953  -1.586
  689    HB   ILE  40           HB       ILE  40 -14.680  -4.702  -1.652
  690   HG12  ILE  40          2HG1      ILE  40 -14.488  -2.039  -0.254
  691   HG13  ILE  40          1HG1      ILE  40 -15.111  -2.179  -1.894
  692   HG21  ILE  40          1HG2      ILE  40 -12.995  -5.355  -0.031
  693   HG22  ILE  40          2HG2      ILE  40 -14.408  -4.696   0.790
  694   HG23  ILE  40          3HG2      ILE  40 -12.952  -3.715   0.613
  695   HD11  ILE  40          3HD1      ILE  40 -16.243  -3.569   0.522
  696   HD12  ILE  40          1HD1      ILE  40 -16.880  -3.643  -1.120
  697   HD13  ILE  40          2HD1      ILE  40 -16.898  -2.118  -0.236
  698    H    GLY  41           H        GLY  41 -13.448  -5.047  -4.116
  699    HA2  GLY  41           2HA      GLY  41 -12.123  -7.423  -3.365
  700    HA3  GLY  41           1HA      GLY  41 -12.666  -7.022  -4.989
  701    H    ALA  42           H        ALA  42 -11.191  -4.902  -5.693
  702    HA   ALA  42           HA       ALA  42  -8.662  -6.045  -6.277
  703    HB1  ALA  42           1HB      ALA  42  -8.169  -3.927  -7.373
  704    HB2  ALA  42           2HB      ALA  42  -9.570  -3.186  -6.600
  705    HB3  ALA  42           3HB      ALA  42  -9.796  -4.476  -7.781
  706    H    ALA  43           H        ALA  43  -9.760  -3.720  -3.886
  707    HA   ALA  43           HA       ALA  43  -7.303  -2.691  -3.059
  708    HB1  ALA  43           1HB      ALA  43  -9.724  -3.190  -1.335
  709    HB2  ALA  43           2HB      ALA  43  -9.496  -1.792  -2.385
  710    HB3  ALA  43           3HB      ALA  43  -8.419  -2.051  -1.012
  711    H    LEU  44           H        LEU  44  -9.119  -5.433  -1.667
  712    HA   LEU  44           HA       LEU  44  -7.084  -6.117   0.192
  713    HB2  LEU  44           2HB      LEU  44  -9.644  -7.267  -0.718
  714    HB3  LEU  44           1HB      LEU  44  -8.492  -8.415  -0.069
  715    HG   LEU  44           HG       LEU  44  -8.369  -7.037   2.009
  716   HD11  LEU  44          1HD1      LEU  44 -10.079  -5.372   2.429
  717   HD12  LEU  44          2HD1      LEU  44 -10.712  -5.579   0.797
  718   HD13  LEU  44          3HD1      LEU  44  -9.098  -4.909   1.040
  719   HD21  LEU  44          3HD2      LEU  44 -11.100  -8.066   1.241
  720   HD22  LEU  44          1HD2      LEU  44 -10.534  -7.766   2.884
  721   HD23  LEU  44          2HD2      LEU  44  -9.772  -9.018   1.906
  722    H    ASP  45           H        ASP  45  -7.799  -7.094  -3.086
  723    HA   ASP  45           HA       ASP  45  -6.119  -9.371  -3.210
  724    HB2  ASP  45           2HB      ASP  45  -7.925  -8.901  -4.833
  725    HB3  ASP  45           1HB      ASP  45  -7.011  -7.524  -5.437
  726    H    THR  46           H        THR  46  -5.592  -5.958  -3.824
  727    HA   THR  46           HA       THR  46  -3.160  -5.998  -5.139
  728    HB   THR  46           HB       THR  46  -4.234  -3.974  -3.170
  729    HG1  THR  46           1HG      THR  46  -5.515  -4.167  -5.015
  730   HG21  THR  46          3HG2      THR  46  -2.663  -2.381  -4.189
  731   HG22  THR  46          1HG2      THR  46  -1.955  -3.691  -5.132
  732   HG23  THR  46          2HG2      THR  46  -1.814  -3.693  -3.374
  733    H    ILE  47           H        ILE  47  -3.732  -6.202  -1.633
  734    HA   ILE  47           HA       ILE  47  -0.830  -6.349  -1.234
  735    HB   ILE  47           HB       ILE  47  -1.273  -6.046   1.155
  736   HG12  ILE  47          2HG1      ILE  47  -4.161  -5.557   0.433
  737   HG13  ILE  47          1HG1      ILE  47  -3.591  -7.118   1.011
  738   HG21  ILE  47          1HG2      ILE  47  -0.977  -4.134  -0.465
  739   HG22  ILE  47          2HG2      ILE  47  -1.775  -3.740   1.057
  740   HG23  ILE  47          3HG2      ILE  47  -2.729  -3.930  -0.414
  741   HD11  ILE  47          3HD1      ILE  47  -2.814  -6.056   3.075
  742   HD12  ILE  47          1HD1      ILE  47  -4.546  -5.835   2.823
  743   HD13  ILE  47          2HD1      ILE  47  -3.431  -4.509   2.498
  744    H    GLN  48           H        GLN  48  -3.016  -8.483  -2.018
  745    HA   GLN  48           HA       GLN  48  -3.127 -10.740  -1.948
  746    HB2  GLN  48           2HB      GLN  48  -0.508 -10.284  -1.369
  747    HB3  GLN  48           1HB      GLN  48  -1.018 -11.199   0.040
  748    HG2  GLN  48           2HG      GLN  48  -2.078 -12.524  -2.201
  749    HG3  GLN  48           1HG      GLN  48  -0.401 -12.132  -2.581
  750   HE21  GLN  48          1HE2      GLN  48   0.266 -14.249  -2.488
  751   HE22  GLN  48          2HE2      GLN  48   0.397 -15.122  -1.000
  752    H    TYR  49           H        TYR  49  -2.650  -9.249   1.231
  753    HA   TYR  49           HA       TYR  49  -3.784 -11.285   2.785
  754    HB2  TYR  49           2HB      TYR  49  -3.607  -8.306   3.233
  755    HB3  TYR  49           1HB      TYR  49  -4.244  -9.420   4.435
  756    HD1  TYR  49           1HD      TYR  49  -2.767 -11.045   5.533
  757    HD2  TYR  49           2HD      TYR  49  -1.247  -8.191   2.767
  758    HE1  TYR  49           1HE      TYR  49  -0.482 -11.489   6.336
  759    HE2  TYR  49           2HE      TYR  49   1.037  -8.627   3.562
  760    HH   TYR  49           HH       TYR  49   2.232  -9.519   5.346
  761    H    SER  50           H        SER  50  -5.659 -12.150   2.114
  762    HA   SER  50           HA       SER  50  -7.971 -10.334   1.898
  763    HB2  SER  50           2HB      SER  50  -7.738 -13.025   0.537
  764    HB3  SER  50           1HB      SER  50  -8.930 -11.759   0.235
  765    HG   SER  50           HG       SER  50  -6.318 -10.943  -0.066
  766    H    LYS  51           H        LYS  51  -6.875 -13.554   2.912
  767    HA   LYS  51           HA       LYS  51  -9.360 -14.148   4.242
  768    HB2  LYS  51           2HB      LYS  51  -6.689 -15.518   4.086
  769    HB3  LYS  51           1HB      LYS  51  -7.915 -16.062   5.221
  770    HG2  LYS  51           2HG      LYS  51  -9.451 -16.491   3.394
  771    HG3  LYS  51           1HG      LYS  51  -8.270 -15.878   2.234
  772    HD2  LYS  51           2HD      LYS  51  -8.176 -18.279   2.222
  773    HD3  LYS  51           1HD      LYS  51  -6.709 -17.662   2.977
  774    HE2  LYS  51           2HE      LYS  51  -7.711 -18.070   5.194
  775    HE3  LYS  51           1HE      LYS  51  -9.123 -18.765   4.402
  776    HZ1  LYS  51           3HZ      LYS  51  -7.732 -20.483   3.468
  777    HZ2  LYS  51           1HZ      LYS  51  -7.553 -20.455   5.148
  778    HZ3  LYS  51           2HZ      LYS  51  -6.351 -19.794   4.161
  779    H    HIS  52           H        HIS  52  -6.048 -14.037   5.546
  780    HA   HIS  52           HA       HIS  52  -6.713 -12.150   7.583
  781    HB2  HIS  52           2HB      HIS  52  -7.712 -14.419   8.349
  782    HB3  HIS  52           1HB      HIS  52  -6.040 -14.898   8.610
  783    HD1  HIS  52           1HD      HIS  52  -4.813 -13.896  10.625
  784    HD2  HIS  52           2HD      HIS  52  -8.680 -12.451  10.138
  785    HE1  HIS  52           1HE      HIS  52  -5.343 -12.657  12.747
  786    HE2  HIS  52           2HE      HIS  52  -7.677 -11.765  12.424
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1  17.776  18.778  -1.667
    2    H2   GLY   1           2HT      GLY   1  17.145  17.510  -2.595
    3    H3   GLY   1           3HT      GLY   1  17.428  19.018  -3.304
    4    HA2  GLY   1           1HA      GLY   1  19.160  17.538  -3.973
    5    HA3  GLY   1           2HA      GLY   1  19.812  18.760  -2.894
    6    H    SER   2           H        SER   2  20.892  16.142  -3.463
    7    HA   SER   2           HA       SER   2  20.439  14.667  -0.992
    8    HB2  SER   2           2HB      SER   2  22.298  13.924  -3.258
    9    HB3  SER   2           1HB      SER   2  21.629  12.860  -2.019
   10    HG   SER   2           HG       SER   2  20.633  13.312  -4.377
   11    HA   PRO   3           HA       PRO   3  24.040  16.839   0.583
   12    HB2  PRO   3           2HB      PRO   3  23.698  16.180   3.167
   13    HB3  PRO   3           1HB      PRO   3  22.705  17.403   2.370
   14    HG2  PRO   3           2HG      PRO   3  22.055  14.566   3.020
   15    HG3  PRO   3           1HG      PRO   3  21.022  16.004   3.103
   16    HD2  PRO   3           2HD      PRO   3  21.000  14.168   1.041
   17    HD3  PRO   3           1HD      PRO   3  20.435  15.843   0.908
   18    HA   PRO   4           HA       PRO   4  27.007  13.516   0.709
   19    HB2  PRO   4           2HB      PRO   4  28.753  15.289   2.277
   20    HB3  PRO   4           1HB      PRO   4  28.995  14.625   0.659
   21    HG2  PRO   4           2HG      PRO   4  28.477  17.231   1.066
   22    HG3  PRO   4           1HG      PRO   4  27.882  16.365  -0.361
   23    HD2  PRO   4           2HD      PRO   4  26.416  17.120   2.140
   24    HD3  PRO   4           1HD      PRO   4  25.872  17.189   0.453
   25    H    GLU   5           H        GLU   5  25.622  14.955   3.448
   26    HA   GLU   5           HA       GLU   5  26.972  13.298   5.391
   27    HB2  GLU   5           2HB      GLU   5  24.741  15.313   5.561
   28    HB3  GLU   5           1HB      GLU   5  25.221  14.332   6.940
   29    HG2  GLU   5           2HG      GLU   5  26.993  16.235   5.420
   30    HG3  GLU   5           1HG      GLU   5  26.261  16.528   7.000
   31    H    ALA   6           H        ALA   6  24.589  12.805   3.160
   32    HA   ALA   6           HA       ALA   6  22.953  11.023   4.783
   33    HB1  ALA   6           1HB      ALA   6  22.795  11.741   1.856
   34    HB2  ALA   6           2HB      ALA   6  21.805  12.409   3.155
   35    HB3  ALA   6           3HB      ALA   6  21.651  10.709   2.713
   36    H    ASP   7           H        ASP   7  22.947   8.802   4.585
   37    HA   ASP   7           HA       ASP   7  25.391   7.629   3.729
   38    HB2  ASP   7           2HB      ASP   7  23.862   6.827   5.627
   39    HB3  ASP   7           1HB      ASP   7  22.883   6.088   4.363
   40    HA   PRO   8           HA       PRO   8  24.331   7.288  -0.600
   41    HB2  PRO   8           2HB      PRO   8  26.626   5.405  -0.547
   42    HB3  PRO   8           1HB      PRO   8  26.346   6.813  -1.576
   43    HG2  PRO   8           2HG      PRO   8  28.121   6.912   0.404
   44    HG3  PRO   8           1HG      PRO   8  27.089   8.306   0.030
   45    HD2  PRO   8           2HD      PRO   8  26.856   6.312   2.247
   46    HD3  PRO   8           1HD      PRO   8  26.570   8.065   2.267
   47    H    ARG   9           H        ARG   9  24.661   4.653   1.656
   48    HA   ARG   9           HA       ARG   9  23.619   2.693  -0.221
   49    HB2  ARG   9           2HB      ARG   9  24.290   2.445   2.715
   50    HB3  ARG   9           1HB      ARG   9  23.848   1.118   1.654
   51    HG2  ARG   9           2HG      ARG   9  25.856   1.162   0.528
   52    HG3  ARG   9           1HG      ARG   9  26.177   2.843   0.959
   53    HD2  ARG   9           2HD      ARG   9  26.163   0.556   2.915
   54    HD3  ARG   9           1HD      ARG   9  27.612   1.204   2.150
   55    HE   ARG   9           HE       ARG   9  25.936   3.082   3.629
   56   HH11  ARG   9          1HH1      ARG   9  28.808   1.072   3.536
   57   HH12  ARG   9          2HH1      ARG   9  29.588   1.900   4.843
   58   HH21  ARG   9          1HH2      ARG   9  26.960   4.190   5.346
   59   HH22  ARG   9          2HH2      ARG   9  28.539   3.671   5.875
   60    H    LEU  10           H        LEU  10  22.604   4.447   2.666
   61    HA   LEU  10           HA       LEU  10  20.119   3.148   2.986
   62    HB2  LEU  10           2HB      LEU  10  21.211   4.516   4.738
   63    HB3  LEU  10           1HB      LEU  10  20.873   5.954   3.793
   64    HG   LEU  10           HG       LEU  10  18.427   5.409   3.992
   65   HD11  LEU  10          1HD1      LEU  10  17.760   3.884   5.792
   66   HD12  LEU  10          2HD1      LEU  10  19.445   3.410   6.006
   67   HD13  LEU  10          3HD1      LEU  10  18.611   3.043   4.496
   68   HD21  LEU  10          3HD2      LEU  10  18.259   6.186   6.328
   69   HD22  LEU  10          1HD2      LEU  10  19.416   7.114   5.375
   70   HD23  LEU  10          2HD2      LEU  10  19.990   5.901   6.519
   71    H    ILE  11           H        ILE  11  21.071   6.062   1.225
   72    HA   ILE  11           HA       ILE  11  18.435   6.766   0.440
   73    HB   ILE  11           HB       ILE  11  20.325   8.371   0.464
   74   HG12  ILE  11          2HG1      ILE  11  19.050   8.109  -2.269
   75   HG13  ILE  11          1HG1      ILE  11  18.241   8.780  -0.855
   76   HG21  ILE  11          1HG2      ILE  11  21.851   8.396  -1.513
   77   HG22  ILE  11          2HG2      ILE  11  21.252   6.791  -1.921
   78   HG23  ILE  11          3HG2      ILE  11  22.112   7.049  -0.404
   79   HD11  ILE  11          3HD1      ILE  11  19.962  10.544  -0.754
   80   HD12  ILE  11          1HD1      ILE  11  19.048  10.553  -2.264
   81   HD13  ILE  11          2HD1      ILE  11  20.680   9.887  -2.226
   82    H    GLU  12           H        GLU  12  20.625   4.374  -0.653
   83    HA   GLU  12           HA       GLU  12  19.644   4.192  -3.330
   84    HB2  GLU  12           2HB      GLU  12  21.526   2.640  -1.649
   85    HB3  GLU  12           1HB      GLU  12  20.777   1.792  -2.995
   86    HG2  GLU  12           2HG      GLU  12  22.471   4.267  -3.107
   87    HG3  GLU  12           1HG      GLU  12  22.846   2.672  -3.758
   88    H    SER  13           H        SER  13  18.406   3.217  -0.331
   89    HA   SER  13           HA       SER  13  17.083   0.838  -1.011
   90    HB2  SER  13           2HB      SER  13  15.999   2.910   0.904
   91    HB3  SER  13           1HB      SER  13  15.775   1.161   0.960
   92    HG   SER  13           HG       SER  13  17.923   2.722   1.785
   93    H    LEU  14           H        LEU  14  16.327   4.196  -1.613
   94    HA   LEU  14           HA       LEU  14  13.631   3.742  -2.457
   95    HB2  LEU  14           2HB      LEU  14  15.490   6.062  -2.987
   96    HB3  LEU  14           1HB      LEU  14  13.779   6.044  -3.363
   97    HG   LEU  14           HG       LEU  14  13.917   5.407  -0.644
   98   HD11  LEU  14          1HD1      LEU  14  15.698   7.765  -1.236
   99   HD12  LEU  14          2HD1      LEU  14  16.276   6.185  -0.712
  100   HD13  LEU  14          3HD1      LEU  14  15.243   7.144   0.350
  101   HD21  LEU  14          3HD2      LEU  14  13.298   7.986  -2.075
  102   HD22  LEU  14          1HD2      LEU  14  12.919   7.663  -0.383
  103   HD23  LEU  14          2HD2      LEU  14  12.165   6.700  -1.655
  104    H    SER  15           H        SER  15  16.743   4.196  -4.082
  105    HA   SER  15           HA       SER  15  15.797   4.078  -6.723
  106    HB2  SER  15           2HB      SER  15  18.507   3.022  -6.172
  107    HB3  SER  15           1HB      SER  15  17.995   4.289  -7.288
  108    HG   SER  15           HG       SER  15  19.273   4.827  -5.242
  109    H    GLN  16           H        GLN  16  16.831   1.592  -4.455
  110    HA   GLN  16           HA       GLN  16  16.983  -0.588  -6.200
  111    HB2  GLN  16           2HB      GLN  16  17.819  -0.599  -3.878
  112    HB3  GLN  16           1HB      GLN  16  16.165  -0.585  -3.289
  113    HG2  GLN  16           2HG      GLN  16  17.084  -2.814  -3.170
  114    HG3  GLN  16           1HG      GLN  16  15.778  -2.761  -4.353
  115   HE21  GLN  16          1HE2      GLN  16  16.226  -3.090  -6.499
  116   HE22  GLN  16          2HE2      GLN  16  17.766  -3.637  -7.068
  117    H    MET  17           H        MET  17  14.223   0.836  -4.544
  118    HA   MET  17           HA       MET  17  12.376  -1.223  -5.112
  119    HB2  MET  17           2HB      MET  17  11.818   1.730  -4.733
  120    HB3  MET  17           1HB      MET  17  10.639   0.432  -4.619
  121    HG2  MET  17           2HG      MET  17  12.986   0.881  -2.793
  122    HG3  MET  17           1HG      MET  17  11.290   1.184  -2.423
  123    HE1  MET  17           3HE      MET  17   9.556  -1.062  -3.155
  124    HE2  MET  17           1HE      MET  17   9.681  -0.545  -1.476
  125    HE3  MET  17           2HE      MET  17   9.763  -2.261  -1.878
  126    H    LEU  18           H        LEU  18  13.463   1.579  -6.900
  127    HA   LEU  18           HA       LEU  18  11.527   1.515  -8.950
  128    HB2  LEU  18           2HB      LEU  18  13.021   3.431  -8.456
  129    HB3  LEU  18           1HB      LEU  18  14.373   2.509  -9.078
  130    HG   LEU  18           HG       LEU  18  13.292   2.451 -11.302
  131   HD11  LEU  18          1HD1      LEU  18  11.246   4.202  -9.949
  132   HD12  LEU  18          2HD1      LEU  18  10.982   2.627 -10.698
  133   HD13  LEU  18          3HD1      LEU  18  11.403   4.019 -11.695
  134   HD21  LEU  18          3HD2      LEU  18  14.934   4.165 -10.835
  135   HD22  LEU  18          1HD2      LEU  18  13.701   5.191 -10.104
  136   HD23  LEU  18          2HD2      LEU  18  13.644   4.836 -11.830
  137    H    SER  19           H        SER  19  14.753   0.044  -8.657
  138    HA   SER  19           HA       SER  19  14.765  -1.116 -11.240
  139    HB2  SER  19           2HB      SER  19  16.284  -2.605  -9.240
  140    HB3  SER  19           1HB      SER  19  16.857  -1.748 -10.671
  141    HG   SER  19           HG       SER  19  16.912   0.143  -9.502
  142    H    MET  20           H        MET  20  13.367  -2.030  -8.215
  143    HA   MET  20           HA       MET  20  12.981  -4.797  -8.839
  144    HB2  MET  20           2HB      MET  20  13.106  -3.768  -6.522
  145    HB3  MET  20           1HB      MET  20  11.479  -3.166  -6.793
  146    HG2  MET  20           2HG      MET  20  10.644  -5.424  -7.020
  147    HG3  MET  20           1HG      MET  20  12.279  -6.066  -6.856
  148    HE1  MET  20           3HE      MET  20  13.431  -4.113  -4.449
  149    HE2  MET  20           1HE      MET  20  13.734  -5.829  -4.726
  150    HE3  MET  20           2HE      MET  20  13.153  -5.277  -3.153
  151    H    GLY  21           H        GLY  21  11.408  -1.888  -9.666
  152    HA2  GLY  21           2HA      GLY  21   9.788  -1.821 -11.410
  153    HA3  GLY  21           1HA      GLY  21   9.250  -3.426 -10.933
  154    H    PHE  22           H        PHE  22   9.779  -1.396  -8.285
  155    HA   PHE  22           HA       PHE  22   6.909  -1.180  -7.845
  156    HB2  PHE  22           2HB      PHE  22   8.860  -1.847  -6.133
  157    HB3  PHE  22           1HB      PHE  22   8.884  -0.108  -5.883
  158    HD1  PHE  22           2HD      PHE  22   6.032   0.573  -6.082
  159    HD2  PHE  22           1HD      PHE  22   7.951  -2.731  -4.206
  160    HE1  PHE  22           2HE      PHE  22   4.150   0.370  -4.511
  161    HE2  PHE  22           1HE      PHE  22   6.070  -2.938  -2.640
  162    HZ   PHE  22           HZ       PHE  22   4.167  -1.385  -2.791
  163    H    SER  23           H        SER  23   5.819   0.593  -8.288
  164    HA   SER  23           HA       SER  23   7.107   3.195  -8.091
  165    HB2  SER  23           2HB      SER  23   5.473   3.221 -10.445
  166    HB3  SER  23           1HB      SER  23   7.197   3.557 -10.300
  167    HG   SER  23           HG       SER  23   7.519   1.751 -11.294
  168    H    ASP  24           H        ASP  24   5.755   4.767  -7.381
  169    HA   ASP  24           HA       ASP  24   2.939   4.000  -7.024
  170    HB2  ASP  24           2HB      ASP  24   2.939   5.500  -5.045
  171    HB3  ASP  24           1HB      ASP  24   4.033   4.138  -4.886
  172    H    GLU  25           H        GLU  25   1.505   5.131  -8.103
  173    HA   GLU  25           HA       GLU  25   2.324   7.523  -9.515
  174    HB2  GLU  25           2HB      GLU  25  -0.506   6.909  -9.710
  175    HB3  GLU  25           1HB      GLU  25   0.711   6.992 -10.975
  176    HG2  GLU  25           2HG      GLU  25   0.085   4.816 -11.160
  177    HG3  GLU  25           1HG      GLU  25   1.409   4.654 -10.006
  178    H    GLY  26           H        GLY  26   0.007   6.635  -6.998
  179    HA2  GLY  26           2HA      GLY  26  -0.924   9.349  -6.687
  180    HA3  GLY  26           1HA      GLY  26  -1.370   7.972  -5.692
  181    H    GLY  27           H        GLY  27   1.927   8.015  -5.885
  182    HA2  GLY  27           2HA      GLY  27   3.614   8.710  -4.492
  183    HA3  GLY  27           1HA      GLY  27   2.584  10.050  -4.017
  184    H    TRP  28           H        TRP  28   1.904   6.598  -3.692
  185    HA   TRP  28           HA       TRP  28   1.416   7.051  -0.868
  186    HB2  TRP  28           2HB      TRP  28   0.269   4.920  -0.870
  187    HB3  TRP  28           1HB      TRP  28  -0.302   5.904  -2.205
  188    HD1  TRP  28           HD       TRP  28   0.422   5.083  -4.706
  189    HE1  TRP  28           1HE      TRP  28   0.996   2.725  -5.574
  190    HE3  TRP  28           3HE      TRP  28   1.371   2.786  -0.236
  191    HZ2  TRP  28           2HZ      TRP  28   1.747   0.213  -4.487
  192    HZ3  TRP  28           3HZ      TRP  28   2.009   0.411  -0.235
  193    HH2  TRP  28           HH       TRP  28   2.193  -0.845  -2.320
  194    H    LEU  29           H        LEU  29   3.629   5.257  -2.923
  195    HA   LEU  29           HA       LEU  29   4.737   3.684  -0.809
  196    HB2  LEU  29           2HB      LEU  29   4.959   2.889  -3.069
  197    HB3  LEU  29           1HB      LEU  29   5.764   4.368  -3.562
  198    HG   LEU  29           HG       LEU  29   7.606   3.716  -1.893
  199   HD11  LEU  29          1HD1      LEU  29   6.326   1.975  -0.733
  200   HD12  LEU  29          2HD1      LEU  29   7.818   1.343  -1.428
  201   HD13  LEU  29          3HD1      LEU  29   6.275   1.030  -2.222
  202   HD21  LEU  29          3HD2      LEU  29   7.145   2.067  -4.376
  203   HD22  LEU  29          1HD2      LEU  29   8.690   2.276  -3.554
  204   HD23  LEU  29          2HD2      LEU  29   7.899   3.659  -4.307
  205    H    THR  30           H        THR  30   5.484   6.786  -2.290
  206    HA   THR  30           HA       THR  30   7.984   7.215  -1.084
  207    HB   THR  30           HB       THR  30   6.612   8.567  -2.932
  208    HG1  THR  30           1HG      THR  30   8.149  10.430  -1.974
  209   HG21  THR  30          3HG2      THR  30   6.190  10.177  -0.414
  210   HG22  THR  30          1HG2      THR  30   4.939   9.498  -1.455
  211   HG23  THR  30          2HG2      THR  30   5.979  10.792  -2.053
  212    H    ARG  31           H        ARG  31   4.804   7.265   0.199
  213    HA   ARG  31           HA       ARG  31   5.593   8.739   2.592
  214    HB2  ARG  31           2HB      ARG  31   2.926   7.461   1.972
  215    HB3  ARG  31           1HB      ARG  31   3.264   8.670   3.204
  216    HG2  ARG  31           2HG      ARG  31   3.873   9.381   0.397
  217    HG3  ARG  31           1HG      ARG  31   2.174   9.277   0.861
  218    HD2  ARG  31           2HD      ARG  31   4.101  10.823   2.549
  219    HD3  ARG  31           1HD      ARG  31   3.451  11.535   1.071
  220    HE   ARG  31           HE       ARG  31   1.630  10.460   3.114
  221   HH11  ARG  31          1HH1      ARG  31   2.844  13.167   1.247
  222   HH12  ARG  31          2HH1      ARG  31   1.544  14.218   1.703
  223   HH21  ARG  31          1HH2      ARG  31  -0.086  11.825   3.691
  224   HH22  ARG  31          2HH2      ARG  31  -0.125  13.456   3.106
  225    H    LEU  32           H        LEU  32   4.736   5.536   1.483
  226    HA   LEU  32           HA       LEU  32   4.486   4.229   3.949
  227    HB2  LEU  32           2HB      LEU  32   3.839   3.387   1.650
  228    HB3  LEU  32           1HB      LEU  32   5.532   3.018   1.392
  229    HG   LEU  32           HG       LEU  32   5.250   1.640   3.615
  230   HD11  LEU  32          1HD1      LEU  32   2.945   2.444   4.000
  231   HD12  LEU  32          2HD1      LEU  32   3.064   0.687   3.892
  232   HD13  LEU  32          3HD1      LEU  32   2.443   1.614   2.527
  233   HD21  LEU  32          3HD2      LEU  32   4.649  -0.328   2.251
  234   HD22  LEU  32          1HD2      LEU  32   5.895   0.672   1.504
  235   HD23  LEU  32          2HD2      LEU  32   4.233   0.753   0.921
  236    H    LEU  33           H        LEU  33   7.291   4.916   1.938
  237    HA   LEU  33           HA       LEU  33   9.150   3.335   3.373
  238    HB2  LEU  33           2HB      LEU  33   9.531   5.754   1.613
  239    HB3  LEU  33           1HB      LEU  33  10.853   4.796   2.255
  240    HG   LEU  33           HG       LEU  33   8.698   3.698   0.443
  241   HD11  LEU  33          1HD1      LEU  33  10.431   3.758  -1.305
  242   HD12  LEU  33          2HD1      LEU  33  11.489   4.643  -0.203
  243   HD13  LEU  33          3HD1      LEU  33   9.977   5.369  -0.751
  244   HD21  LEU  33          3HD2      LEU  33   9.696   1.977   1.778
  245   HD22  LEU  33          1HD2      LEU  33  11.318   2.591   1.444
  246   HD23  LEU  33          2HD2      LEU  33  10.364   1.868   0.151
  247    H    GLN  34           H        GLN  34   7.572   6.198   4.223
  248    HA   GLN  34           HA       GLN  34   9.731   7.084   5.979
  249    HB2  GLN  34           2HB      GLN  34   7.026   8.360   5.560
  250    HB3  GLN  34           1HB      GLN  34   8.419   9.073   6.360
  251    HG2  GLN  34           2HG      GLN  34   8.084   8.460   3.442
  252    HG3  GLN  34           1HG      GLN  34   8.268  10.037   4.203
  253   HE21  GLN  34          1HE2      GLN  34   9.808   8.657   2.093
  254   HE22  GLN  34          2HE2      GLN  34  11.454   8.653   2.643
  255    H    THR  35           H        THR  35   6.496   5.716   6.085
  256    HA   THR  35           HA       THR  35   6.363   5.890   8.967
  257    HB   THR  35           HB       THR  35   4.248   4.443   8.542
  258    HG1  THR  35           1HG      THR  35   3.483   4.777   6.353
  259   HG21  THR  35          3HG2      THR  35   4.444   7.249   7.441
  260   HG22  THR  35          1HG2      THR  35   4.219   6.828   9.138
  261   HG23  THR  35          2HG2      THR  35   2.965   6.442   7.959
  262    H    LYS  36           H        LYS  36   6.759   3.326   6.537
  263    HA   LYS  36           HA       LYS  36   7.188   1.382   8.681
  264    HB2  LYS  36           2HB      LYS  36   6.600   1.185   5.759
  265    HB3  LYS  36           1HB      LYS  36   7.380  -0.168   6.566
  266    HG2  LYS  36           2HG      LYS  36   5.119  -0.689   6.653
  267    HG3  LYS  36           1HG      LYS  36   5.460  -0.024   8.253
  268    HD2  LYS  36           2HD      LYS  36   4.647   2.193   7.383
  269    HD3  LYS  36           1HD      LYS  36   4.095   1.341   5.938
  270    HE2  LYS  36           2HE      LYS  36   2.173   1.146   7.099
  271    HE3  LYS  36           1HE      LYS  36   3.007  -0.204   7.871
  272    HZ1  LYS  36           3HZ      LYS  36   2.302   0.988   9.678
  273    HZ2  LYS  36           1HZ      LYS  36   2.466   2.494   8.914
  274    HZ3  LYS  36           2HZ      LYS  36   3.835   1.662   9.464
  275    H    ASN  37           H        ASN  37   9.033   3.588   7.460
  276    HA   ASN  37           HA       ASN  37  11.268   3.942   7.306
  277    HB2  ASN  37           2HB      ASN  37  11.142   2.121   9.243
  278    HB3  ASN  37           1HB      ASN  37  11.943   1.123   8.036
  279   HD21  ASN  37          1HD2      ASN  37  12.928   2.103  10.593
  280   HD22  ASN  37          2HD2      ASN  37  14.362   3.003  10.246
  281    H    TYR  38           H        TYR  38  13.349   2.875   6.260
  282    HA   TYR  38           HA       TYR  38  12.542   2.196   3.559
  283    HB2  TYR  38           2HB      TYR  38  15.224   2.869   4.780
  284    HB3  TYR  38           1HB      TYR  38  15.000   2.467   3.081
  285    HD1  TYR  38           1HD      TYR  38  13.268   3.915   1.788
  286    HD2  TYR  38           2HD      TYR  38  15.064   5.084   5.461
  287    HE1  TYR  38           1HE      TYR  38  12.728   6.260   1.297
  288    HE2  TYR  38           2HE      TYR  38  14.533   7.436   4.978
  289    HH   TYR  38           HH       TYR  38  14.009   8.871   3.137
  290    H    ASP  39           H        ASP  39  12.072   0.177   5.494
  291    HA   ASP  39           HA       ASP  39  14.168  -1.806   5.081
  292    HB2  ASP  39           2HB      ASP  39  12.971  -1.487   7.308
  293    HB3  ASP  39           1HB      ASP  39  11.552  -2.196   6.541
  294    H    ILE  40           H        ILE  40  14.122  -2.581   3.073
  295    HA   ILE  40           HA       ILE  40  11.878  -2.816   1.419
  296    HB   ILE  40           HB       ILE  40  14.481  -4.343   1.287
  297   HG12  ILE  40          2HG1      ILE  40  13.609  -1.844  -0.183
  298   HG13  ILE  40          1HG1      ILE  40  14.658  -1.848   1.232
  299   HG21  ILE  40          1HG2      ILE  40  12.746  -5.445  -0.028
  300   HG22  ILE  40          2HG2      ILE  40  13.946  -4.695  -1.080
  301   HG23  ILE  40          3HG2      ILE  40  12.379  -3.921  -0.843
  302   HD11  ILE  40          3HD1      ILE  40  15.280  -3.202  -1.379
  303   HD12  ILE  40          1HD1      ILE  40  16.344  -3.067   0.019
  304   HD13  ILE  40          2HD1      ILE  40  15.887  -1.621  -0.881
  305    H    GLY  41           H        GLY  41  13.303  -5.074   3.700
  306    HA2  GLY  41           2HA      GLY  41  11.925  -7.397   2.908
  307    HA3  GLY  41           1HA      GLY  41  12.586  -7.097   4.507
  308    H    ALA  42           H        ALA  42  11.153  -5.013   5.421
  309    HA   ALA  42           HA       ALA  42   8.694  -6.229   6.157
  310    HB1  ALA  42           1HB      ALA  42   8.278  -4.147   7.389
  311    HB2  ALA  42           2HB      ALA  42   9.667  -3.410   6.592
  312    HB3  ALA  42           3HB      ALA  42   9.900  -4.778   7.679
  313    H    ALA  43           H        ALA  43   9.520  -3.550   3.998
  314    HA   ALA  43           HA       ALA  43   6.952  -2.644   3.420
  315    HB1  ALA  43           1HB      ALA  43   9.341  -2.691   1.584
  316    HB2  ALA  43           2HB      ALA  43   8.994  -1.453   2.793
  317    HB3  ALA  43           3HB      ALA  43   7.918  -1.667   1.411
  318    H    LEU  44           H        LEU  44   8.882  -5.085   1.676
  319    HA   LEU  44           HA       LEU  44   6.908  -5.641  -0.267
  320    HB2  LEU  44           2HB      LEU  44   9.480  -6.756   0.560
  321    HB3  LEU  44           1HB      LEU  44   8.368  -7.973  -0.032
  322    HG   LEU  44           HG       LEU  44   8.127  -6.721  -2.140
  323   HD11  LEU  44          1HD1      LEU  44   9.623  -4.867  -2.635
  324   HD12  LEU  44          2HD1      LEU  44  10.242  -4.915  -0.985
  325   HD13  LEU  44          3HD1      LEU  44   8.559  -4.479  -1.284
  326   HD21  LEU  44          3HD2      LEU  44   9.797  -8.489  -1.962
  327   HD22  LEU  44          1HD2      LEU  44  10.981  -7.325  -1.367
  328   HD23  LEU  44          2HD2      LEU  44  10.365  -7.195  -3.015
  329    H    ASP  45           H        ASP  45   7.636  -7.085   2.871
  330    HA   ASP  45           HA       ASP  45   5.830  -9.249   2.707
  331    HB2  ASP  45           2HB      ASP  45   7.734  -8.879   4.377
  332    HB3  ASP  45           1HB      ASP  45   6.611  -7.852   5.262
  333    H    THR  46           H        THR  46   5.441  -5.896   3.589
  334    HA   THR  46           HA       THR  46   2.992  -6.012   4.939
  335    HB   THR  46           HB       THR  46   4.056  -3.780   3.191
  336    HG1  THR  46           1HG      THR  46   5.402  -4.461   5.005
  337   HG21  THR  46          3HG2      THR  46   2.621  -2.321   4.564
  338   HG22  THR  46          1HG2      THR  46   1.956  -3.746   5.363
  339   HG23  THR  46          2HG2      THR  46   1.679  -3.493   3.640
  340    H    ILE  47           H        ILE  47   3.711  -5.991   1.491
  341    HA   ILE  47           HA       ILE  47   0.819  -6.061   0.957
  342    HB   ILE  47           HB       ILE  47   1.298  -5.354  -1.315
  343   HG12  ILE  47          2HG1      ILE  47   4.197  -5.051  -0.525
  344   HG13  ILE  47          1HG1      ILE  47   3.592  -6.477  -1.359
  345   HG21  ILE  47          1HG2      ILE  47   1.861  -3.089  -0.864
  346   HG22  ILE  47          2HG2      ILE  47   2.793  -3.538   0.563
  347   HG23  ILE  47          3HG2      ILE  47   1.038  -3.695   0.575
  348   HD11  ILE  47          3HD1      ILE  47   4.595  -4.929  -2.919
  349   HD12  ILE  47          1HD1      ILE  47   3.507  -3.650  -2.383
  350   HD13  ILE  47          2HD1      ILE  47   2.862  -5.062  -3.222
  351    H    GLN  48           H        GLN  48   3.195  -8.140   1.456
  352    HA   GLN  48           HA       GLN  48   3.486 -10.353   1.096
  353    HB2  GLN  48           2HB      GLN  48   0.836 -10.095   0.811
  354    HB3  GLN  48           1HB      GLN  48   1.239 -10.626  -0.816
  355    HG2  GLN  48           2HG      GLN  48   1.073 -12.684  -0.009
  356    HG3  GLN  48           1HG      GLN  48   2.643 -12.386   0.733
  357   HE21  GLN  48          1HE2      GLN  48   2.757 -11.953   2.936
  358   HE22  GLN  48          2HE2      GLN  48   1.435 -12.252   4.006
  359    H    TYR  49           H        TYR  49   2.586  -8.638  -1.866
  360    HA   TYR  49           HA       TYR  49   3.663 -10.277  -3.787
  361    HB2  TYR  49           2HB      TYR  49   3.341  -7.300  -3.625
  362    HB3  TYR  49           1HB      TYR  49   4.115  -8.031  -5.025
  363    HD1  TYR  49           2HD      TYR  49   1.239  -9.389  -3.091
  364    HD2  TYR  49           1HD      TYR  49   2.554  -7.591  -6.717
  365    HE1  TYR  49           2HE      TYR  49  -0.966  -9.804  -4.090
  366    HE2  TYR  49           1HE      TYR  49   0.352  -8.005  -7.724
  367    HH   TYR  49           HH       TYR  49  -2.305  -9.369  -5.826
  368    H    SER  50           H        SER  50   5.584 -11.156  -3.880
  369    HA   SER  50           HA       SER  50   7.944  -9.450  -3.686
  370    HB2  SER  50           2HB      SER  50   8.926 -11.628  -2.425
  371    HB3  SER  50           1HB      SER  50   8.258 -10.238  -1.572
  372    HG   SER  50           HG       SER  50   6.224 -11.350  -1.565
  373    H    LYS  51           H        LYS  51   6.411 -12.421  -4.712
  374    HA   LYS  51           HA       LYS  51   8.686 -12.971  -6.489
  375    HB2  LYS  51           2HB      LYS  51   6.419 -14.795  -5.655
  376    HB3  LYS  51           1HB      LYS  51   7.748 -15.241  -6.720
  377    HG2  LYS  51           2HG      LYS  51   9.250 -14.543  -4.734
  378    HG3  LYS  51           1HG      LYS  51   7.777 -14.720  -3.779
  379    HD2  LYS  51           2HD      LYS  51   7.547 -17.021  -4.534
  380    HD3  LYS  51           1HD      LYS  51   8.977 -16.852  -5.549
  381    HE2  LYS  51           2HE      LYS  51  10.227 -16.268  -3.408
  382    HE3  LYS  51           1HE      LYS  51   8.804 -16.857  -2.551
  383    HZ1  LYS  51           3HZ      LYS  51   9.085 -18.996  -3.669
  384    HZ2  LYS  51           1HZ      LYS  51  10.451 -18.587  -2.758
  385    HZ3  LYS  51           2HZ      LYS  51  10.474 -18.420  -4.438
  386    H    HIS  52           H        HIS  52   5.124 -13.085  -6.485
  387    HA   HIS  52           HA       HIS  52   4.939 -11.669  -8.951
  388    HB2  HIS  52           2HB      HIS  52   5.555 -14.148  -9.545
  389    HB3  HIS  52           1HB      HIS  52   3.876 -14.468  -9.131
  390    HD1  HIS  52           1HD      HIS  52   2.365 -12.249 -10.419
  391    HD2  HIS  52           2HD      HIS  52   5.644 -14.058 -12.227
  392    HE1  HIS  52           1HE      HIS  52   2.122 -11.795 -12.880
  393    HE2  HIS  52           2HE      HIS  52   4.165 -12.819 -13.946
  394    H1   GLY   1           1HT      GLY   1 -19.799  19.018   1.907
  395    H2   GLY   1           2HT      GLY   1 -18.276  18.647   1.276
  396    H3   GLY   1           3HT      GLY   1 -18.405  19.472   2.745
  397    HA2  GLY   1           1HA      GLY   1 -17.834  17.188   3.158
  398    HA3  GLY   1           2HA      GLY   1 -19.445  17.543   3.766
  399    H    SER   2           H        SER   2 -20.677  15.787   3.467
  400    HA   SER   2           HA       SER   2 -20.318  14.168   1.062
  401    HB2  SER   2           2HB      SER   2 -22.158  13.660   3.413
  402    HB3  SER   2           1HB      SER   2 -21.675  12.504   2.173
  403    HG   SER   2           HG       SER   2 -20.358  12.072   3.852
  404    HA   PRO   3           HA       PRO   3 -23.835  16.600  -0.455
  405    HB2  PRO   3           2HB      PRO   3 -23.148  15.638  -3.091
  406    HB3  PRO   3           1HB      PRO   3 -23.012  17.273  -2.447
  407    HG2  PRO   3           2HG      PRO   3 -20.861  15.708  -3.076
  408    HG3  PRO   3           1HG      PRO   3 -20.820  16.999  -1.864
  409    HD2  PRO   3           2HD      PRO   3 -21.074  14.045  -1.480
  410    HD3  PRO   3           1HD      PRO   3 -20.145  15.232  -0.536
  411    HA   PRO   4           HA       PRO   4 -26.717  13.206  -0.658
  412    HB2  PRO   4           2HB      PRO   4 -28.544  15.163  -1.907
  413    HB3  PRO   4           1HB      PRO   4 -28.740  14.229  -0.422
  414    HG2  PRO   4           2HG      PRO   4 -28.253  16.857  -0.342
  415    HG3  PRO   4           1HG      PRO   4 -27.545  15.754   0.854
  416    HD2  PRO   4           2HD      PRO   4 -26.283  16.990  -1.565
  417    HD3  PRO   4           1HD      PRO   4 -25.618  16.774   0.069
  418    H    GLU   5           H        GLU   5 -25.539  14.945  -3.343
  419    HA   GLU   5           HA       GLU   5 -27.043  13.509  -5.343
  420    HB2  GLU   5           2HB      GLU   5 -24.517  14.815  -6.145
  421    HB3  GLU   5           1HB      GLU   5 -26.107  14.909  -6.875
  422    HG2  GLU   5           2HG      GLU   5 -25.333  16.348  -4.356
  423    HG3  GLU   5           1HG      GLU   5 -25.243  17.052  -5.968
  424    H    ALA   6           H        ALA   6 -24.319  12.922  -3.422
  425    HA   ALA   6           HA       ALA   6 -22.970  11.161  -5.275
  426    HB1  ALA   6           1HB      ALA   6 -22.506  11.610  -2.326
  427    HB2  ALA   6           2HB      ALA   6 -21.684  12.451  -3.640
  428    HB3  ALA   6           3HB      ALA   6 -21.447  10.717  -3.418
  429    H    ASP   7           H        ASP   7 -22.593   8.898  -4.766
  430    HA   ASP   7           HA       ASP   7 -25.030   7.546  -4.122
  431    HB2  ASP   7           2HB      ASP   7 -23.320   6.799  -5.840
  432    HB3  ASP   7           1HB      ASP   7 -22.295   6.319  -4.498
  433    HA   PRO   8           HA       PRO   8 -24.124   7.493   0.274
  434    HB2  PRO   8           2HB      PRO   8 -26.295   6.014   0.997
  435    HB3  PRO   8           1HB      PRO   8 -26.357   7.746   0.658
  436    HG2  PRO   8           2HG      PRO   8 -27.086   5.448  -1.107
  437    HG3  PRO   8           1HG      PRO   8 -27.925   6.993  -0.873
  438    HD2  PRO   8           2HD      PRO   8 -26.351   6.513  -3.017
  439    HD3  PRO   8           1HD      PRO   8 -26.497   8.125  -2.287
  440    H    ARG   9           H        ARG   9 -24.347   4.793  -1.843
  441    HA   ARG   9           HA       ARG   9 -23.519   2.910   0.235
  442    HB2  ARG   9           2HB      ARG   9 -23.991   2.378  -2.703
  443    HB3  ARG   9           1HB      ARG   9 -23.827   1.182  -1.424
  444    HG2  ARG   9           2HG      ARG   9 -25.937   1.557  -0.608
  445    HG3  ARG   9           1HG      ARG   9 -25.998   3.210  -1.227
  446    HD2  ARG   9           2HD      ARG   9 -26.107   0.705  -2.904
  447    HD3  ARG   9           1HD      ARG   9 -27.498   1.689  -2.450
  448    HE   ARG   9           HE       ARG   9 -25.432   3.178  -3.799
  449   HH11  ARG   9          1HH1      ARG   9 -28.269   1.165  -4.233
  450   HH12  ARG   9          2HH1      ARG   9 -28.605   1.763  -5.825
  451   HH21  ARG   9          1HH2      ARG   9 -25.874   3.965  -5.901
  452   HH22  ARG   9          2HH2      ARG   9 -27.264   3.367  -6.760
  453    H    LEU  10           H        LEU  10 -22.327   4.470  -2.685
  454    HA   LEU  10           HA       LEU  10 -19.878   3.067  -2.852
  455    HB2  LEU  10           2HB      LEU  10 -20.848   4.375  -4.708
  456    HB3  LEU  10           1HB      LEU  10 -20.527   5.851  -3.818
  457    HG   LEU  10           HG       LEU  10 -18.086   5.286  -3.895
  458   HD11  LEU  10          1HD1      LEU  10 -17.363   3.659  -5.595
  459   HD12  LEU  10          2HD1      LEU  10 -19.042   3.171  -5.824
  460   HD13  LEU  10          3HD1      LEU  10 -18.247   2.898  -4.273
  461   HD21  LEU  10          3HD2      LEU  10 -19.509   5.615  -6.536
  462   HD22  LEU  10          1HD2      LEU  10 -17.811   5.982  -6.227
  463   HD23  LEU  10          2HD2      LEU  10 -19.075   6.908  -5.419
  464    H    ILE  11           H        ILE  11 -20.845   5.960  -1.097
  465    HA   ILE  11           HA       ILE  11 -18.223   6.744  -0.339
  466    HB   ILE  11           HB       ILE  11 -20.263   8.220  -0.311
  467   HG12  ILE  11          2HG1      ILE  11 -18.769   8.136   2.316
  468   HG13  ILE  11          1HG1      ILE  11 -18.084   8.765   0.820
  469   HG21  ILE  11          1HG2      ILE  11 -21.660   8.207   1.712
  470   HG22  ILE  11          2HG2      ILE  11 -20.850   6.736   2.247
  471   HG23  ILE  11          3HG2      ILE  11 -21.824   6.722   0.776
  472   HD11  ILE  11          3HD1      ILE  11 -19.795  10.478   0.734
  473   HD12  ILE  11          1HD1      ILE  11 -18.912  10.547   2.258
  474   HD13  ILE  11          2HD1      ILE  11 -20.526   9.839   2.205
  475    H    GLU  12           H        GLU  12 -20.261   4.225   0.691
  476    HA   GLU  12           HA       GLU  12 -19.235   4.020   3.368
  477    HB2  GLU  12           2HB      GLU  12 -21.001   2.267   1.681
  478    HB3  GLU  12           1HB      GLU  12 -20.432   1.760   3.265
  479    HG2  GLU  12           2HG      GLU  12 -21.905   4.333   2.803
  480    HG3  GLU  12           1HG      GLU  12 -22.707   2.811   3.194
  481    H    SER  13           H        SER  13 -18.082   3.154   0.314
  482    HA   SER  13           HA       SER  13 -16.751   0.745   0.834
  483    HB2  SER  13           2HB      SER  13 -15.710   2.943  -0.960
  484    HB3  SER  13           1HB      SER  13 -15.450   1.208  -1.119
  485    HG   SER  13           HG       SER  13 -17.659   2.752  -1.793
  486    H    LEU  14           H        LEU  14 -15.938   4.068   1.578
  487    HA   LEU  14           HA       LEU  14 -13.242   3.528   2.374
  488    HB2  LEU  14           2HB      LEU  14 -15.057   5.880   2.928
  489    HB3  LEU  14           1HB      LEU  14 -13.365   5.815   3.383
  490    HG   LEU  14           HG       LEU  14 -13.062   5.344   0.782
  491   HD11  LEU  14          1HD1      LEU  14 -15.606   6.952   0.926
  492   HD12  LEU  14          2HD1      LEU  14 -15.426   5.331   0.251
  493   HD13  LEU  14          3HD1      LEU  14 -14.632   6.702  -0.522
  494   HD21  LEU  14          3HD2      LEU  14 -13.539   8.064   1.989
  495   HD22  LEU  14          1HD2      LEU  14 -12.667   7.740   0.490
  496   HD23  LEU  14          2HD2      LEU  14 -12.027   7.155   2.026
  497    H    SER  15           H        SER  15 -16.337   3.958   4.023
  498    HA   SER  15           HA       SER  15 -15.413   3.745   6.664
  499    HB2  SER  15           2HB      SER  15 -18.080   2.614   6.161
  500    HB3  SER  15           1HB      SER  15 -17.608   3.974   7.179
  501    HG   SER  15           HG       SER  15 -18.954   4.344   5.161
  502    H    GLN  16           H        GLN  16 -16.419   1.346   4.297
  503    HA   GLN  16           HA       GLN  16 -16.489  -0.905   5.952
  504    HB2  GLN  16           2HB      GLN  16 -17.373  -0.809   3.638
  505    HB3  GLN  16           1HB      GLN  16 -15.725  -0.781   3.028
  506    HG2  GLN  16           2HG      GLN  16 -16.788  -3.000   2.899
  507    HG3  GLN  16           1HG      GLN  16 -15.315  -2.987   3.865
  508   HE21  GLN  16          1HE2      GLN  16 -15.445  -3.292   6.076
  509   HE22  GLN  16          2HE2      GLN  16 -16.868  -3.919   6.838
  510    H    MET  17           H        MET  17 -13.800   0.600   4.214
  511    HA   MET  17           HA       MET  17 -11.906  -1.433   4.764
  512    HB2  MET  17           2HB      MET  17 -11.579   1.495   4.106
  513    HB3  MET  17           1HB      MET  17 -10.217   0.404   4.308
  514    HG2  MET  17           2HG      MET  17 -12.379   0.254   2.226
  515    HG3  MET  17           1HG      MET  17 -10.677   0.638   1.978
  516    HE1  MET  17           3HE      MET  17  -8.694  -1.175   2.328
  517    HE2  MET  17           1HE      MET  17  -8.996  -2.834   2.847
  518    HE3  MET  17           2HE      MET  17  -9.313  -1.490   3.947
  519    H    LEU  18           H        LEU  18 -12.916   1.464   6.452
  520    HA   LEU  18           HA       LEU  18 -10.948   1.501   8.451
  521    HB2  LEU  18           2HB      LEU  18 -12.429   3.393   7.991
  522    HB3  LEU  18           1HB      LEU  18 -13.811   2.457   8.522
  523    HG   LEU  18           HG       LEU  18 -12.548   2.316  10.786
  524   HD11  LEU  18          1HD1      LEU  18 -11.276   4.780   9.611
  525   HD12  LEU  18          2HD1      LEU  18 -10.442   3.258   9.913
  526   HD13  LEU  18          3HD1      LEU  18 -11.097   4.187  11.261
  527   HD21  LEU  18          3HD2      LEU  18 -14.653   3.492  10.456
  528   HD22  LEU  18          1HD2      LEU  18 -13.787   4.887   9.814
  529   HD23  LEU  18          2HD2      LEU  18 -13.577   4.418  11.501
  530    H    SER  19           H        SER  19 -14.225   0.094   8.446
  531    HA   SER  19           HA       SER  19 -14.021  -1.032  11.042
  532    HB2  SER  19           2HB      SER  19 -15.841  -2.088   8.895
  533    HB3  SER  19           1HB      SER  19 -16.131  -1.968  10.631
  534    HG   SER  19           HG       SER  19 -16.001   0.388  10.279
  535    H    MET  20           H        MET  20 -12.662  -1.941   8.082
  536    HA   MET  20           HA       MET  20 -12.552  -4.775   8.639
  537    HB2  MET  20           2HB      MET  20 -12.630  -3.755   6.306
  538    HB3  MET  20           1HB      MET  20 -10.963  -3.261   6.563
  539    HG2  MET  20           2HG      MET  20 -10.210  -5.492   6.667
  540    HG3  MET  20           1HG      MET  20 -11.853  -6.115   6.799
  541    HE1  MET  20           3HE      MET  20 -13.572  -6.109   5.017
  542    HE2  MET  20           1HE      MET  20 -13.294  -5.878   3.290
  543    HE3  MET  20           2HE      MET  20 -13.436  -4.480   4.353
  544    H    GLY  21           H        GLY  21 -10.955  -2.050   9.698
  545    HA2  GLY  21           2HA      GLY  21  -9.306  -2.068  11.370
  546    HA3  GLY  21           1HA      GLY  21  -8.857  -3.696  10.882
  547    H    PHE  22           H        PHE  22  -9.247  -1.257   8.445
  548    HA   PHE  22           HA       PHE  22  -6.321  -1.029   8.291
  549    HB2  PHE  22           2HB      PHE  22  -8.223  -1.929   6.272
  550    HB3  PHE  22           1HB      PHE  22  -7.225  -0.596   5.708
  551    HD1  PHE  22           1HD      PHE  22  -4.735  -0.821   5.796
  552    HD2  PHE  22           2HD      PHE  22  -7.363  -4.102   6.457
  553    HE1  PHE  22           1HE      PHE  22  -2.888  -2.384   5.352
  554    HE2  PHE  22           2HE      PHE  22  -5.521  -5.670   6.019
  555    HZ   PHE  22           HZ       PHE  22  -3.277  -4.811   5.465
  556    H    SER  23           H        SER  23  -5.617   0.916   8.514
  557    HA   SER  23           HA       SER  23  -7.079   3.186   7.443
  558    HB2  SER  23           2HB      SER  23  -6.064   3.339  10.277
  559    HB3  SER  23           1HB      SER  23  -7.231   4.377   9.463
  560    HG   SER  23           HG       SER  23  -8.662   3.143  10.371
  561    H    ASP  24           H        ASP  24  -5.715   4.835   6.817
  562    HA   ASP  24           HA       ASP  24  -2.889   4.137   6.852
  563    HB2  ASP  24           2HB      ASP  24  -2.688   6.025   5.187
  564    HB3  ASP  24           1HB      ASP  24  -3.643   4.647   4.672
  565    H    GLU  25           H        GLU  25  -1.297   5.357   7.686
  566    HA   GLU  25           HA       GLU  25  -2.125   7.415   9.602
  567    HB2  GLU  25           2HB      GLU  25   0.671   6.803   9.754
  568    HB3  GLU  25           1HB      GLU  25  -0.584   6.506  10.946
  569    HG2  GLU  25           2HG      GLU  25   0.254   4.396  10.600
  570    HG3  GLU  25           1HG      GLU  25  -1.123   4.430   9.504
  571    H    GLY  26           H        GLY  26   0.000   6.823   6.866
  572    HA2  GLY  26           2HA      GLY  26   0.875   9.613   6.866
  573    HA3  GLY  26           1HA      GLY  26   1.494   8.329   5.836
  574    H    GLY  27           H        GLY  27  -1.863   8.309   5.995
  575    HA2  GLY  27           2HA      GLY  27  -3.528   8.920   4.542
  576    HA3  GLY  27           1HA      GLY  27  -2.535  10.306   4.116
  577    H    TRP  28           H        TRP  28  -1.690   6.899   3.734
  578    HA   TRP  28           HA       TRP  28  -1.289   7.426   0.896
  579    HB2  TRP  28           2HB      TRP  28   0.106   5.442   0.864
  580    HB3  TRP  28           1HB      TRP  28   0.608   6.511   2.162
  581    HD1  TRP  28           HD       TRP  28   0.216   5.649   4.671
  582    HE1  TRP  28           1HE      TRP  28  -0.115   3.288   5.630
  583    HE3  TRP  28           3HE      TRP  28  -0.966   3.196   0.351
  584    HZ2  TRP  28           2HZ      TRP  28  -0.796   0.704   4.667
  585    HZ3  TRP  28           3HZ      TRP  28  -1.442   0.781   0.452
  586    HH2  TRP  28           HH       TRP  28  -1.358  -0.431   2.563
  587    H    LEU  29           H        LEU  29  -3.358   5.591   2.989
  588    HA   LEU  29           HA       LEU  29  -4.223   3.714   0.998
  589    HB2  LEU  29           2HB      LEU  29  -4.385   3.206   3.396
  590    HB3  LEU  29           1HB      LEU  29  -5.510   4.533   3.608
  591    HG   LEU  29           HG       LEU  29  -7.028   3.285   1.962
  592   HD11  LEU  29          1HD1      LEU  29  -5.314   1.726   1.136
  593   HD12  LEU  29          2HD1      LEU  29  -6.717   0.893   1.804
  594   HD13  LEU  29          3HD1      LEU  29  -5.226   0.997   2.740
  595   HD21  LEU  29          3HD2      LEU  29  -7.712   3.409   4.194
  596   HD22  LEU  29          1HD2      LEU  29  -6.403   2.364   4.748
  597   HD23  LEU  29          2HD2      LEU  29  -7.739   1.687   3.821
  598    H    THR  30           H        THR  30  -5.349   6.815   2.236
  599    HA   THR  30           HA       THR  30  -7.795   6.879   0.829
  600    HB   THR  30           HB       THR  30  -7.270   8.405   2.705
  601    HG1  THR  30           1HG      THR  30  -8.128   9.366   0.200
  602   HG21  THR  30          3HG2      THR  30  -5.476   9.798   0.712
  603   HG22  THR  30          1HG2      THR  30  -4.940   8.901   2.132
  604   HG23  THR  30          2HG2      THR  30  -5.879  10.380   2.327
  605    H    ARG  31           H        ARG  31  -4.542   7.245  -0.186
  606    HA   ARG  31           HA       ARG  31  -5.213   8.617  -2.670
  607    HB2  ARG  31           2HB      ARG  31  -2.559   7.434  -1.811
  608    HB3  ARG  31           1HB      ARG  31  -2.830   8.574  -3.119
  609    HG2  ARG  31           2HG      ARG  31  -3.594   9.334  -0.344
  610    HG3  ARG  31           1HG      ARG  31  -1.899   9.385  -0.822
  611    HD2  ARG  31           2HD      ARG  31  -3.932  10.670  -2.576
  612    HD3  ARG  31           1HD      ARG  31  -3.456  11.489  -1.093
  613    HE   ARG  31           HE       ARG  31  -1.679  10.840  -3.348
  614   HH11  ARG  31          1HH1      ARG  31  -2.309  12.576  -0.378
  615   HH12  ARG  31          2HH1      ARG  31  -0.935  13.621  -0.544
  616   HH21  ARG  31          1HH2      ARG  31   0.115  12.220  -3.584
  617   HH22  ARG  31          2HH2      ARG  31   0.439  13.425  -2.381
  618    H    LEU  32           H        LEU  32  -4.578   5.462  -1.404
  619    HA   LEU  32           HA       LEU  32  -4.031   4.082  -3.800
  620    HB2  LEU  32           2HB      LEU  32  -3.540   3.181  -1.574
  621    HB3  LEU  32           1HB      LEU  32  -5.255   3.106  -1.211
  622    HG   LEU  32           HG       LEU  32  -4.501   1.613  -3.617
  623   HD11  LEU  32          1HD1      LEU  32  -2.473   1.234  -2.315
  624   HD12  LEU  32          2HD1      LEU  32  -3.453  -0.230  -2.408
  625   HD13  LEU  32          3HD1      LEU  32  -3.446   0.734  -0.931
  626   HD21  LEU  32          3HD2      LEU  32  -5.919  -0.078  -2.575
  627   HD22  LEU  32          1HD2      LEU  32  -6.709   1.496  -2.568
  628   HD23  LEU  32          2HD2      LEU  32  -5.977   0.873  -1.089
  629    H    LEU  33           H        LEU  33  -7.030   4.739  -2.047
  630    HA   LEU  33           HA       LEU  33  -8.719   3.234  -3.759
  631    HB2  LEU  33           2HB      LEU  33  -9.398   5.571  -1.973
  632    HB3  LEU  33           1HB      LEU  33 -10.554   4.461  -2.682
  633    HG   LEU  33           HG       LEU  33  -8.412   3.652  -0.717
  634   HD11  LEU  33          1HD1      LEU  33 -10.206   3.516   0.925
  635   HD12  LEU  33          2HD1      LEU  33 -11.348   4.147  -0.261
  636   HD13  LEU  33          3HD1      LEU  33 -10.026   5.162   0.317
  637   HD21  LEU  33          3HD2      LEU  33  -9.136   1.838  -2.182
  638   HD22  LEU  33          1HD2      LEU  33 -10.819   2.173  -1.777
  639   HD23  LEU  33          2HD2      LEU  33  -9.713   1.587  -0.535
  640    H    GLN  34           H        GLN  34  -7.127   6.178  -4.235
  641    HA   GLN  34           HA       GLN  34  -9.117   7.185  -6.115
  642    HB2  GLN  34           2HB      GLN  34  -6.451   8.340  -5.272
  643    HB3  GLN  34           1HB      GLN  34  -7.619   9.133  -6.318
  644    HG2  GLN  34           2HG      GLN  34  -8.060   8.377  -3.437
  645    HG3  GLN  34           1HG      GLN  34  -7.702   9.994  -4.043
  646   HE21  GLN  34          1HE2      GLN  34 -10.017   8.818  -2.592
  647   HE22  GLN  34          2HE2      GLN  34 -11.408   9.226  -3.538
  648    H    THR  35           H        THR  35  -6.100   5.483  -6.052
  649    HA   THR  35           HA       THR  35  -5.725   5.885  -8.931
  650    HB   THR  35           HB       THR  35  -3.560   4.535  -8.427
  651    HG1  THR  35           1HG      THR  35  -4.050   5.562  -5.816
  652   HG21  THR  35          3HG2      THR  35  -2.416   6.612  -7.701
  653   HG22  THR  35          1HG2      THR  35  -3.994   7.344  -7.408
  654   HG23  THR  35          2HG2      THR  35  -3.530   6.871  -9.044
  655    H    LYS  36           H        LYS  36  -6.660   3.461  -6.614
  656    HA   LYS  36           HA       LYS  36  -6.758   1.476  -8.793
  657    HB2  LYS  36           2HB      LYS  36  -6.349   1.080  -5.829
  658    HB3  LYS  36           1HB      LYS  36  -6.723  -0.239  -6.934
  659    HG2  LYS  36           2HG      LYS  36  -4.567  -0.446  -7.373
  660    HG3  LYS  36           1HG      LYS  36  -4.568   1.177  -8.063
  661    HD2  LYS  36           2HD      LYS  36  -4.303   2.004  -5.660
  662    HD3  LYS  36           1HD      LYS  36  -3.907   0.332  -5.257
  663    HE2  LYS  36           2HE      LYS  36  -1.862   1.533  -5.637
  664    HE3  LYS  36           1HE      LYS  36  -2.107   0.408  -6.971
  665    HZ1  LYS  36           3HZ      LYS  36  -2.756   2.141  -8.392
  666    HZ2  LYS  36           1HZ      LYS  36  -1.387   2.728  -7.588
  667    HZ3  LYS  36           2HZ      LYS  36  -2.926   3.248  -7.123
  668    H    ASN  37           H        ASN  37  -8.681   3.570  -7.619
  669    HA   ASN  37           HA       ASN  37 -10.923   3.835  -7.480
  670    HB2  ASN  37           2HB      ASN  37 -10.906   2.192  -9.408
  671    HB3  ASN  37           1HB      ASN  37 -11.222   0.924  -8.228
  672   HD21  ASN  37          1HD2      ASN  37 -13.235   0.354  -8.888
  673   HD22  ASN  37          2HD2      ASN  37 -14.597   1.417  -8.831
  674    H    TYR  38           H        TYR  38 -12.886   3.083  -6.262
  675    HA   TYR  38           HA       TYR  38 -12.112   2.317  -3.586
  676    HB2  TYR  38           2HB      TYR  38 -14.868   2.882  -4.699
  677    HB3  TYR  38           1HB      TYR  38 -14.432   2.804  -2.999
  678    HD1  TYR  38           1HD      TYR  38 -13.043   4.610  -2.003
  679    HD2  TYR  38           2HD      TYR  38 -14.516   4.855  -5.988
  680    HE1  TYR  38           1HE      TYR  38 -12.620   7.033  -2.007
  681    HE2  TYR  38           2HE      TYR  38 -14.093   7.274  -6.002
  682    HH   TYR  38           HH       TYR  38 -13.829   9.102  -4.478
  683    H    ASP  39           H        ASP  39 -11.470   0.189  -4.969
  684    HA   ASP  39           HA       ASP  39 -13.741  -1.673  -4.786
  685    HB2  ASP  39           2HB      ASP  39 -11.686  -1.331  -6.747
  686    HB3  ASP  39           1HB      ASP  39 -11.526  -2.931  -6.029
  687    H    ILE  40           H        ILE  40 -13.789  -2.576  -2.850
  688    HA   ILE  40           HA       ILE  40 -11.669  -2.838  -1.055
  689    HB   ILE  40           HB       ILE  40 -14.145  -4.562  -1.227
  690   HG12  ILE  40          2HG1      ILE  40 -13.779  -2.127   0.505
  691   HG13  ILE  40          1HG1      ILE  40 -14.417  -2.002  -1.130
  692   HG21  ILE  40          1HG2      ILE  40 -12.442  -5.499   0.242
  693   HG22  ILE  40          2HG2      ILE  40 -13.821  -4.909   1.168
  694   HG23  ILE  40          3HG2      ILE  40 -12.333  -3.966   1.109
  695   HD11  ILE  40          3HD1      ILE  40 -15.625  -3.690   1.049
  696   HD12  ILE  40          1HD1      ILE  40 -16.290  -3.394  -0.557
  697   HD13  ILE  40          2HD1      ILE  40 -16.168  -2.071   0.603
  698    H    GLY  41           H        GLY  41 -13.074  -5.274  -3.250
  699    HA2  GLY  41           2HA      GLY  41 -11.397  -7.402  -2.572
  700    HA3  GLY  41           1HA      GLY  41 -12.195  -7.209  -4.125
  701    H    ALA  42           H        ALA  42 -10.970  -4.954  -5.113
  702    HA   ALA  42           HA       ALA  42  -8.544  -5.988  -6.106
  703    HB1  ALA  42           1HB      ALA  42  -8.287  -3.901  -7.260
  704    HB2  ALA  42           2HB      ALA  42  -9.436  -3.108  -6.181
  705    HB3  ALA  42           3HB      ALA  42  -9.989  -4.355  -7.300
  706    H    ALA  43           H        ALA  43  -9.214  -3.450  -3.705
  707    HA   ALA  43           HA       ALA  43  -6.557  -2.715  -3.198
  708    HB1  ALA  43           1HB      ALA  43  -8.921  -2.680  -1.320
  709    HB2  ALA  43           2HB      ALA  43  -8.450  -1.391  -2.430
  710    HB3  ALA  43           3HB      ALA  43  -7.404  -1.815  -1.074
  711    H    LEU  44           H        LEU  44  -8.617  -5.140  -1.643
  712    HA   LEU  44           HA       LEU  44  -6.717  -5.992   0.269
  713    HB2  LEU  44           2HB      LEU  44  -9.355  -6.800  -0.648
  714    HB3  LEU  44           1HB      LEU  44  -8.357  -8.173  -0.220
  715    HG   LEU  44           HG       LEU  44  -8.006  -7.240   2.019
  716   HD11  LEU  44          1HD1      LEU  44  -9.293  -5.290   2.753
  717   HD12  LEU  44          2HD1      LEU  44  -9.866  -5.048   1.101
  718   HD13  LEU  44          3HD1      LEU  44  -8.151  -4.870   1.479
  719   HD21  LEU  44          3HD2      LEU  44  -9.871  -8.751   1.647
  720   HD22  LEU  44          1HD2      LEU  44 -10.902  -7.394   1.193
  721   HD23  LEU  44          2HD2      LEU  44 -10.295  -7.528   2.844
  722    H    ASP  45           H        ASP  45  -7.386  -6.976  -3.032
  723    HA   ASP  45           HA       ASP  45  -5.762  -9.321  -2.964
  724    HB2  ASP  45           2HB      ASP  45  -7.523  -9.156  -4.603
  725    HB3  ASP  45           1HB      ASP  45  -6.814  -7.697  -5.284
  726    H    THR  46           H        THR  46  -5.165  -5.964  -3.752
  727    HA   THR  46           HA       THR  46  -2.673  -6.309  -5.032
  728    HB   THR  46           HB       THR  46  -3.552  -3.894  -3.441
  729    HG1  THR  46           1HG      THR  46  -5.148  -4.483  -4.997
  730   HG21  THR  46          3HG2      THR  46  -2.109  -2.648  -4.927
  731   HG22  THR  46          1HG2      THR  46  -1.739  -4.103  -5.850
  732   HG23  THR  46          2HG2      THR  46  -1.178  -3.950  -4.187
  733    H    ILE  47           H        ILE  47  -3.576  -5.990  -1.644
  734    HA   ILE  47           HA       ILE  47  -0.738  -6.087  -0.902
  735    HB   ILE  47           HB       ILE  47  -1.482  -5.434   1.358
  736   HG12  ILE  47          2HG1      ILE  47  -4.211  -5.196   0.064
  737   HG13  ILE  47          1HG1      ILE  47  -3.753  -6.417   1.243
  738   HG21  ILE  47          1HG2      ILE  47  -2.519  -3.599  -0.808
  739   HG22  ILE  47          2HG2      ILE  47  -0.823  -3.762  -0.352
  740   HG23  ILE  47          3HG2      ILE  47  -1.991  -3.128   0.810
  741   HD11  ILE  47          3HD1      ILE  47  -3.374  -4.640   2.898
  742   HD12  ILE  47          1HD1      ILE  47  -5.032  -4.675   2.302
  743   HD13  ILE  47          2HD1      ILE  47  -3.909  -3.450   1.710
  744    H    GLN  48           H        GLN  48  -3.411  -8.078  -1.200
  745    HA   GLN  48           HA       GLN  48  -3.824 -10.245  -0.737
  746    HB2  GLN  48           2HB      GLN  48  -0.933 -10.025  -0.510
  747    HB3  GLN  48           1HB      GLN  48  -1.595 -11.341   0.447
  748    HG2  GLN  48           2HG      GLN  48  -2.186 -10.918  -2.467
  749    HG3  GLN  48           1HG      GLN  48  -0.918 -11.979  -1.857
  750   HE21  GLN  48          1HE2      GLN  48  -2.328 -12.985   0.383
  751   HE22  GLN  48          2HE2      GLN  48  -3.599 -14.005  -0.201
  752    H    TYR  49           H        TYR  49  -3.144  -8.072   1.698
  753    HA   TYR  49           HA       TYR  49  -3.442  -9.855   3.929
  754    HB2  TYR  49           2HB      TYR  49  -3.271  -6.880   3.597
  755    HB3  TYR  49           1HB      TYR  49  -3.864  -7.542   5.116
  756    HD1  TYR  49           2HD      TYR  49  -1.333  -9.423   3.279
  757    HD2  TYR  49           1HD      TYR  49  -1.984  -6.479   6.277
  758    HE1  TYR  49           2HE      TYR  49   0.984  -9.715   4.059
  759    HE2  TYR  49           1HE      TYR  49   0.324  -6.761   7.070
  760    HH   TYR  49           HH       TYR  49   2.686  -8.513   5.300
  761    H    SER  50           H        SER  50  -5.368 -10.941   3.473
  762    HA   SER  50           HA       SER  50  -7.789  -9.315   3.869
  763    HB2  SER  50           2HB      SER  50  -7.688 -11.879   2.277
  764    HB3  SER  50           1HB      SER  50  -9.000 -10.701   2.349
  765    HG   SER  50           HG       SER  50  -6.842  -9.395   1.587
  766    H    LYS  51           H        LYS  51  -5.917 -12.012   4.852
  767    HA   LYS  51           HA       LYS  51  -8.049 -12.827   6.711
  768    HB2  LYS  51           2HB      LYS  51  -5.928 -14.463   5.334
  769    HB3  LYS  51           1HB      LYS  51  -6.743 -15.037   6.781
  770    HG2  LYS  51           2HG      LYS  51  -8.376 -15.822   5.524
  771    HG3  LYS  51           1HG      LYS  51  -8.750 -14.180   5.006
  772    HD2  LYS  51           2HD      LYS  51  -8.398 -15.371   3.018
  773    HD3  LYS  51           1HD      LYS  51  -6.890 -14.493   3.277
  774    HE2  LYS  51           2HE      LYS  51  -5.832 -16.461   4.144
  775    HE3  LYS  51           1HE      LYS  51  -7.352 -17.350   4.102
  776    HZ1  LYS  51           3HZ      LYS  51  -7.353 -17.235   1.715
  777    HZ2  LYS  51           1HZ      LYS  51  -5.880 -17.885   2.235
  778    HZ3  LYS  51           2HZ      LYS  51  -5.958 -16.279   1.716
  779    H    HIS  52           H        HIS  52  -4.536 -13.322   6.450
  780    HA   HIS  52           HA       HIS  52  -3.916 -11.691   8.688
  781    HB2  HIS  52           2HB      HIS  52  -4.962 -14.020   9.545
  782    HB3  HIS  52           1HB      HIS  52  -3.291 -14.529   9.334
  783    HD1  HIS  52           1HD      HIS  52  -1.521 -12.764  10.555
  784    HD2  HIS  52           2HD      HIS  52  -5.421 -12.945  11.968
  785    HE1  HIS  52           1HE      HIS  52  -1.445 -11.787  12.869
  786    HE2  HIS  52           2HE      HIS  52  -3.850 -11.719  13.611
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1  19.521  20.491  -2.769
    2    H2   GLY   1           2HT      GLY   1  17.962  19.973  -2.388
    3    H3   GLY   1           3HT      GLY   1  18.242  20.806  -3.831
    4    HA2  GLY   1           1HA      GLY   1  17.986  18.499  -4.331
    5    HA3  GLY   1           2HA      GLY   1  19.661  18.969  -4.592
    6    H    SER   2           H        SER   2  20.884  17.265  -4.030
    7    HA   SER   2           HA       SER   2  20.134  15.720  -1.660
    8    HB2  SER   2           2HB      SER   2  22.101  14.244  -2.585
    9    HB3  SER   2           1HB      SER   2  20.529  14.206  -3.380
   10    HG   SER   2           HG       SER   2  22.773  14.693  -4.526
   11    HA   PRO   3           HA       PRO   3  23.349  18.142   0.367
   12    HB2  PRO   3           2HB      PRO   3  22.760  17.336   2.886
   13    HB3  PRO   3           1HB      PRO   3  21.821  18.566   2.034
   14    HG2  PRO   3           2HG      PRO   3  21.223  15.667   2.429
   15    HG3  PRO   3           1HG      PRO   3  20.129  17.057   2.524
   16    HD2  PRO   3           2HD      PRO   3  20.288  15.425   0.350
   17    HD3  PRO   3           1HD      PRO   3  19.840  17.139   0.248
   18    HA   PRO   4           HA       PRO   4  26.549  15.071   0.664
   19    HB2  PRO   4           2HB      PRO   4  27.853  16.845   2.624
   20    HB3  PRO   4           1HB      PRO   4  28.431  16.292   1.051
   21    HG2  PRO   4           2HG      PRO   4  27.640  18.823   1.448
   22    HG3  PRO   4           1HG      PRO   4  27.357  17.979  -0.085
   23    HD2  PRO   4           2HD      PRO   4  25.449  18.547   2.143
   24    HD3  PRO   4           1HD      PRO   4  25.188  18.600   0.389
   25    H    GLU   5           H        GLU   5  24.774  16.208   3.371
   26    HA   GLU   5           HA       GLU   5  25.997  14.402   5.267
   27    HB2  GLU   5           2HB      GLU   5  23.517  16.102   5.546
   28    HB3  GLU   5           1HB      GLU   5  24.357  15.271   6.850
   29    HG2  GLU   5           2HG      GLU   5  25.347  17.589   5.212
   30    HG3  GLU   5           1HG      GLU   5  24.963  17.563   6.931
   31    H    ALA   6           H        ALA   6  23.898  13.978   2.783
   32    HA   ALA   6           HA       ALA   6  22.133  12.094   4.112
   33    HB1  ALA   6           1HB      ALA   6  22.385  12.846   1.195
   34    HB2  ALA   6           2HB      ALA   6  21.199  13.473   2.342
   35    HB3  ALA   6           3HB      ALA   6  21.158  11.774   1.874
   36    H    ASP   7           H        ASP   7  22.644  10.023   4.385
   37    HA   ASP   7           HA       ASP   7  25.081   8.914   3.549
   38    HB2  ASP   7           2HB      ASP   7  23.723   8.137   5.510
   39    HB3  ASP   7           1HB      ASP   7  22.600   7.395   4.376
   40    HA   PRO   8           HA       PRO   8  24.139   8.061  -0.714
   41    HB2  PRO   8           2HB      PRO   8  26.248   6.370  -1.156
   42    HB3  PRO   8           1HB      PRO   8  26.363   8.135  -1.168
   43    HG2  PRO   8           2HG      PRO   8  27.029   6.202   1.023
   44    HG3  PRO   8           1HG      PRO   8  27.923   7.637   0.486
   45    HD2  PRO   8           2HD      PRO   8  26.384   7.682   2.679
   46    HD3  PRO   8           1HD      PRO   8  26.507   9.092   1.607
   47    H    ARG   9           H        ARG   9  24.351   5.646   1.773
   48    HA   ARG   9           HA       ARG   9  23.342   3.572  -0.025
   49    HB2  ARG   9           2HB      ARG   9  24.012   3.378   2.916
   50    HB3  ARG   9           1HB      ARG   9  23.663   2.037   1.834
   51    HG2  ARG   9           2HG      ARG   9  25.695   2.191   0.773
   52    HG3  ARG   9           1HG      ARG   9  25.920   3.884   1.216
   53    HD2  ARG   9           2HD      ARG   9  26.084   1.506   3.052
   54    HD3  ARG   9           1HD      ARG   9  27.427   2.495   2.485
   55    HE   ARG   9           HE       ARG   9  25.665   4.217   3.739
   56   HH11  ARG   9          1HH1      ARG   9  27.576   1.417   4.617
   57   HH12  ARG   9          2HH1      ARG   9  27.789   1.924   6.264
   58   HH21  ARG   9          1HH2      ARG   9  25.968   4.903   5.890
   59   HH22  ARG   9          2HH2      ARG   9  26.884   3.903   6.984
   60    H    LEU  10           H        LEU  10  22.356   5.631   2.613
   61    HA   LEU  10           HA       LEU  10  19.898   4.352   3.181
   62    HB2  LEU  10           2HB      LEU  10  20.962   5.947   4.717
   63    HB3  LEU  10           1HB      LEU  10  20.700   7.235   3.557
   64    HG   LEU  10           HG       LEU  10  18.209   6.742   3.788
   65   HD11  LEU  10          1HD1      LEU  10  17.513   5.681   5.867
   66   HD12  LEU  10          2HD1      LEU  10  19.193   5.295   6.241
   67   HD13  LEU  10          3HD1      LEU  10  18.409   4.556   4.845
   68   HD21  LEU  10          3HD2      LEU  10  19.751   7.802   6.146
   69   HD22  LEU  10          1HD2      LEU  10  18.039   8.085   5.830
   70   HD23  LEU  10          2HD2      LEU  10  19.258   8.717   4.722
   71    H    ILE  11           H        ILE  11  20.893   6.782   0.861
   72    HA   ILE  11           HA       ILE  11  18.233   7.421   0.014
   73    HB   ILE  11           HB       ILE  11  20.251   8.941  -0.221
   74   HG12  ILE  11          2HG1      ILE  11  18.686   8.440  -2.763
   75   HG13  ILE  11          1HG1      ILE  11  18.063   9.306  -1.362
   76   HG21  ILE  11          1HG2      ILE  11  21.632   8.687  -2.224
   77   HG22  ILE  11          2HG2      ILE  11  20.838   7.151  -2.574
   78   HG23  ILE  11          3HG2      ILE  11  21.824   7.322  -1.122
   79   HD11  ILE  11          3HD1      ILE  11  19.792  11.003  -1.639
   80   HD12  ILE  11          1HD1      ILE  11  18.803  10.838  -3.089
   81   HD13  ILE  11          2HD1      ILE  11  20.419  10.133  -3.040
   82    H    GLU  12           H        GLU  12  20.331   4.818  -0.522
   83    HA   GLU  12           HA       GLU  12  19.557   4.128  -3.175
   84    HB2  GLU  12           2HB      GLU  12  20.815   2.520  -0.955
   85    HB3  GLU  12           1HB      GLU  12  20.496   1.863  -2.553
   86    HG2  GLU  12           2HG      GLU  12  22.124   4.340  -2.180
   87    HG3  GLU  12           1HG      GLU  12  22.833   2.735  -2.036
   88    H    SER  13           H        SER  13  18.027   3.862  -0.138
   89    HA   SER  13           HA       SER  13  16.500   1.553  -0.436
   90    HB2  SER  13           2HB      SER  13  15.487   4.084   0.859
   91    HB3  SER  13           1HB      SER  13  15.099   2.415   1.281
   92    HG   SER  13           HG       SER  13  17.310   3.953   1.940
   93    H    LEU  14           H        LEU  14  16.109   4.747  -1.802
   94    HA   LEU  14           HA       LEU  14  13.453   4.289  -2.780
   95    HB2  LEU  14           2HB      LEU  14  15.522   6.405  -3.335
   96    HB3  LEU  14           1HB      LEU  14  13.995   6.354  -4.194
   97    HG   LEU  14           HG       LEU  14  12.952   6.379  -1.799
   98   HD11  LEU  14          1HD1      LEU  14  14.277   7.635  -0.180
   99   HD12  LEU  14          2HD1      LEU  14  15.659   7.595  -1.276
  100   HD13  LEU  14          3HD1      LEU  14  15.042   6.095  -0.579
  101   HD21  LEU  14          3HD2      LEU  14  12.949   8.842  -1.850
  102   HD22  LEU  14          1HD2      LEU  14  12.638   8.131  -3.434
  103   HD23  LEU  14          2HD2      LEU  14  14.229   8.798  -3.064
  104    H    SER  15           H        SER  15  16.720   4.261  -4.176
  105    HA   SER  15           HA       SER  15  15.922   3.652  -6.815
  106    HB2  SER  15           2HB      SER  15  18.513   2.568  -6.316
  107    HB3  SER  15           1HB      SER  15  18.102   4.066  -7.151
  108    HG   SER  15           HG       SER  15  19.418   3.902  -4.946
  109    H    GLN  16           H        GLN  16  16.733   1.658  -4.026
  110    HA   GLN  16           HA       GLN  16  16.929  -0.829  -5.261
  111    HB2  GLN  16           2HB      GLN  16  17.545  -0.417  -2.925
  112    HB3  GLN  16           1HB      GLN  16  15.855  -0.171  -2.510
  113    HG2  GLN  16           2HG      GLN  16  16.702  -2.384  -1.855
  114    HG3  GLN  16           1HG      GLN  16  15.351  -2.475  -2.985
  115   HE21  GLN  16          1HE2      GLN  16  15.945  -4.572  -3.591
  116   HE22  GLN  16          2HE2      GLN  16  17.292  -4.869  -4.622
  117    H    MET  17           H        MET  17  14.053   0.808  -3.962
  118    HA   MET  17           HA       MET  17  12.240  -1.277  -4.537
  119    HB2  MET  17           2HB      MET  17  11.700   1.696  -4.348
  120    HB3  MET  17           1HB      MET  17  10.480   0.431  -4.293
  121    HG2  MET  17           2HG      MET  17  12.617   1.017  -2.266
  122    HG3  MET  17           1HG      MET  17  10.869   1.148  -2.073
  123    HE1  MET  17           3HE      MET  17   9.251  -0.815  -1.714
  124    HE2  MET  17           1HE      MET  17   9.688  -2.519  -1.824
  125    HE3  MET  17           2HE      MET  17   9.682  -1.516  -3.275
  126    H    LEU  18           H        LEU  18  13.267   1.560  -6.365
  127    HA   LEU  18           HA       LEU  18  11.531   1.263  -8.554
  128    HB2  LEU  18           2HB      LEU  18  12.709   3.329  -8.195
  129    HB3  LEU  18           1HB      LEU  18  14.262   2.523  -8.312
  130    HG   LEU  18           HG       LEU  18  13.752   2.023 -10.710
  131   HD11  LEU  18          1HD1      LEU  18  11.426   3.873 -10.212
  132   HD12  LEU  18          2HD1      LEU  18  11.342   2.170 -10.656
  133   HD13  LEU  18          3HD1      LEU  18  11.989   3.347 -11.798
  134   HD21  LEU  18          3HD2      LEU  18  15.201   3.861 -10.140
  135   HD22  LEU  18          1HD2      LEU  18  13.815   4.916  -9.860
  136   HD23  LEU  18          2HD2      LEU  18  14.165   4.332 -11.487
  137    H    SER  19           H        SER  19  14.898   0.193  -8.108
  138    HA   SER  19           HA       SER  19  15.138  -1.093 -10.601
  139    HB2  SER  19           2HB      SER  19  16.623  -1.713  -8.037
  140    HB3  SER  19           1HB      SER  19  17.146  -2.115  -9.673
  141    HG   SER  19           HG       SER  19  18.180  -0.257  -9.275
  142    H    MET  20           H        MET  20  13.692  -2.097  -7.609
  143    HA   MET  20           HA       MET  20  13.674  -4.900  -8.215
  144    HB2  MET  20           2HB      MET  20  13.576  -4.028  -5.897
  145    HB3  MET  20           1HB      MET  20  11.999  -3.334  -6.245
  146    HG2  MET  20           2HG      MET  20  11.169  -5.634  -6.721
  147    HG3  MET  20           1HG      MET  20  12.722  -6.254  -6.166
  148    HE1  MET  20           3HE      MET  20  13.351  -4.214  -3.725
  149    HE2  MET  20           1HE      MET  20  13.643  -5.952  -3.754
  150    HE3  MET  20           2HE      MET  20  12.749  -5.230  -2.415
  151    H    GLY  21           H        GLY  21  11.857  -2.205  -9.184
  152    HA2  GLY  21           2HA      GLY  21  10.350  -2.348 -11.019
  153    HA3  GLY  21           1HA      GLY  21   9.941  -3.984 -10.522
  154    H    PHE  22           H        PHE  22  10.119  -1.772  -7.942
  155    HA   PHE  22           HA       PHE  22   7.180  -1.684  -7.880
  156    HB2  PHE  22           2HB      PHE  22   8.811  -2.628  -5.947
  157    HB3  PHE  22           1HB      PHE  22   8.764  -0.936  -5.478
  158    HD1  PHE  22           2HD      PHE  22   5.774  -0.777  -6.657
  159    HD2  PHE  22           1HD      PHE  22   7.808  -3.175  -3.795
  160    HE1  PHE  22           2HE      PHE  22   3.650  -1.186  -5.493
  161    HE2  PHE  22           1HE      PHE  22   5.688  -3.589  -2.622
  162    HZ   PHE  22           HZ       PHE  22   3.601  -2.594  -3.470
  163    H    SER  23           H        SER  23   6.277   0.144  -8.347
  164    HA   SER  23           HA       SER  23   7.244   2.663  -7.387
  165    HB2  SER  23           2HB      SER  23   7.277   2.061 -10.361
  166    HB3  SER  23           1HB      SER  23   7.357   3.686  -9.684
  167    HG   SER  23           HG       SER  23   9.181   2.033  -8.530
  168    H    ASP  24           H        ASP  24   5.483   3.836  -6.921
  169    HA   ASP  24           HA       ASP  24   2.968   2.987  -8.162
  170    HB2  ASP  24           2HB      ASP  24   1.879   3.364  -6.199
  171    HB3  ASP  24           1HB      ASP  24   3.478   3.015  -5.557
  172    H    GLU  25           H        GLU  25   1.281   4.891  -8.134
  173    HA   GLU  25           HA       GLU  25   2.635   7.155  -9.447
  174    HB2  GLU  25           2HB      GLU  25  -0.031   7.057 -10.344
  175    HB3  GLU  25           1HB      GLU  25   1.426   6.697 -11.257
  176    HG2  GLU  25           2HG      GLU  25   0.033   4.841 -11.533
  177    HG3  GLU  25           1HG      GLU  25   1.250   4.338 -10.364
  178    H    GLY  26           H        GLY  26   0.140   6.230  -7.174
  179    HA2  GLY  26           2HA      GLY  26  -0.995   8.870  -6.978
  180    HA3  GLY  26           1HA      GLY  26  -1.344   7.508  -5.927
  181    H    GLY  27           H        GLY  27   1.717   7.331  -5.599
  182    HA2  GLY  27           2HA      GLY  27   3.379   8.506  -4.405
  183    HA3  GLY  27           1HA      GLY  27   2.170   9.697  -3.933
  184    H    TRP  28           H        TRP  28   1.645   6.238  -3.713
  185    HA   TRP  28           HA       TRP  28   1.319   6.602  -0.838
  186    HB2  TRP  28           2HB      TRP  28   0.040   4.611  -0.784
  187    HB3  TRP  28           1HB      TRP  28  -0.472   5.483  -2.214
  188    HD1  TRP  28           HD       TRP  28  -0.223   4.277  -4.521
  189    HE1  TRP  28           1HE      TRP  28   0.466   1.896  -5.215
  190    HE3  TRP  28           3HE      TRP  28   1.693   2.642  -0.067
  191    HZ2  TRP  28           2HZ      TRP  28   1.642  -0.374  -4.036
  192    HZ3  TRP  28           3HZ      TRP  28   2.567   0.346   0.062
  193    HH2  TRP  28           HH       TRP  28   2.543  -1.128  -1.879
  194    H    LEU  29           H        LEU  29   3.395   4.932  -3.113
  195    HA   LEU  29           HA       LEU  29   4.640   3.260  -1.155
  196    HB2  LEU  29           2HB      LEU  29   4.700   2.773  -3.585
  197    HB3  LEU  29           1HB      LEU  29   5.708   4.187  -3.826
  198    HG   LEU  29           HG       LEU  29   7.386   3.083  -2.252
  199   HD11  LEU  29          1HD1      LEU  29   7.256   0.677  -2.022
  200   HD12  LEU  29          2HD1      LEU  29   5.714   0.656  -2.877
  201   HD13  LEU  29          3HD1      LEU  29   5.837   1.438  -1.299
  202   HD21  LEU  29          3HD2      LEU  29   6.736   1.901  -4.947
  203   HD22  LEU  29          1HD2      LEU  29   8.225   1.570  -4.060
  204   HD23  LEU  29          2HD2      LEU  29   7.860   3.212  -4.587
  205    H    THR  30           H        THR  30   5.219   6.468  -2.437
  206    HA   THR  30           HA       THR  30   7.755   6.853  -1.235
  207    HB   THR  30           HB       THR  30   6.738   8.212  -3.145
  208    HG1  THR  30           1HG      THR  30   8.244   9.141  -0.995
  209   HG21  THR  30          3HG2      THR  30   5.471   9.711  -0.847
  210   HG22  THR  30          1HG2      THR  30   4.602   8.753  -2.047
  211   HG23  THR  30          2HG2      THR  30   5.470  10.207  -2.540
  212    H    ARG  31           H        ARG  31   4.586   6.810   0.003
  213    HA   ARG  31           HA       ARG  31   5.264   8.361   2.388
  214    HB2  ARG  31           2HB      ARG  31   2.703   7.115   1.383
  215    HB3  ARG  31           1HB      ARG  31   2.848   7.788   3.001
  216    HG2  ARG  31           2HG      ARG  31   3.522   9.430   0.593
  217    HG3  ARG  31           1HG      ARG  31   1.852   9.243   1.134
  218    HD2  ARG  31           2HD      ARG  31   3.274   9.834   3.444
  219    HD3  ARG  31           1HD      ARG  31   3.972  10.890   2.216
  220    HE   ARG  31           HE       ARG  31   1.131  10.813   2.998
  221   HH11  ARG  31          1HH1      ARG  31   3.871  12.479   1.581
  222   HH12  ARG  31          2HH1      ARG  31   2.993  13.948   1.309
  223   HH21  ARG  31          1HH2      ARG  31  -0.020  12.750   2.656
  224   HH22  ARG  31          2HH2      ARG  31   0.779  14.109   1.934
  225    H    LEU  32           H        LEU  32   4.524   5.120   1.304
  226    HA   LEU  32           HA       LEU  32   4.317   3.795   3.743
  227    HB2  LEU  32           2HB      LEU  32   3.810   2.881   1.464
  228    HB3  LEU  32           1HB      LEU  32   5.534   2.715   1.198
  229    HG   LEU  32           HG       LEU  32   5.280   1.328   3.499
  230   HD11  LEU  32          1HD1      LEU  32   2.856   1.630   3.573
  231   HD12  LEU  32          2HD1      LEU  32   3.287  -0.067   3.368
  232   HD13  LEU  32          3HD1      LEU  32   2.710   0.869   1.989
  233   HD21  LEU  32          3HD2      LEU  32   5.348  -0.685   2.111
  234   HD22  LEU  32          1HD2      LEU  32   6.394   0.578   1.463
  235   HD23  LEU  32          2HD2      LEU  32   4.829   0.260   0.715
  236    H    LEU  33           H        LEU  33   7.155   4.632   1.825
  237    HA   LEU  33           HA       LEU  33   9.045   3.211   3.381
  238    HB2  LEU  33           2HB      LEU  33   9.399   5.613   1.591
  239    HB3  LEU  33           1HB      LEU  33  10.715   4.661   2.257
  240    HG   LEU  33           HG       LEU  33   8.610   3.636   0.343
  241   HD11  LEU  33          1HD1      LEU  33  10.392   3.615  -1.299
  242   HD12  LEU  33          2HD1      LEU  33  11.525   4.269  -0.115
  243   HD13  LEU  33          3HD1      LEU  33  10.166   5.247  -0.670
  244   HD21  LEU  33          3HD2      LEU  33   9.368   1.851   1.757
  245   HD22  LEU  33          1HD2      LEU  33  11.052   2.331   1.545
  246   HD23  LEU  33          2HD2      LEU  33  10.140   1.680   0.182
  247    H    GLN  34           H        GLN  34   7.257   5.956   4.130
  248    HA   GLN  34           HA       GLN  34   9.315   7.099   5.858
  249    HB2  GLN  34           2HB      GLN  34   6.480   8.051   5.417
  250    HB3  GLN  34           1HB      GLN  34   7.774   8.935   6.209
  251    HG2  GLN  34           2HG      GLN  34   7.620   8.186   3.299
  252    HG3  GLN  34           1HG      GLN  34   7.419   9.795   3.990
  253   HE21  GLN  34          1HE2      GLN  34   9.323   8.724   2.018
  254   HE22  GLN  34          2HE2      GLN  34  10.899   9.100   2.639
  255    H    THR  35           H        THR  35   5.947   5.974   6.134
  256    HA   THR  35           HA       THR  35   6.039   5.951   8.994
  257    HB   THR  35           HB       THR  35   3.867   4.389   7.940
  258    HG1  THR  35           1HG      THR  35   4.142   6.992   6.794
  259   HG21  THR  35          3HG2      THR  35   3.764   5.604  10.034
  260   HG22  THR  35          1HG2      THR  35   2.535   6.228   8.933
  261   HG23  THR  35          2HG2      THR  35   4.027   7.133   9.194
  262    H    LYS  36           H        LYS  36   6.403   3.516   6.466
  263    HA   LYS  36           HA       LYS  36   6.505   1.407   8.494
  264    HB2  LYS  36           2HB      LYS  36   6.258   1.406   5.508
  265    HB3  LYS  36           1HB      LYS  36   6.834  -0.036   6.335
  266    HG2  LYS  36           2HG      LYS  36   4.540  -0.375   6.086
  267    HG3  LYS  36           1HG      LYS  36   4.728   0.145   7.762
  268    HD2  LYS  36           2HD      LYS  36   4.068   2.407   7.152
  269    HD3  LYS  36           1HD      LYS  36   3.935   1.930   5.457
  270    HE2  LYS  36           2HE      LYS  36   1.734   1.899   6.290
  271    HE3  LYS  36           1HE      LYS  36   2.236   0.210   6.238
  272    HZ1  LYS  36           3HZ      LYS  36   1.177   0.562   8.300
  273    HZ2  LYS  36           1HZ      LYS  36   2.056   1.976   8.615
  274    HZ3  LYS  36           2HZ      LYS  36   2.826   0.467   8.638
  275    H    ASN  37           H        ASN  37   8.578   3.582   7.412
  276    HA   ASN  37           HA       ASN  37  10.833   3.820   7.578
  277    HB2  ASN  37           2HB      ASN  37  10.722   2.228   9.485
  278    HB3  ASN  37           1HB      ASN  37  10.907   0.893   8.355
  279   HD21  ASN  37          1HD2      ASN  37  12.824   0.133   9.104
  280   HD22  ASN  37          2HD2      ASN  37  14.305   1.016   9.010
  281    H    TYR  38           H        TYR  38  12.856   3.163   6.467
  282    HA   TYR  38           HA       TYR  38  12.265   2.417   3.739
  283    HB2  TYR  38           2HB      TYR  38  14.825   3.258   5.112
  284    HB3  TYR  38           1HB      TYR  38  14.707   2.902   3.393
  285    HD1  TYR  38           1HD      TYR  38  13.398   4.401   1.906
  286    HD2  TYR  38           2HD      TYR  38  14.011   5.318   6.017
  287    HE1  TYR  38           1HE      TYR  38  12.754   6.737   1.476
  288    HE2  TYR  38           2HE      TYR  38  13.366   7.655   5.599
  289    HH   TYR  38           HH       TYR  38  12.901   9.186   4.035
  290    H    ASP  39           H        ASP  39  11.885   0.314   5.608
  291    HA   ASP  39           HA       ASP  39  14.166  -1.471   5.211
  292    HB2  ASP  39           2HB      ASP  39  12.853  -1.190   7.446
  293    HB3  ASP  39           1HB      ASP  39  11.652  -2.224   6.677
  294    H    ILE  40           H        ILE  40  14.138  -2.223   3.208
  295    HA   ILE  40           HA       ILE  40  11.935  -2.669   1.569
  296    HB   ILE  40           HB       ILE  40  14.644  -3.996   1.499
  297   HG12  ILE  40          2HG1      ILE  40  14.524  -2.207  -0.576
  298   HG13  ILE  40          1HG1      ILE  40  13.615  -1.368   0.678
  299   HG21  ILE  40          1HG2      ILE  40  13.075  -5.313   0.221
  300   HG22  ILE  40          2HG2      ILE  40  14.154  -4.444  -0.874
  301   HG23  ILE  40          3HG2      ILE  40  12.508  -3.868  -0.617
  302   HD11  ILE  40          3HD1      ILE  40  16.429  -2.413   0.917
  303   HD12  ILE  40          1HD1      ILE  40  15.525  -1.596   2.192
  304   HD13  ILE  40          2HD1      ILE  40  15.950  -0.728   0.717
  305    H    GLY  41           H        GLY  41  13.630  -4.905   3.729
  306    HA2  GLY  41           2HA      GLY  41  12.346  -7.279   2.979
  307    HA3  GLY  41           1HA      GLY  41  13.045  -6.964   4.560
  308    H    ALA  42           H        ALA  42  11.511  -4.975   5.539
  309    HA   ALA  42           HA       ALA  42   9.215  -6.317   6.455
  310    HB1  ALA  42           1HB      ALA  42   8.611  -4.155   7.480
  311    HB2  ALA  42           2HB      ALA  42   9.907  -3.385   6.567
  312    HB3  ALA  42           3HB      ALA  42  10.289  -4.604   7.782
  313    H    ALA  43           H        ALA  43   9.665  -3.809   4.016
  314    HA   ALA  43           HA       ALA  43   6.984  -3.257   3.467
  315    HB1  ALA  43           1HB      ALA  43   9.323  -3.139   1.565
  316    HB2  ALA  43           2HB      ALA  43   8.848  -1.871   2.696
  317    HB3  ALA  43           3HB      ALA  43   7.776  -2.313   1.366
  318    H    LEU  44           H        LEU  44   9.163  -5.614   1.959
  319    HA   LEU  44           HA       LEU  44   7.431  -6.549  -0.029
  320    HB2  LEU  44           2HB      LEU  44   9.927  -7.408   1.216
  321    HB3  LEU  44           1HB      LEU  44   8.944  -8.748   0.659
  322    HG   LEU  44           HG       LEU  44   8.907  -7.797  -1.598
  323   HD11  LEU  44          1HD1      LEU  44  10.745  -5.691  -0.463
  324   HD12  LEU  44          2HD1      LEU  44   9.090  -5.432  -1.019
  325   HD13  LEU  44          3HD1      LEU  44  10.342  -5.906  -2.166
  326   HD21  LEU  44          3HD2      LEU  44  10.638  -9.388  -1.029
  327   HD22  LEU  44          1HD2      LEU  44  11.659  -8.089  -0.411
  328   HD23  LEU  44          2HD2      LEU  44  11.272  -8.166  -2.130
  329    H    ASP  45           H        ASP  45   7.856  -7.596   3.318
  330    HA   ASP  45           HA       ASP  45   6.027  -9.795   3.076
  331    HB2  ASP  45           2HB      ASP  45   7.886  -9.744   4.729
  332    HB3  ASP  45           1HB      ASP  45   7.040  -8.462   5.591
  333    H    THR  46           H        THR  46   5.702  -6.438   3.651
  334    HA   THR  46           HA       THR  46   3.327  -6.416   5.163
  335    HB   THR  46           HB       THR  46   4.351  -4.361   3.195
  336    HG1  THR  46           1HG      THR  46   5.730  -4.853   5.034
  337   HG21  THR  46          3HG2      THR  46   1.965  -4.044   3.668
  338   HG22  THR  46          1HG2      THR  46   2.938  -2.761   4.388
  339   HG23  THR  46          2HG2      THR  46   2.306  -4.061   5.399
  340    H    ILE  47           H        ILE  47   3.919  -6.725   1.703
  341    HA   ILE  47           HA       ILE  47   1.006  -6.825   1.271
  342    HB   ILE  47           HB       ILE  47   1.452  -6.352  -1.092
  343   HG12  ILE  47          2HG1      ILE  47   4.322  -5.812  -0.355
  344   HG13  ILE  47          1HG1      ILE  47   3.811  -7.389  -0.950
  345   HG21  ILE  47          1HG2      ILE  47   2.876  -4.311   0.604
  346   HG22  ILE  47          2HG2      ILE  47   1.127  -4.537   0.641
  347   HG23  ILE  47          3HG2      ILE  47   1.921  -4.042  -0.854
  348   HD11  ILE  47          3HD1      ILE  47   2.993  -6.337  -3.001
  349   HD12  ILE  47          1HD1      ILE  47   4.713  -6.045  -2.748
  350   HD13  ILE  47          2HD1      ILE  47   3.540  -4.771  -2.409
  351    H    GLN  48           H        GLN  48   3.045  -8.994   2.073
  352    HA   GLN  48           HA       GLN  48   3.176 -11.251   1.847
  353    HB2  GLN  48           2HB      GLN  48   0.802 -10.688   0.128
  354    HB3  GLN  48           1HB      GLN  48   1.565 -12.265   0.007
  355    HG2  GLN  48           2HG      GLN  48   0.688 -11.092   2.621
  356    HG3  GLN  48           1HG      GLN  48  -0.366 -12.075   1.607
  357   HE21  GLN  48          1HE2      GLN  48   0.567 -12.624   4.282
  358   HE22  GLN  48          2HE2      GLN  48   1.452 -14.107   4.206
  359    H    TYR  49           H        TYR  49   2.824  -9.745  -1.357
  360    HA   TYR  49           HA       TYR  49   4.349 -11.624  -2.776
  361    HB2  TYR  49           2HB      TYR  49   3.956  -8.684  -3.376
  362    HB3  TYR  49           1HB      TYR  49   4.506  -9.902  -4.520
  363    HD1  TYR  49           1HD      TYR  49   2.868 -11.918  -4.886
  364    HD2  TYR  49           2HD      TYR  49   1.700  -8.151  -3.288
  365    HE1  TYR  49           1HE      TYR  49   0.539 -12.365  -5.537
  366    HE2  TYR  49           2HE      TYR  49  -0.635  -8.593  -3.938
  367    HH   TYR  49           HH       TYR  49  -1.913  -9.930  -5.402
  368    H    SER  50           H        SER  50   6.345 -12.155  -2.134
  369    HA   SER  50           HA       SER  50   8.318  -9.985  -1.907
  370    HB2  SER  50           2HB      SER  50   8.407 -12.494  -0.229
  371    HB3  SER  50           1HB      SER  50   9.378 -11.033  -0.043
  372    HG   SER  50           HG       SER  50   6.869 -10.266   0.087
  373    H    LYS  51           H        LYS  51   7.509 -13.190  -2.951
  374    HA   LYS  51           HA       LYS  51  10.197 -13.580  -4.053
  375    HB2  LYS  51           2HB      LYS  51   7.889 -15.515  -3.803
  376    HB3  LYS  51           1HB      LYS  51   9.472 -15.913  -4.450
  377    HG2  LYS  51           2HG      LYS  51  10.506 -15.715  -2.359
  378    HG3  LYS  51           1HG      LYS  51   9.138 -14.838  -1.671
  379    HD2  LYS  51           2HD      LYS  51   8.982 -17.007  -0.778
  380    HD3  LYS  51           1HD      LYS  51   7.787 -16.963  -2.071
  381    HE2  LYS  51           2HE      LYS  51  10.466 -17.843  -2.894
  382    HE3  LYS  51           1HE      LYS  51   9.652 -18.914  -1.759
  383    HZ1  LYS  51           3HZ      LYS  51   8.395 -17.945  -4.260
  384    HZ2  LYS  51           1HZ      LYS  51   7.843 -19.176  -3.244
  385    HZ3  LYS  51           2HZ      LYS  51   9.251 -19.399  -4.159
  386    H    HIS  52           H        HIS  52   6.779 -13.760  -5.014
  387    HA   HIS  52           HA       HIS  52   7.288 -12.537  -7.538
  388    HB2  HIS  52           2HB      HIS  52   7.980 -15.061  -7.745
  389    HB3  HIS  52           1HB      HIS  52   6.242 -15.341  -7.778
  390    HD1  HIS  52           1HD      HIS  52   5.189 -13.245  -9.585
  391    HD2  HIS  52           2HD      HIS  52   8.812 -15.149 -10.306
  392    HE1  HIS  52           1HE      HIS  52   5.622 -12.963 -12.047
  393    HE2  HIS  52           2HE      HIS  52   7.907 -13.956 -12.417
  394    H1   GLY   1           1HT      GLY   1 -16.817  19.399   2.372
  395    H2   GLY   1           2HT      GLY   1 -16.823  20.186   3.865
  396    H3   GLY   1           3HT      GLY   1 -18.118  20.389   2.799
  397    HA2  GLY   1           1HA      GLY   1 -17.382  17.945   4.301
  398    HA3  GLY   1           2HA      GLY   1 -18.847  18.902   4.465
  399    H    SER   2           H        SER   2 -19.529  16.474   4.127
  400    HA   SER   2           HA       SER   2 -19.534  15.588   1.391
  401    HB2  SER   2           2HB      SER   2 -21.451  14.314   3.202
  402    HB3  SER   2           1HB      SER   2 -20.113  13.602   2.296
  403    HG   SER   2           HG       SER   2 -19.093  13.532   4.125
  404    HA   PRO   3           HA       PRO   3 -23.321  17.928   0.668
  405    HB2  PRO   3           2HB      PRO   3 -23.011  18.271  -1.956
  406    HB3  PRO   3           1HB      PRO   3 -21.992  19.144  -0.805
  407    HG2  PRO   3           2HG      PRO   3 -21.345  16.766  -2.482
  408    HG3  PRO   3           1HG      PRO   3 -20.316  18.130  -2.022
  409    HD2  PRO   3           2HD      PRO   3 -20.366  15.602  -0.799
  410    HD3  PRO   3           1HD      PRO   3 -19.608  17.066  -0.144
  411    HA   PRO   4           HA       PRO   4 -26.146  14.791  -0.715
  412    HB2  PRO   4           2HB      PRO   4 -27.618  16.807  -2.284
  413    HB3  PRO   4           1HB      PRO   4 -28.156  15.850  -0.900
  414    HG2  PRO   4           2HG      PRO   4 -27.676  18.475  -0.687
  415    HG3  PRO   4           1HG      PRO   4 -27.307  17.354   0.635
  416    HD2  PRO   4           2HD      PRO   4 -25.457  18.599  -1.365
  417    HD3  PRO   4           1HD      PRO   4 -25.225  18.336   0.376
  418    H    GLU   5           H        GLU   5 -24.154  16.412  -2.829
  419    HA   GLU   5           HA       GLU   5 -25.194  15.371  -5.303
  420    HB2  GLU   5           2HB      GLU   5 -22.523  16.657  -4.712
  421    HB3  GLU   5           1HB      GLU   5 -23.210  16.377  -6.306
  422    HG2  GLU   5           2HG      GLU   5 -24.599  18.070  -4.260
  423    HG3  GLU   5           1HG      GLU   5 -23.373  18.725  -5.343
  424    H    ALA   6           H        ALA   6 -23.286  14.169  -2.779
  425    HA   ALA   6           HA       ALA   6 -21.855  12.279  -4.484
  426    HB1  ALA   6           1HB      ALA   6 -21.704  12.661  -1.496
  427    HB2  ALA   6           2HB      ALA   6 -20.614  13.381  -2.679
  428    HB3  ALA   6           3HB      ALA   6 -20.655  11.631  -2.472
  429    H    ASP   7           H        ASP   7 -22.114  10.053  -4.349
  430    HA   ASP   7           HA       ASP   7 -24.757   9.177  -3.657
  431    HB2  ASP   7           2HB      ASP   7 -23.526   8.320  -5.649
  432    HB3  ASP   7           1HB      ASP   7 -22.399   7.510  -4.565
  433    HA   PRO   8           HA       PRO   8 -23.908   8.129   0.559
  434    HB2  PRO   8           2HB      PRO   8 -26.025   6.398   0.887
  435    HB3  PRO   8           1HB      PRO   8 -26.142   8.159   0.993
  436    HG2  PRO   8           2HG      PRO   8 -26.789   6.345  -1.294
  437    HG3  PRO   8           1HG      PRO   8 -27.663   7.774  -0.715
  438    HD2  PRO   8           2HD      PRO   8 -26.084   7.875  -2.879
  439    HD3  PRO   8           1HD      PRO   8 -26.210   9.245  -1.758
  440    H    ARG   9           H        ARG   9 -24.144   5.729  -1.975
  441    HA   ARG   9           HA       ARG   9 -23.169   3.613  -0.220
  442    HB2  ARG   9           2HB      ARG   9 -23.735   3.547  -3.188
  443    HB3  ARG   9           1HB      ARG   9 -23.388   2.156  -2.174
  444    HG2  ARG   9           2HG      ARG   9 -25.454   2.202  -1.160
  445    HG3  ARG   9           1HG      ARG   9 -25.705   3.912  -1.519
  446    HD2  ARG   9           2HD      ARG   9 -25.729   1.658  -3.522
  447    HD3  ARG   9           1HD      ARG   9 -27.144   2.503  -2.894
  448    HE   ARG   9           HE       ARG   9 -25.418   4.410  -4.003
  449   HH11  ARG   9          1HH1      ARG   9 -27.378   1.705  -5.043
  450   HH12  ARG   9          2HH1      ARG   9 -27.703   2.369  -6.611
  451   HH21  ARG   9          1HH2      ARG   9 -25.836   5.305  -6.060
  452   HH22  ARG   9          2HH2      ARG   9 -26.813   4.420  -7.201
  453    H    LEU  10           H        LEU  10 -22.096   5.686  -2.821
  454    HA   LEU  10           HA       LEU  10 -19.622   4.446  -3.347
  455    HB2  LEU  10           2HB      LEU  10 -20.668   6.082  -4.842
  456    HB3  LEU  10           1HB      LEU  10 -20.426   7.341  -3.646
  457    HG   LEU  10           HG       LEU  10 -17.943   6.957  -3.883
  458   HD11  LEU  10          1HD1      LEU  10 -17.198   5.835  -5.954
  459   HD12  LEU  10          2HD1      LEU  10 -18.853   5.297  -6.234
  460   HD13  LEU  10          3HD1      LEU  10 -17.966   4.725  -4.820
  461   HD21  LEU  10          3HD2      LEU  10 -19.453   7.813  -6.352
  462   HD22  LEU  10          1HD2      LEU  10 -17.782   8.220  -5.969
  463   HD23  LEU  10          2HD2      LEU  10 -19.092   8.829  -4.957
  464    H    ILE  11           H        ILE  11 -20.589   6.930  -1.054
  465    HA   ILE  11           HA       ILE  11 -17.918   7.431  -0.125
  466    HB   ILE  11           HB       ILE  11 -19.788   9.111  -0.071
  467   HG12  ILE  11          2HG1      ILE  11 -18.553   8.590   2.640
  468   HG13  ILE  11          1HG1      ILE  11 -17.688   9.306   1.285
  469   HG21  ILE  11          1HG2      ILE  11 -21.330   9.027   1.866
  470   HG22  ILE  11          2HG2      ILE  11 -20.761   7.392   2.199
  471   HG23  ILE  11          3HG2      ILE  11 -21.604   7.741   0.690
  472   HD11  ILE  11          3HD1      ILE  11 -19.216  11.190   1.280
  473   HD12  ILE  11          1HD1      ILE  11 -18.473  10.989   2.866
  474   HD13  ILE  11          2HD1      ILE  11 -20.134  10.463   2.598
  475    H    GLU  12           H        GLU  12 -20.034   4.893   0.358
  476    HA   GLU  12           HA       GLU  12 -19.378   4.393   3.125
  477    HB2  GLU  12           2HB      GLU  12 -21.174   3.225   1.106
  478    HB3  GLU  12           1HB      GLU  12 -20.508   2.079   2.264
  479    HG2  GLU  12           2HG      GLU  12 -21.986   4.604   2.971
  480    HG3  GLU  12           1HG      GLU  12 -22.669   2.977   2.970
  481    H    SER  13           H        SER  13 -17.967   3.707   0.104
  482    HA   SER  13           HA       SER  13 -16.732   1.248   0.625
  483    HB2  SER  13           2HB      SER  13 -15.595   3.502  -1.047
  484    HB3  SER  13           1HB      SER  13 -15.251   1.778  -1.203
  485    HG   SER  13           HG       SER  13 -16.876   2.796  -2.680
  486    H    LEU  14           H        LEU  14 -16.002   4.471   1.692
  487    HA   LEU  14           HA       LEU  14 -13.321   3.940   2.526
  488    HB2  LEU  14           2HB      LEU  14 -15.241   6.150   3.275
  489    HB3  LEU  14           1HB      LEU  14 -13.563   6.092   3.778
  490    HG   LEU  14           HG       LEU  14 -13.471   5.818   0.998
  491   HD11  LEU  14          1HD1      LEU  14 -14.715   7.765   0.191
  492   HD12  LEU  14          2HD1      LEU  14 -15.433   7.968   1.789
  493   HD13  LEU  14          3HD1      LEU  14 -15.789   6.527   0.837
  494   HD21  LEU  14          3HD2      LEU  14 -13.063   8.271   2.704
  495   HD22  LEU  14          1HD2      LEU  14 -12.418   8.013   1.082
  496   HD23  LEU  14          2HD2      LEU  14 -11.874   7.001   2.420
  497    H    SER  15           H        SER  15 -16.436   4.243   4.233
  498    HA   SER  15           HA       SER  15 -15.439   3.670   6.798
  499    HB2  SER  15           2HB      SER  15 -18.191   2.784   6.264
  500    HB3  SER  15           1HB      SER  15 -17.590   3.957   7.437
  501    HG   SER  15           HG       SER  15 -18.928   4.561   5.367
  502    H    GLN  16           H        GLN  16 -16.530   1.598   4.172
  503    HA   GLN  16           HA       GLN  16 -16.775  -0.805   5.587
  504    HB2  GLN  16           2HB      GLN  16 -17.506  -0.382   3.223
  505    HB3  GLN  16           1HB      GLN  16 -15.821  -0.521   2.734
  506    HG2  GLN  16           2HG      GLN  16 -16.966  -2.592   2.326
  507    HG3  GLN  16           1HG      GLN  16 -15.776  -2.814   3.604
  508   HE21  GLN  16          1HE2      GLN  16 -16.827  -4.627   4.402
  509   HE22  GLN  16          2HE2      GLN  16 -18.315  -4.518   5.281
  510    H    MET  17           H        MET  17 -13.962   0.614   3.948
  511    HA   MET  17           HA       MET  17 -12.187  -1.512   4.489
  512    HB2  MET  17           2HB      MET  17 -11.679   1.417   3.946
  513    HB3  MET  17           1HB      MET  17 -10.396   0.225   4.106
  514    HG2  MET  17           2HG      MET  17 -12.556   0.290   2.012
  515    HG3  MET  17           1HG      MET  17 -10.839   0.619   1.784
  516    HE1  MET  17           3HE      MET  17  -8.953  -1.199   1.866
  517    HE2  MET  17           1HE      MET  17  -9.222  -2.896   2.263
  518    HE3  MET  17           2HE      MET  17  -9.426  -1.656   3.502
  519    H    LEU  18           H        LEU  18 -12.973   1.451   6.233
  520    HA   LEU  18           HA       LEU  18 -11.048   1.189   8.274
  521    HB2  LEU  18           2HB      LEU  18 -12.201   3.291   7.825
  522    HB3  LEU  18           1HB      LEU  18 -13.731   2.578   8.302
  523    HG   LEU  18           HG       LEU  18 -12.775   2.272  10.609
  524   HD11  LEU  18          1HD1      LEU  18 -10.576   4.015   9.500
  525   HD12  LEU  18          2HD1      LEU  18 -10.411   2.349  10.051
  526   HD13  LEU  18          3HD1      LEU  18 -10.815   3.623  11.202
  527   HD21  LEU  18          3HD2      LEU  18 -14.272   4.129   9.992
  528   HD22  LEU  18          1HD2      LEU  18 -12.861   5.107   9.589
  529   HD23  LEU  18          2HD2      LEU  18 -13.120   4.577  11.252
  530    H    SER  19           H        SER  19 -14.450   0.194   8.080
  531    HA   SER  19           HA       SER  19 -14.611  -0.901  10.676
  532    HB2  SER  19           2HB      SER  19 -16.579  -0.307   9.240
  533    HB3  SER  19           1HB      SER  19 -16.228  -1.722   8.246
  534    HG   SER  19           HG       SER  19 -16.318  -2.363  10.876
  535    H    MET  20           H        MET  20 -13.329  -2.109   7.693
  536    HA   MET  20           HA       MET  20 -13.355  -4.873   8.378
  537    HB2  MET  20           2HB      MET  20 -13.102  -3.791   6.051
  538    HB3  MET  20           1HB      MET  20 -11.409  -3.587   6.480
  539    HG2  MET  20           2HG      MET  20 -11.272  -6.037   6.859
  540    HG3  MET  20           1HG      MET  20 -12.919  -6.183   6.256
  541    HE1  MET  20           3HE      MET  20 -13.616  -5.244   3.836
  542    HE2  MET  20           1HE      MET  20 -12.461  -4.858   2.561
  543    HE3  MET  20           2HE      MET  20 -12.658  -3.768   3.931
  544    H    GLY  21           H        GLY  21 -11.384  -2.202   9.228
  545    HA2  GLY  21           2HA      GLY  21  -9.947  -2.399  11.152
  546    HA3  GLY  21           1HA      GLY  21  -9.549  -4.032  10.639
  547    H    PHE  22           H        PHE  22  -9.679  -1.871   8.053
  548    HA   PHE  22           HA       PHE  22  -6.749  -1.739   8.026
  549    HB2  PHE  22           2HB      PHE  22  -8.793  -1.774   5.811
  550    HB3  PHE  22           1HB      PHE  22  -7.138  -1.239   5.530
  551    HD1  PHE  22           2HD      PHE  22  -5.256  -2.843   5.976
  552    HD2  PHE  22           1HD      PHE  22  -9.336  -4.054   5.894
  553    HE1  PHE  22           2HE      PHE  22  -4.553  -5.186   5.672
  554    HE2  PHE  22           1HE      PHE  22  -8.643  -6.396   5.592
  555    HZ   PHE  22           HZ       PHE  22  -6.245  -6.965   5.479
  556    H    SER  23           H        SER  23  -5.821   0.140   8.345
  557    HA   SER  23           HA       SER  23  -7.078   2.605   7.472
  558    HB2  SER  23           2HB      SER  23  -6.536   3.548   9.847
  559    HB3  SER  23           1HB      SER  23  -8.026   2.639   9.608
  560    HG   SER  23           HG       SER  23  -5.720   1.238  10.345
  561    H    ASP  24           H        ASP  24  -5.587   4.199   7.028
  562    HA   ASP  24           HA       ASP  24  -2.791   3.341   7.223
  563    HB2  ASP  24           2HB      ASP  24  -2.350   4.989   5.424
  564    HB3  ASP  24           1HB      ASP  24  -3.482   3.730   4.954
  565    H    GLU  25           H        GLU  25  -1.183   4.706   7.875
  566    HA   GLU  25           HA       GLU  25  -2.065   6.928   9.588
  567    HB2  GLU  25           2HB      GLU  25   0.633   6.223  10.138
  568    HB3  GLU  25           1HB      GLU  25  -0.769   6.014  11.175
  569    HG2  GLU  25           2HG      GLU  25   0.158   3.887  11.037
  570    HG3  GLU  25           1HG      GLU  25  -1.176   3.849   9.888
  571    H    GLY  26           H        GLY  26   0.340   5.892   7.222
  572    HA2  GLY  26           2HA      GLY  26   1.519   8.529   7.055
  573    HA3  GLY  26           1HA      GLY  26   1.948   7.130   6.083
  574    H    GLY  27           H        GLY  27  -1.274   7.226   5.850
  575    HA2  GLY  27           2HA      GLY  27  -2.810   8.192   4.413
  576    HA3  GLY  27           1HA      GLY  27  -1.608   9.408   4.005
  577    H    TRP  28           H        TRP  28  -1.200   5.923   3.759
  578    HA   TRP  28           HA       TRP  28  -0.628   6.280   0.921
  579    HB2  TRP  28           2HB      TRP  28   0.518   4.169   1.015
  580    HB3  TRP  28           1HB      TRP  28   1.034   5.137   2.385
  581    HD1  TRP  28           HD       TRP  28   0.232   4.316   4.833
  582    HE1  TRP  28           1HE      TRP  28  -0.498   1.997   5.678
  583    HE3  TRP  28           3HE      TRP  28  -0.718   2.075   0.333
  584    HZ2  TRP  28           2HZ      TRP  28  -1.365  -0.466   4.569
  585    HZ3  TRP  28           3HZ      TRP  28  -1.497  -0.255   0.316
  586    HH2  TRP  28           HH       TRP  28  -1.814  -1.498   2.389
  587    H    LEU  29           H        LEU  29  -3.015   4.888   3.001
  588    HA   LEU  29           HA       LEU  29  -4.100   3.162   0.939
  589    HB2  LEU  29           2HB      LEU  29  -4.130   2.569   3.381
  590    HB3  LEU  29           1HB      LEU  29  -5.297   3.853   3.623
  591    HG   LEU  29           HG       LEU  29  -6.773   2.631   1.938
  592   HD11  LEU  29          1HD1      LEU  29  -4.954   1.193   1.049
  593   HD12  LEU  29          2HD1      LEU  29  -6.376   0.297   1.582
  594   HD13  LEU  29          3HD1      LEU  29  -4.929   0.340   2.592
  595   HD21  LEU  29          3HD2      LEU  29  -6.104   1.393   4.603
  596   HD22  LEU  29          1HD2      LEU  29  -7.545   1.015   3.658
  597   HD23  LEU  29          2HD2      LEU  29  -7.302   2.648   4.278
  598    H    THR  30           H        THR  30  -4.845   6.235   2.504
  599    HA   THR  30           HA       THR  30  -7.346   6.620   1.249
  600    HB   THR  30           HB       THR  30  -6.441   7.900   3.252
  601    HG1  THR  30           1HG      THR  30  -8.364   8.515   2.126
  602   HG21  THR  30          3HG2      THR  30  -5.063   9.455   1.065
  603   HG22  THR  30          1HG2      THR  30  -4.298   8.600   2.405
  604   HG23  THR  30          2HG2      THR  30  -5.278  10.032   2.718
  605    H    ARG  31           H        ARG  31  -4.079   7.048   0.152
  606    HA   ARG  31           HA       ARG  31  -4.909   8.535  -2.206
  607    HB2  ARG  31           2HB      ARG  31  -2.178   7.542  -1.347
  608    HB3  ARG  31           1HB      ARG  31  -2.488   8.515  -2.781
  609    HG2  ARG  31           2HG      ARG  31  -3.683   9.938  -0.721
  610    HG3  ARG  31           1HG      ARG  31  -2.182   9.329  -0.022
  611    HD2  ARG  31           2HD      ARG  31  -2.228  10.665  -2.706
  612    HD3  ARG  31           1HD      ARG  31  -2.147  11.605  -1.220
  613    HE   ARG  31           HE       ARG  31  -0.156   9.514  -1.552
  614   HH11  ARG  31          1HH1      ARG  31  -0.940  12.913  -1.797
  615   HH12  ARG  31          2HH1      ARG  31   0.714  13.430  -1.774
  616   HH21  ARG  31          1HH2      ARG  31   2.031  10.192  -1.521
  617   HH22  ARG  31          2HH2      ARG  31   2.402  11.887  -1.616
  618    H    LEU  32           H        LEU  32  -4.480   5.342  -1.176
  619    HA   LEU  32           HA       LEU  32  -3.806   4.105  -3.641
  620    HB2  LEU  32           2HB      LEU  32  -3.606   3.147  -1.277
  621    HB3  LEU  32           1HB      LEU  32  -5.329   2.837  -1.367
  622    HG   LEU  32           HG       LEU  32  -4.470   1.636  -3.655
  623   HD11  LEU  32          1HD1      LEU  32  -2.132   2.075  -3.140
  624   HD12  LEU  32          2HD1      LEU  32  -2.477   0.345  -3.105
  625   HD13  LEU  32          3HD1      LEU  32  -2.308   1.242  -1.595
  626   HD21  LEU  32          3HD2      LEU  32  -4.724  -0.462  -2.440
  627   HD22  LEU  32          1HD2      LEU  32  -5.976   0.689  -1.979
  628   HD23  LEU  32          2HD2      LEU  32  -4.604   0.402  -0.907
  629    H    LEU  33           H        LEU  33  -6.817   4.849  -1.981
  630    HA   LEU  33           HA       LEU  33  -8.549   3.528  -3.807
  631    HB2  LEU  33           2HB      LEU  33  -9.102   5.799  -1.895
  632    HB3  LEU  33           1HB      LEU  33 -10.326   4.855  -2.719
  633    HG   LEU  33           HG       LEU  33  -8.343   3.704  -0.759
  634   HD11  LEU  33          1HD1      LEU  33 -10.254   3.604   0.794
  635   HD12  LEU  33          2HD1      LEU  33 -11.214   4.533  -0.358
  636   HD13  LEU  33          3HD1      LEU  33  -9.790   5.257   0.390
  637   HD21  LEU  33          3HD2      LEU  33  -9.171   2.071  -2.351
  638   HD22  LEU  33          1HD2      LEU  33 -10.833   2.562  -2.020
  639   HD23  LEU  33          2HD2      LEU  33  -9.877   1.785  -0.759
  640    H    GLN  34           H        GLN  34  -6.789   6.413  -4.089
  641    HA   GLN  34           HA       GLN  34  -8.700   7.622  -5.922
  642    HB2  GLN  34           2HB      GLN  34  -5.932   8.633  -5.276
  643    HB3  GLN  34           1HB      GLN  34  -7.273   9.534  -5.969
  644    HG2  GLN  34           2HG      GLN  34  -7.065   8.477  -3.158
  645    HG3  GLN  34           1HG      GLN  34  -6.975  10.161  -3.669
  646   HE21  GLN  34          1HE2      GLN  34  -8.794   8.745  -1.819
  647   HE22  GLN  34          2HE2      GLN  34 -10.397   9.083  -2.390
  648    H    THR  35           H        THR  35  -5.856   5.668  -5.976
  649    HA   THR  35           HA       THR  35  -5.483   6.180  -8.834
  650    HB   THR  35           HB       THR  35  -3.417   4.666  -8.429
  651    HG1  THR  35           1HG      THR  35  -3.653   5.628  -5.779
  652   HG21  THR  35          3HG2      THR  35  -3.556   7.400  -7.155
  653   HG22  THR  35          1HG2      THR  35  -3.393   7.102  -8.887
  654   HG23  THR  35          2HG2      THR  35  -2.115   6.601  -7.781
  655    H    LYS  36           H        LYS  36  -6.115   3.530  -6.555
  656    HA   LYS  36           HA       LYS  36  -6.524   1.724  -8.836
  657    HB2  LYS  36           2HB      LYS  36  -6.189   1.160  -5.884
  658    HB3  LYS  36           1HB      LYS  36  -6.580  -0.070  -7.078
  659    HG2  LYS  36           2HG      LYS  36  -4.385  -0.367  -7.285
  660    HG3  LYS  36           1HG      LYS  36  -4.358   1.177  -8.143
  661    HD2  LYS  36           2HD      LYS  36  -4.165   2.229  -5.804
  662    HD3  LYS  36           1HD      LYS  36  -3.736   0.604  -5.267
  663    HE2  LYS  36           2HE      LYS  36  -1.694   1.699  -5.691
  664    HE3  LYS  36           1HE      LYS  36  -1.959   0.625  -7.064
  665    HZ1  LYS  36           3HZ      LYS  36  -2.597   2.425  -8.415
  666    HZ2  LYS  36           1HZ      LYS  36  -1.204   2.948  -7.609
  667    HZ3  LYS  36           2HZ      LYS  36  -2.727   3.485  -7.105
  668    H    ASN  37           H        ASN  37  -8.357   3.875  -7.754
  669    HA   ASN  37           HA       ASN  37 -10.583   4.243  -7.653
  670    HB2  ASN  37           2HB      ASN  37 -10.452   2.271  -9.436
  671    HB3  ASN  37           1HB      ASN  37 -11.292   1.390  -8.163
  672   HD21  ASN  37          1HD2      ASN  37 -11.496   3.908 -10.519
  673   HD22  ASN  37          2HD2      ASN  37 -13.189   4.220 -10.342
  674    H    TYR  38           H        TYR  38 -12.698   3.185  -6.604
  675    HA   TYR  38           HA       TYR  38 -11.938   2.674  -3.824
  676    HB2  TYR  38           2HB      TYR  38 -14.439   3.681  -5.162
  677    HB3  TYR  38           1HB      TYR  38 -14.468   3.117  -3.497
  678    HD1  TYR  38           2HD      TYR  38 -13.038   5.661  -5.770
  679    HD2  TYR  38           1HD      TYR  38 -13.653   4.478  -1.731
  680    HE1  TYR  38           2HE      TYR  38 -12.318   7.887  -5.011
  681    HE2  TYR  38           1HE      TYR  38 -12.941   6.701  -0.963
  682    HH   TYR  38           HH       TYR  38 -12.693   9.351  -2.985
  683    H    ASP  39           H        ASP  39 -11.826   0.551  -5.844
  684    HA   ASP  39           HA       ASP  39 -14.108  -1.137  -5.243
  685    HB2  ASP  39           2HB      ASP  39 -13.038  -1.073  -7.526
  686    HB3  ASP  39           1HB      ASP  39 -11.649  -1.897  -6.820
  687    H    ILE  40           H        ILE  40 -14.161  -2.132  -3.394
  688    HA   ILE  40           HA       ILE  40 -12.010  -2.552  -1.654
  689    HB   ILE  40           HB       ILE  40 -14.570  -4.152  -1.691
  690   HG12  ILE  40          2HG1      ILE  40 -14.123  -1.563  -0.209
  691   HG13  ILE  40          1HG1      ILE  40 -14.863  -1.617  -1.804
  692   HG21  ILE  40          1HG2      ILE  40 -12.833  -4.971  -0.175
  693   HG22  ILE  40          2HG2      ILE  40 -14.220  -4.334   0.706
  694   HG23  ILE  40          3HG2      ILE  40 -12.744  -3.378   0.583
  695   HD11  ILE  40          3HD1      ILE  40 -15.917  -3.024   0.638
  696   HD12  ILE  40          1HD1      ILE  40 -16.678  -2.966  -0.952
  697   HD13  ILE  40          2HD1      ILE  40 -16.515  -1.490   0.002
  698    H    GLY  41           H        GLY  41 -13.574  -4.738  -3.966
  699    HA2  GLY  41           2HA      GLY  41 -12.297  -7.119  -3.273
  700    HA3  GLY  41           1HA      GLY  41 -12.892  -6.732  -4.882
  701    H    ALA  42           H        ALA  42 -11.354  -4.849  -5.855
  702    HA   ALA  42           HA       ALA  42  -8.964  -6.153  -6.538
  703    HB1  ALA  42           1HB      ALA  42  -8.387  -4.148  -7.742
  704    HB2  ALA  42           2HB      ALA  42  -9.573  -3.216  -6.826
  705    HB3  ALA  42           3HB      ALA  42 -10.108  -4.473  -7.943
  706    H    ALA  43           H        ALA  43  -9.560  -3.471  -4.280
  707    HA   ALA  43           HA       ALA  43  -6.904  -2.876  -3.642
  708    HB1  ALA  43           1HB      ALA  43  -9.325  -2.640  -1.861
  709    HB2  ALA  43           2HB      ALA  43  -8.803  -1.450  -3.051
  710    HB3  ALA  43           3HB      ALA  43  -7.790  -1.794  -1.651
  711    H    LEU  44           H        LEU  44  -9.135  -5.171  -2.090
  712    HA   LEU  44           HA       LEU  44  -7.396  -5.933  -0.003
  713    HB2  LEU  44           2HB      LEU  44  -9.881  -6.331  -0.144
  714    HB3  LEU  44           1HB      LEU  44  -9.547  -7.627  -1.273
  715    HG   LEU  44           HG       LEU  44  -8.233  -8.780   0.487
  716   HD11  LEU  44          1HD1      LEU  44  -9.251  -6.530   2.209
  717   HD12  LEU  44          2HD1      LEU  44  -7.570  -6.916   1.841
  718   HD13  LEU  44          3HD1      LEU  44  -8.531  -8.017   2.824
  719   HD21  LEU  44          3HD2      LEU  44 -10.522  -9.430   0.123
  720   HD22  LEU  44          1HD2      LEU  44 -11.097  -8.114   1.147
  721   HD23  LEU  44          2HD2      LEU  44 -10.183  -9.447   1.854
  722    H    ASP  45           H        ASP  45  -7.858  -7.143  -3.276
  723    HA   ASP  45           HA       ASP  45  -6.165  -9.424  -2.970
  724    HB2  ASP  45           2HB      ASP  45  -8.009  -9.072  -4.708
  725    HB3  ASP  45           1HB      ASP  45  -6.849  -8.077  -5.578
  726    H    THR  46           H        THR  46  -5.625  -6.091  -3.650
  727    HA   THR  46           HA       THR  46  -3.225  -6.220  -5.080
  728    HB   THR  46           HB       THR  46  -4.089  -4.076  -3.130
  729    HG1  THR  46           1HG      THR  46  -5.491  -4.721  -5.060
  730   HG21  THR  46          3HG2      THR  46  -2.652  -2.592  -4.407
  731   HG22  THR  46          1HG2      THR  46  -2.202  -3.910  -5.484
  732   HG23  THR  46          2HG2      THR  46  -1.709  -3.952  -3.790
  733    H    ILE  47           H        ILE  47  -3.843  -6.495  -1.622
  734    HA   ILE  47           HA       ILE  47  -0.945  -6.593  -1.154
  735    HB   ILE  47           HB       ILE  47  -1.561  -6.437   1.284
  736   HG12  ILE  47          2HG1      ILE  47  -4.263  -5.627   0.174
  737   HG13  ILE  47          1HG1      ILE  47  -3.938  -7.157   0.986
  738   HG21  ILE  47          1HG2      ILE  47  -2.412  -4.133  -0.462
  739   HG22  ILE  47          2HG2      ILE  47  -0.744  -4.549  -0.071
  740   HG23  ILE  47          3HG2      ILE  47  -1.849  -4.039   1.206
  741   HD11  ILE  47          3HD1      ILE  47  -4.989  -5.562   2.484
  742   HD12  ILE  47          1HD1      ILE  47  -3.672  -4.421   2.210
  743   HD13  ILE  47          2HD1      ILE  47  -3.356  -5.953   3.024
  744    H    GLN  48           H        GLN  48  -3.319  -8.704  -1.827
  745    HA   GLN  48           HA       GLN  48  -3.583 -10.954  -1.618
  746    HB2  GLN  48           2HB      GLN  48  -0.822 -10.504  -1.575
  747    HB3  GLN  48           1HB      GLN  48  -1.123 -11.642  -0.273
  748    HG2  GLN  48           2HG      GLN  48  -2.215 -12.076  -3.022
  749    HG3  GLN  48           1HG      GLN  48  -0.585 -12.565  -2.592
  750   HE21  GLN  48          1HE2      GLN  48  -3.969 -13.158  -2.151
  751   HE22  GLN  48          2HE2      GLN  48  -3.804 -14.687  -1.361
  752    H    TYR  49           H        TYR  49  -4.069  -9.088   0.762
  753    HA   TYR  49           HA       TYR  49  -3.865 -11.015   2.955
  754    HB2  TYR  49           2HB      TYR  49  -4.368  -8.070   2.800
  755    HB3  TYR  49           1HB      TYR  49  -4.980  -8.957   4.189
  756    HD1  TYR  49           2HD      TYR  49  -1.780  -9.325   2.292
  757    HD2  TYR  49           1HD      TYR  49  -3.645  -8.367   5.995
  758    HE1  TYR  49           2HE      TYR  49   0.433  -9.147   3.355
  759    HE2  TYR  49           1HE      TYR  49  -1.437  -8.184   7.063
  760    HH   TYR  49           HH       TYR  49   1.431  -7.988   5.310
  761    H    SER  50           H        SER  50  -5.660 -11.238   0.618
  762    HA   SER  50           HA       SER  50  -8.328 -10.710   1.349
  763    HB2  SER  50           2HB      SER  50  -8.171 -12.959  -0.404
  764    HB3  SER  50           1HB      SER  50  -8.571 -11.287  -0.803
  765    HG   SER  50           HG       SER  50  -6.691 -12.135  -1.923
  766    H    LYS  51           H        LYS  51  -6.149 -13.300   2.113
  767    HA   LYS  51           HA       LYS  51  -8.232 -15.097   2.974
  768    HB2  LYS  51           2HB      LYS  51  -5.230 -15.246   3.281
  769    HB3  LYS  51           1HB      LYS  51  -6.350 -16.521   3.745
  770    HG2  LYS  51           2HG      LYS  51  -6.597 -15.545   0.981
  771    HG3  LYS  51           1HG      LYS  51  -5.103 -16.403   1.363
  772    HD2  LYS  51           2HD      LYS  51  -6.827 -17.925   0.502
  773    HD3  LYS  51           1HD      LYS  51  -6.396 -18.312   2.164
  774    HE2  LYS  51           2HE      LYS  51  -8.396 -17.314   2.999
  775    HE3  LYS  51           1HE      LYS  51  -8.764 -16.618   1.427
  776    HZ1  LYS  51           3HZ      LYS  51  -8.724 -19.519   2.040
  777    HZ2  LYS  51           1HZ      LYS  51  -9.114 -18.827   0.550
  778    HZ3  LYS  51           2HZ      LYS  51 -10.114 -18.570   1.887
  779    H    HIS  52           H        HIS  52  -5.684 -13.196   4.568
  780    HA   HIS  52           HA       HIS  52  -7.333 -12.634   6.802
  781    HB2  HIS  52           2HB      HIS  52  -6.608 -15.054   7.215
  782    HB3  HIS  52           1HB      HIS  52  -4.987 -14.407   7.456
  783    HD1  HIS  52           1HD      HIS  52  -4.456 -13.497   9.716
  784    HD2  HIS  52           2HD      HIS  52  -8.535 -14.039   9.149
  785    HE1  HIS  52           1HE      HIS  52  -5.511 -13.031  11.946
  786    HE2  HIS  52           2HE      HIS  52  -7.969 -13.494  11.615
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1  18.775  20.176  -1.772
    2    H2   GLY   1           2HT      GLY   1  17.421  19.177  -1.907
    3    H3   GLY   1           3HT      GLY   1  17.734  20.339  -3.093
    4    HA2  GLY   1           1HA      GLY   1  18.336  18.156  -3.894
    5    HA3  GLY   1           2HA      GLY   1  19.750  19.189  -3.740
    6    H    SER   2           H        SER   2  20.518  16.771  -3.830
    7    HA   SER   2           HA       SER   2  20.456  15.470  -1.239
    8    HB2  SER   2           2HB      SER   2  22.303  14.306  -3.140
    9    HB3  SER   2           1HB      SER   2  20.836  13.609  -2.449
   10    HG   SER   2           HG       SER   2  20.426  13.752  -4.593
   11    HA   PRO   3           HA       PRO   3  24.329  17.617  -0.346
   12    HB2  PRO   3           2HB      PRO   3  24.082  17.642   2.316
   13    HB3  PRO   3           1HB      PRO   3  23.079  18.684   1.299
   14    HG2  PRO   3           2HG      PRO   3  22.376  16.150   2.697
   15    HG3  PRO   3           1HG      PRO   3  21.382  17.585   2.405
   16    HD2  PRO   3           2HD      PRO   3  21.347  15.206   0.911
   17    HD3  PRO   3           1HD      PRO   3  20.613  16.751   0.445
   18    HA   PRO   4           HA       PRO   4  27.122  14.249   0.456
   19    HB2  PRO   4           2HB      PRO   4  28.688  16.090   2.165
   20    HB3  PRO   4           1HB      PRO   4  29.177  15.215   0.709
   21    HG2  PRO   4           2HG      PRO   4  28.764  17.857   0.664
   22    HG3  PRO   4           1HG      PRO   4  28.320  16.828  -0.708
   23    HD2  PRO   4           2HD      PRO   4  26.577  18.026   1.404
   24    HD3  PRO   4           1HD      PRO   4  26.274  17.834  -0.335
   25    H    GLU   5           H        GLU   5  25.597  15.981   2.990
   26    HA   GLU   5           HA       GLU   5  26.596  14.442   5.173
   27    HB2  GLU   5           2HB      GLU   5  24.148  16.192   4.941
   28    HB3  GLU   5           1HB      GLU   5  24.749  15.506   6.445
   29    HG2  GLU   5           2HG      GLU   5  26.007  17.603   4.713
   30    HG3  GLU   5           1HG      GLU   5  25.523  17.711   6.405
   31    H    ALA   6           H        ALA   6  24.246  13.909   2.767
   32    HA   ALA   6           HA       ALA   6  22.618  12.094   4.300
   33    HB1  ALA   6           1HB      ALA   6  22.690  12.616   1.330
   34    HB2  ALA   6           2HB      ALA   6  21.616  13.385   2.495
   35    HB3  ALA   6           3HB      ALA   6  21.476  11.657   2.179
   36    H    ASP   7           H        ASP   7  22.602   9.882   4.178
   37    HA   ASP   7           HA       ASP   7  25.109   8.630   3.606
   38    HB2  ASP   7           2HB      ASP   7  23.426   8.007   5.450
   39    HB3  ASP   7           1HB      ASP   7  22.535   7.173   4.184
   40    HA   PRO   8           HA       PRO   8  24.235   7.888  -0.712
   41    HB2  PRO   8           2HB      PRO   8  26.339   6.176  -1.127
   42    HB3  PRO   8           1HB      PRO   8  26.473   7.937  -1.140
   43    HG2  PRO   8           2HG      PRO   8  27.112   6.006   1.050
   44    HG3  PRO   8           1HG      PRO   8  27.996   7.454   0.538
   45    HD2  PRO   8           2HD      PRO   8  26.415   7.445   2.715
   46    HD3  PRO   8           1HD      PRO   8  26.576   8.879   1.678
   47    H    ARG   9           H        ARG   9  24.461   5.467   1.771
   48    HA   ARG   9           HA       ARG   9  23.485   3.362   0.002
   49    HB2  ARG   9           2HB      ARG   9  23.969   3.275   2.988
   50    HB3  ARG   9           1HB      ARG   9  23.701   1.898   1.927
   51    HG2  ARG   9           2HG      ARG   9  25.801   2.056   0.970
   52    HG3  ARG   9           1HG      ARG   9  26.004   3.743   1.447
   53    HD2  ARG   9           2HD      ARG   9  25.944   1.387   3.332
   54    HD3  ARG   9           1HD      ARG   9  27.402   2.212   2.779
   55    HE   ARG   9           HE       ARG   9  25.574   4.062   3.952
   56   HH11  ARG   9          1HH1      ARG   9  27.846   1.530   4.783
   57   HH12  ARG   9          2HH1      ARG   9  28.230   2.196   6.335
   58   HH21  ARG   9          1HH2      ARG   9  26.068   4.953   6.005
   59   HH22  ARG   9          2HH2      ARG   9  27.228   4.146   7.025
   60    H    LEU  10           H        LEU  10  22.352   5.530   2.490
   61    HA   LEU  10           HA       LEU  10  19.876   4.244   2.996
   62    HB2  LEU  10           2HB      LEU  10  20.879   5.891   4.523
   63    HB3  LEU  10           1HB      LEU  10  20.624   7.148   3.327
   64    HG   LEU  10           HG       LEU  10  18.153   6.688   3.506
   65   HD11  LEU  10          1HD1      LEU  10  17.364   5.510   5.497
   66   HD12  LEU  10          2HD1      LEU  10  19.028   5.085   5.906
   67   HD13  LEU  10          3HD1      LEU  10  18.288   4.441   4.441
   68   HD21  LEU  10          3HD2      LEU  10  19.698   7.656   5.904
   69   HD22  LEU  10          1HD2      LEU  10  17.952   7.835   5.727
   70   HD23  LEU  10          2HD2      LEU  10  19.037   8.617   4.579
   71    H    ILE  11           H        ILE  11  20.885   6.752   0.725
   72    HA   ILE  11           HA       ILE  11  18.255   7.265  -0.241
   73    HB   ILE  11           HB       ILE  11  20.137   8.882  -0.449
   74   HG12  ILE  11          2HG1      ILE  11  19.004   8.146  -3.155
   75   HG13  ILE  11          1HG1      ILE  11  18.074   8.964  -1.903
   76   HG21  ILE  11          1HG2      ILE  11  21.757   8.595  -2.275
   77   HG22  ILE  11          2HG2      ILE  11  21.129   6.972  -2.560
   78   HG23  ILE  11          3HG2      ILE  11  21.919   7.357  -1.029
   79   HD11  ILE  11          3HD1      ILE  11  19.512  10.868  -1.995
   80   HD12  ILE  11          1HD1      ILE  11  19.001  10.469  -3.633
   81   HD13  ILE  11          2HD1      ILE  11  20.620  10.036  -3.087
   82    H    GLU  12           H        GLU  12  20.582   4.812  -0.822
   83    HA   GLU  12           HA       GLU  12  19.739   4.075  -3.440
   84    HB2  GLU  12           2HB      GLU  12  21.549   2.979  -1.375
   85    HB3  GLU  12           1HB      GLU  12  20.885   1.820  -2.519
   86    HG2  GLU  12           2HG      GLU  12  22.478   4.287  -3.172
   87    HG3  GLU  12           1HG      GLU  12  23.013   2.612  -3.299
   88    H    SER  13           H        SER  13  18.363   3.662  -0.368
   89    HA   SER  13           HA       SER  13  17.111   1.151  -0.704
   90    HB2  SER  13           2HB      SER  13  15.908   3.404   0.887
   91    HB3  SER  13           1HB      SER  13  15.879   1.670   1.224
   92    HG   SER  13           HG       SER  13  17.821   3.564   1.780
   93    H    LEU  14           H        LEU  14  16.263   4.411  -1.698
   94    HA   LEU  14           HA       LEU  14  13.577   3.774  -2.463
   95    HB2  LEU  14           2HB      LEU  14  15.338   6.098  -3.262
   96    HB3  LEU  14           1HB      LEU  14  13.620   5.974  -3.585
   97    HG   LEU  14           HG       LEU  14  13.925   5.604  -0.804
   98   HD11  LEU  14          1HD1      LEU  14  15.091   7.592  -0.093
   99   HD12  LEU  14          2HD1      LEU  14  15.426   8.035  -1.767
  100   HD13  LEU  14          3HD1      LEU  14  16.173   6.597  -1.069
  101   HD21  LEU  14          3HD2      LEU  14  12.954   7.934  -2.449
  102   HD22  LEU  14          1HD2      LEU  14  12.691   7.752  -0.714
  103   HD23  LEU  14          2HD2      LEU  14  11.991   6.589  -1.841
  104    H    SER  15           H        SER  15  16.665   4.152  -4.170
  105    HA   SER  15           HA       SER  15  15.632   3.660  -6.755
  106    HB2  SER  15           2HB      SER  15  18.297   2.834  -6.776
  107    HB3  SER  15           1HB      SER  15  17.701   4.451  -7.150
  108    HG   SER  15           HG       SER  15  19.369   4.094  -5.375
  109    H    GLN  16           H        GLN  16  16.680   1.606  -4.142
  110    HA   GLN  16           HA       GLN  16  17.075  -0.802  -5.494
  111    HB2  GLN  16           2HB      GLN  16  17.688  -0.511  -3.154
  112    HB3  GLN  16           1HB      GLN  16  15.997  -0.304  -2.713
  113    HG2  GLN  16           2HG      GLN  16  16.798  -2.519  -2.139
  114    HG3  GLN  16           1HG      GLN  16  15.527  -2.597  -3.358
  115   HE21  GLN  16          1HE2      GLN  16  16.038  -3.257  -5.445
  116   HE22  GLN  16          2HE2      GLN  16  17.543  -4.018  -5.829
  117    H    MET  17           H        MET  17  14.118   0.532  -4.034
  118    HA   MET  17           HA       MET  17  12.447  -1.633  -4.744
  119    HB2  MET  17           2HB      MET  17  11.707   1.264  -4.273
  120    HB3  MET  17           1HB      MET  17  10.580  -0.088  -4.304
  121    HG2  MET  17           2HG      MET  17  12.806   0.339  -2.315
  122    HG3  MET  17           1HG      MET  17  11.082   0.573  -2.024
  123    HE1  MET  17           3HE      MET  17   9.359  -1.328  -1.642
  124    HE2  MET  17           1HE      MET  17   9.659  -3.023  -2.023
  125    HE3  MET  17           2HE      MET  17   9.626  -1.822  -3.314
  126    H    LEU  18           H        LEU  18  13.209   1.423  -6.313
  127    HA   LEU  18           HA       LEU  18  11.469   1.238  -8.495
  128    HB2  LEU  18           2HB      LEU  18  12.624   3.289  -7.895
  129    HB3  LEU  18           1HB      LEU  18  14.177   2.558  -8.256
  130    HG   LEU  18           HG       LEU  18  12.992   2.274 -10.655
  131   HD11  LEU  18          1HD1      LEU  18  11.826   4.805  -9.502
  132   HD12  LEU  18          2HD1      LEU  18  10.923   3.356  -9.939
  133   HD13  LEU  18          3HD1      LEU  18  11.740   4.294 -11.189
  134   HD21  LEU  18          3HD2      LEU  18  15.150   3.273 -10.309
  135   HD22  LEU  18          1HD2      LEU  18  14.415   4.711  -9.602
  136   HD23  LEU  18          2HD2      LEU  18  14.170   4.346 -11.310
  137    H    SER  19           H        SER  19  14.764   0.014  -8.038
  138    HA   SER  19           HA       SER  19  15.022  -0.957 -10.716
  139    HB2  SER  19           2HB      SER  19  16.616  -1.753  -8.264
  140    HB3  SER  19           1HB      SER  19  17.092  -1.976  -9.949
  141    HG   SER  19           HG       SER  19  16.764   0.474  -8.543
  142    H    MET  20           H        MET  20  13.741  -2.217  -7.749
  143    HA   MET  20           HA       MET  20  13.763  -4.979  -8.518
  144    HB2  MET  20           2HB      MET  20  13.738  -4.161  -6.149
  145    HB3  MET  20           1HB      MET  20  12.084  -3.624  -6.392
  146    HG2  MET  20           2HG      MET  20  11.430  -5.940  -6.884
  147    HG3  MET  20           1HG      MET  20  13.080  -6.459  -6.546
  148    HE1  MET  20           3HE      MET  20  13.801  -4.524  -4.008
  149    HE2  MET  20           1HE      MET  20  14.242  -6.223  -4.187
  150    HE3  MET  20           2HE      MET  20  13.424  -5.672  -2.724
  151    H    GLY  21           H        GLY  21  11.881  -2.290  -9.325
  152    HA2  GLY  21           2HA      GLY  21  10.288  -2.302 -11.067
  153    HA3  GLY  21           1HA      GLY  21  10.000  -4.011 -10.757
  154    H    PHE  22           H        PHE  22  10.044  -1.385  -8.397
  155    HA   PHE  22           HA       PHE  22   7.134  -1.605  -8.164
  156    HB2  PHE  22           2HB      PHE  22   8.531  -2.995  -6.400
  157    HB3  PHE  22           1HB      PHE  22   8.763  -1.416  -5.657
  158    HD1  PHE  22           1HD      PHE  22   5.950  -3.380  -7.141
  159    HD2  PHE  22           2HD      PHE  22   7.315  -0.877  -3.978
  160    HE1  PHE  22           1HE      PHE  22   3.757  -3.579  -6.041
  161    HE2  PHE  22           2HE      PHE  22   5.128  -1.076  -2.876
  162    HZ   PHE  22           HZ       PHE  22   3.341  -2.424  -3.904
  163    H    SER  23           H        SER  23   6.263   0.302  -8.215
  164    HA   SER  23           HA       SER  23   7.562   2.597  -7.008
  165    HB2  SER  23           2HB      SER  23   6.615   2.759  -9.884
  166    HB3  SER  23           1HB      SER  23   7.553   3.948  -8.980
  167    HG   SER  23           HG       SER  23   8.385   1.467 -10.039
  168    H    ASP  24           H        ASP  24   5.974   4.546  -7.229
  169    HA   ASP  24           HA       ASP  24   3.253   3.469  -6.966
  170    HB2  ASP  24           2HB      ASP  24   2.807   5.395  -5.421
  171    HB3  ASP  24           1HB      ASP  24   3.925   4.197  -4.793
  172    H    GLU  25           H        GLU  25   1.524   4.952  -7.474
  173    HA   GLU  25           HA       GLU  25   2.248   6.689  -9.742
  174    HB2  GLU  25           2HB      GLU  25  -0.545   6.136  -9.732
  175    HB3  GLU  25           1HB      GLU  25   0.659   5.611 -10.896
  176    HG2  GLU  25           2HG      GLU  25  -0.393   3.650 -10.193
  177    HG3  GLU  25           1HG      GLU  25   1.138   3.681  -9.320
  178    H    GLY  26           H        GLY  26   0.028   6.323  -7.007
  179    HA2  GLY  26           2HA      GLY  26  -0.707   9.145  -7.145
  180    HA3  GLY  26           1HA      GLY  26  -1.367   7.941  -6.048
  181    H    GLY  27           H        GLY  27   1.905   7.596  -6.004
  182    HA2  GLY  27           2HA      GLY  27   3.604   8.350  -4.648
  183    HA3  GLY  27           1HA      GLY  27   2.626   9.761  -4.274
  184    H    TRP  28           H        TRP  28   1.889   6.326  -3.768
  185    HA   TRP  28           HA       TRP  28   1.377   6.960  -0.967
  186    HB2  TRP  28           2HB      TRP  28   0.168   4.833  -0.876
  187    HB3  TRP  28           1HB      TRP  28  -0.421   5.839  -2.184
  188    HD1  TRP  28           HD       TRP  28  -0.104   4.958  -4.653
  189    HE1  TRP  28           1HE      TRP  28   0.471   2.647  -5.614
  190    HE3  TRP  28           3HE      TRP  28   1.629   2.730  -0.397
  191    HZ2  TRP  28           2HZ      TRP  28   1.512   0.182  -4.679
  192    HZ3  TRP  28           3HZ      TRP  28   2.389   0.395  -0.511
  193    HH2  TRP  28           HH       TRP  28   2.335  -0.850  -2.607
  194    H    LEU  29           H        LEU  29   3.562   5.148  -2.975
  195    HA   LEU  29           HA       LEU  29   4.601   3.493  -0.886
  196    HB2  LEU  29           2HB      LEU  29   4.763   2.903  -3.287
  197    HB3  LEU  29           1HB      LEU  29   5.849   4.255  -3.534
  198    HG   LEU  29           HG       LEU  29   7.443   3.175  -1.928
  199   HD11  LEU  29          1HD1      LEU  29   5.964   1.760  -0.692
  200   HD12  LEU  29          2HD1      LEU  29   7.119   0.737  -1.550
  201   HD13  LEU  29          3HD1      LEU  29   5.471   0.913  -2.159
  202   HD21  LEU  29          3HD2      LEU  29   6.696   1.576  -4.375
  203   HD22  LEU  29          1HD2      LEU  29   8.245   1.520  -3.533
  204   HD23  LEU  29          2HD2      LEU  29   7.736   3.000  -4.344
  205    H    THR  30           H        THR  30   5.440   6.596  -2.309
  206    HA   THR  30           HA       THR  30   7.902   6.968  -1.011
  207    HB   THR  30           HB       THR  30   6.978   8.351  -2.916
  208    HG1  THR  30           1HG      THR  30   8.183   9.467  -0.618
  209   HG21  THR  30          3HG2      THR  30   5.506   9.749  -0.682
  210   HG22  THR  30          1HG2      THR  30   4.770   8.833  -2.001
  211   HG23  THR  30          2HG2      THR  30   5.642  10.326  -2.342
  212    H    ARG  31           H        ARG  31   4.657   7.148   0.148
  213    HA   ARG  31           HA       ARG  31   5.388   8.605   2.563
  214    HB2  ARG  31           2HB      ARG  31   2.762   7.444   1.605
  215    HB3  ARG  31           1HB      ARG  31   2.963   8.284   3.136
  216    HG2  ARG  31           2HG      ARG  31   3.674   9.586   0.531
  217    HG3  ARG  31           1HG      ARG  31   2.028   9.603   1.162
  218    HD2  ARG  31           2HD      ARG  31   4.405  10.548   2.749
  219    HD3  ARG  31           1HD      ARG  31   3.458  11.615   1.714
  220    HE   ARG  31           HE       ARG  31   1.740  10.240   3.482
  221   HH11  ARG  31          1HH1      ARG  31   4.153  12.775   3.481
  222   HH12  ARG  31          2HH1      ARG  31   3.467  13.602   4.840
  223   HH21  ARG  31          1HH2      ARG  31   0.840  11.308   5.279
  224   HH22  ARG  31          2HH2      ARG  31   1.594  12.749   5.889
  225    H    LEU  32           H        LEU  32   4.718   5.390   1.441
  226    HA   LEU  32           HA       LEU  32   4.300   4.095   3.895
  227    HB2  LEU  32           2HB      LEU  32   3.894   3.191   1.567
  228    HB3  LEU  32           1HB      LEU  32   5.621   2.906   1.462
  229    HG   LEU  32           HG       LEU  32   5.119   1.596   3.749
  230   HD11  LEU  32          1HD1      LEU  32   2.589   1.318   2.137
  231   HD12  LEU  32          2HD1      LEU  32   2.733   2.116   3.706
  232   HD13  LEU  32          3HD1      LEU  32   3.023   0.381   3.566
  233   HD21  LEU  32          3HD2      LEU  32   5.040  -0.459   2.405
  234   HD22  LEU  32          1HD2      LEU  32   6.255   0.672   1.809
  235   HD23  LEU  32          2HD2      LEU  32   4.717   0.507   0.963
  236    H    LEU  33           H        LEU  33   7.245   4.717   2.039
  237    HA   LEU  33           HA       LEU  33   9.014   3.301   3.736
  238    HB2  LEU  33           2HB      LEU  33   9.520   5.585   1.834
  239    HB3  LEU  33           1HB      LEU  33  10.780   4.632   2.597
  240    HG   LEU  33           HG       LEU  33   8.683   3.472   0.764
  241   HD11  LEU  33          1HD1      LEU  33  10.428   3.464  -0.949
  242   HD12  LEU  33          2HD1      LEU  33  11.504   4.336   0.145
  243   HD13  LEU  33          3HD1      LEU  33  10.026   5.104  -0.436
  244   HD21  LEU  33          3HD2      LEU  33   9.717   1.883   2.320
  245   HD22  LEU  33          1HD2      LEU  33  11.315   2.378   1.763
  246   HD23  LEU  33          2HD2      LEU  33  10.204   1.571   0.654
  247    H    GLN  34           H        GLN  34   7.290   6.082   4.348
  248    HA   GLN  34           HA       GLN  34   9.359   7.306   5.998
  249    HB2  GLN  34           2HB      GLN  34   6.533   8.199   5.401
  250    HB3  GLN  34           1HB      GLN  34   7.707   9.108   6.343
  251    HG2  GLN  34           2HG      GLN  34   7.875   8.409   3.421
  252    HG3  GLN  34           1HG      GLN  34   7.620  10.004   4.126
  253   HE21  GLN  34          1HE2      GLN  34   9.719   8.872   2.351
  254   HE22  GLN  34          2HE2      GLN  34  11.221   9.227   3.137
  255    H    THR  35           H        THR  35   6.188   5.730   6.350
  256    HA   THR  35           HA       THR  35   6.497   5.898   9.255
  257    HB   THR  35           HB       THR  35   4.151   4.873   9.242
  258    HG1  THR  35           1HG      THR  35   3.007   5.113   7.304
  259   HG21  THR  35          3HG2      THR  35   4.585   7.608   8.039
  260   HG22  THR  35          1HG2      THR  35   4.600   7.218   9.759
  261   HG23  THR  35          2HG2      THR  35   3.110   7.053   8.830
  262    H    LYS  36           H        LYS  36   7.302   3.795   6.833
  263    HA   LYS  36           HA       LYS  36   7.250   1.526   8.713
  264    HB2  LYS  36           2HB      LYS  36   6.759   1.566   5.745
  265    HB3  LYS  36           1HB      LYS  36   7.332   0.108   6.543
  266    HG2  LYS  36           2HG      LYS  36   5.051  -0.216   6.530
  267    HG3  LYS  36           1HG      LYS  36   5.309   0.489   8.129
  268    HD2  LYS  36           2HD      LYS  36   4.892   2.747   6.851
  269    HD3  LYS  36           1HD      LYS  36   4.073   1.694   5.693
  270    HE2  LYS  36           2HE      LYS  36   2.450   2.503   7.256
  271    HE3  LYS  36           1HE      LYS  36   2.715   0.790   7.566
  272    HZ1  LYS  36           3HZ      LYS  36   2.952   2.919   9.357
  273    HZ2  LYS  36           1HZ      LYS  36   4.509   2.282   9.132
  274    HZ3  LYS  36           2HZ      LYS  36   3.250   1.275   9.643
  275    H    ASN  37           H        ASN  37   9.153   3.762   7.565
  276    HA   ASN  37           HA       ASN  37  11.386   4.078   7.449
  277    HB2  ASN  37           2HB      ASN  37  11.279   2.194   9.297
  278    HB3  ASN  37           1HB      ASN  37  11.997   1.206   8.031
  279   HD21  ASN  37          1HD2      ASN  37  13.288   1.719  10.407
  280   HD22  ASN  37          2HD2      ASN  37  14.676   2.703  10.096
  281    H    TYR  38           H        TYR  38  13.392   3.300   6.245
  282    HA   TYR  38           HA       TYR  38  12.569   2.570   3.562
  283    HB2  TYR  38           2HB      TYR  38  15.268   3.387   4.671
  284    HB3  TYR  38           1HB      TYR  38  14.923   3.124   2.966
  285    HD1  TYR  38           2HD      TYR  38  14.354   5.347   5.846
  286    HD2  TYR  38           1HD      TYR  38  13.746   4.778   1.673
  287    HE1  TYR  38           2HE      TYR  38  13.711   7.709   5.625
  288    HE2  TYR  38           1HE      TYR  38  13.104   7.140   1.442
  289    HH   TYR  38           HH       TYR  38  13.565   9.423   3.988
  290    H    ASP  39           H        ASP  39  12.247   0.466   5.344
  291    HA   ASP  39           HA       ASP  39  14.561  -1.274   4.983
  292    HB2  ASP  39           2HB      ASP  39  13.324  -1.112   7.189
  293    HB3  ASP  39           1HB      ASP  39  11.994  -1.965   6.409
  294    H    ILE  40           H        ILE  40  14.701  -2.330   3.177
  295    HA   ILE  40           HA       ILE  40  12.654  -2.702   1.299
  296    HB   ILE  40           HB       ILE  40  15.174  -4.349   1.549
  297   HG12  ILE  40          2HG1      ILE  40  15.016  -1.945  -0.208
  298   HG13  ILE  40          1HG1      ILE  40  15.248  -1.684   1.518
  299   HG21  ILE  40          1HG2      ILE  40  13.562  -5.215  -0.060
  300   HG22  ILE  40          2HG2      ILE  40  14.979  -4.559  -0.882
  301   HG23  ILE  40          3HG2      ILE  40  13.477  -3.636  -0.841
  302   HD11  ILE  40          3HD1      ILE  40  17.003  -3.456  -0.160
  303   HD12  ILE  40          1HD1      ILE  40  17.280  -2.923   1.497
  304   HD13  ILE  40          2HD1      ILE  40  17.341  -1.759   0.175
  305    H    GLY  41           H        GLY  41  14.115  -5.008   3.586
  306    HA2  GLY  41           2HA      GLY  41  12.682  -7.284   2.866
  307    HA3  GLY  41           1HA      GLY  41  13.351  -6.983   4.459
  308    H    ALA  42           H        ALA  42  11.881  -4.874   5.348
  309    HA   ALA  42           HA       ALA  42   9.522  -6.102   6.250
  310    HB1  ALA  42           1HB      ALA  42   8.995  -3.996   7.291
  311    HB2  ALA  42           2HB      ALA  42  10.122  -3.146   6.235
  312    HB3  ALA  42           3HB      ALA  42  10.731  -4.285   7.434
  313    H    ALA  43           H        ALA  43  10.018  -3.609   3.768
  314    HA   ALA  43           HA       ALA  43   7.350  -3.070   3.174
  315    HB1  ALA  43           1HB      ALA  43   9.681  -3.038   1.259
  316    HB2  ALA  43           2HB      ALA  43   9.246  -1.737   2.368
  317    HB3  ALA  43           3HB      ALA  43   8.149  -2.186   1.063
  318    H    LEU  44           H        LEU  44   9.499  -5.537   1.795
  319    HA   LEU  44           HA       LEU  44   7.714  -6.492  -0.158
  320    HB2  LEU  44           2HB      LEU  44  10.207  -7.415   1.098
  321    HB3  LEU  44           1HB      LEU  44   9.192  -8.695   0.466
  322    HG   LEU  44           HG       LEU  44   9.192  -7.519  -1.743
  323   HD11  LEU  44          1HD1      LEU  44  10.889  -5.811  -2.146
  324   HD12  LEU  44          2HD1      LEU  44  11.312  -5.820  -0.435
  325   HD13  LEU  44          3HD1      LEU  44   9.715  -5.269  -0.945
  326   HD21  LEU  44          3HD2      LEU  44  11.916  -8.252  -0.675
  327   HD22  LEU  44          1HD2      LEU  44  11.420  -8.248  -2.366
  328   HD23  LEU  44          2HD2      LEU  44  10.702  -9.399  -1.241
  329    H    ASP  45           H        ASP  45   8.113  -7.302   3.232
  330    HA   ASP  45           HA       ASP  45   6.348  -9.570   3.178
  331    HB2  ASP  45           2HB      ASP  45   8.135  -9.434   4.824
  332    HB3  ASP  45           1HB      ASP  45   7.472  -7.938   5.466
  333    H    THR  46           H        THR  46   5.975  -6.166   3.540
  334    HA   THR  46           HA       THR  46   3.523  -6.128   4.945
  335    HB   THR  46           HB       THR  46   4.547  -4.064   2.987
  336    HG1  THR  46           1HG      THR  46   5.951  -4.769   4.864
  337   HG21  THR  46          3HG2      THR  46   3.270  -2.496   4.442
  338   HG22  THR  46          1HG2      THR  46   2.604  -3.888   5.297
  339   HG23  THR  46          2HG2      THR  46   2.247  -3.647   3.585
  340    H    ILE  47           H        ILE  47   4.303  -6.549   1.545
  341    HA   ILE  47           HA       ILE  47   1.433  -6.463   0.903
  342    HB   ILE  47           HB       ILE  47   2.102  -6.350  -1.458
  343   HG12  ILE  47          2HG1      ILE  47   4.946  -6.073  -0.477
  344   HG13  ILE  47          1HG1      ILE  47   4.289  -7.583  -1.097
  345   HG21  ILE  47          1HG2      ILE  47   1.752  -4.291  -0.192
  346   HG22  ILE  47          2HG2      ILE  47   2.999  -4.079  -1.423
  347   HG23  ILE  47          3HG2      ILE  47   3.456  -4.282   0.268
  348   HD11  ILE  47          3HD1      ILE  47   3.836  -6.489  -3.240
  349   HD12  ILE  47          1HD1      ILE  47   5.545  -6.431  -2.805
  350   HD13  ILE  47          2HD1      ILE  47   4.536  -4.997  -2.611
  351    H    GLN  48           H        GLN  48   3.532  -8.679   1.902
  352    HA   GLN  48           HA       GLN  48   3.538 -10.947   1.944
  353    HB2  GLN  48           2HB      GLN  48   1.016 -10.478   0.424
  354    HB3  GLN  48           1HB      GLN  48   1.697 -12.099   0.440
  355    HG2  GLN  48           2HG      GLN  48   1.002 -10.481   2.879
  356    HG3  GLN  48           1HG      GLN  48   0.011 -11.760   2.185
  357   HE21  GLN  48          1HE2      GLN  48   2.847 -11.003   4.021
  358   HE22  GLN  48          2HE2      GLN  48   3.196 -12.618   4.533
  359    H    TYR  49           H        TYR  49   3.061  -9.638  -1.319
  360    HA   TYR  49           HA       TYR  49   4.351 -11.786  -2.655
  361    HB2  TYR  49           2HB      TYR  49   4.106  -8.938  -3.638
  362    HB3  TYR  49           1HB      TYR  49   4.315 -10.384  -4.616
  363    HD1  TYR  49           2HD      TYR  49   2.383 -12.162  -4.406
  364    HD2  TYR  49           1HD      TYR  49   1.993  -8.062  -3.348
  365    HE1  TYR  49           2HE      TYR  49  -0.060 -12.337  -4.645
  366    HE2  TYR  49           1HE      TYR  49  -0.449  -8.225  -3.584
  367    HH   TYR  49           HH       TYR  49  -2.122  -9.548  -4.600
  368    H    SER  50           H        SER  50   6.315 -12.181  -1.608
  369    HA   SER  50           HA       SER  50   8.353 -10.075  -1.931
  370    HB2  SER  50           2HB      SER  50   8.654 -12.371  -0.015
  371    HB3  SER  50           1HB      SER  50   9.407 -10.778   0.035
  372    HG   SER  50           HG       SER  50   7.061 -10.063   0.290
  373    H    LYS  51           H        LYS  51   7.377 -13.173  -2.944
  374    HA   LYS  51           HA       LYS  51  10.106 -13.902  -3.757
  375    HB2  LYS  51           2HB      LYS  51   7.556 -15.507  -3.566
  376    HB3  LYS  51           1HB      LYS  51   9.010 -16.118  -4.346
  377    HG2  LYS  51           2HG      LYS  51   9.538 -15.063  -1.693
  378    HG3  LYS  51           1HG      LYS  51   8.357 -16.374  -1.683
  379    HD2  LYS  51           2HD      LYS  51  10.629 -17.229  -1.414
  380    HD3  LYS  51           1HD      LYS  51   9.915 -17.789  -2.925
  381    HE2  LYS  51           2HE      LYS  51  11.122 -16.029  -4.134
  382    HE3  LYS  51           1HE      LYS  51  11.851 -15.500  -2.619
  383    HZ1  LYS  51           3HZ      LYS  51  12.166 -18.241  -3.685
  384    HZ2  LYS  51           1HZ      LYS  51  13.043 -17.511  -2.441
  385    HZ3  LYS  51           2HZ      LYS  51  13.248 -16.996  -4.037
  386    H    HIS  52           H        HIS  52   6.807 -13.716  -5.039
  387    HA   HIS  52           HA       HIS  52   7.789 -12.679  -7.541
  388    HB2  HIS  52           2HB      HIS  52   8.001 -15.104  -7.917
  389    HB3  HIS  52           1HB      HIS  52   6.318 -15.328  -7.448
  390    HD1  HIS  52           1HD      HIS  52   4.602 -15.116  -9.246
  391    HD2  HIS  52           2HD      HIS  52   8.300 -13.603 -10.397
  392    HE1  HIS  52           1HE      HIS  52   4.376 -14.547 -11.686
  393    HE2  HIS  52           2HE      HIS  52   6.590 -13.545 -12.334
  394    H1   GLY   1           1HT      GLY   1 -18.227  20.287   2.556
  395    H2   GLY   1           2HT      GLY   1 -16.993  19.147   2.380
  396    H3   GLY   1           3HT      GLY   1 -17.100  20.063   3.798
  397    HA2  GLY   1           1HA      GLY   1 -17.960  17.996   4.396
  398    HA3  GLY   1           2HA      GLY   1 -19.360  19.031   4.142
  399    H    SER   2           H        SER   2 -20.258  16.731   3.959
  400    HA   SER   2           HA       SER   2 -19.871  15.644   1.269
  401    HB2  SER   2           2HB      SER   2 -21.527  14.387   3.448
  402    HB3  SER   2           1HB      SER   2 -20.752  13.609   2.066
  403    HG   SER   2           HG       SER   2 -19.772  14.010   4.519
  404    HA   PRO   3           HA       PRO   3 -23.803  17.712   0.435
  405    HB2  PRO   3           2HB      PRO   3 -23.512  17.873  -2.227
  406    HB3  PRO   3           1HB      PRO   3 -22.621  18.942  -1.137
  407    HG2  PRO   3           2HG      PRO   3 -21.685  16.495  -2.575
  408    HG3  PRO   3           1HG      PRO   3 -20.835  18.025  -2.289
  409    HD2  PRO   3           2HD      PRO   3 -20.471  15.721  -0.805
  410    HD3  PRO   3           1HD      PRO   3 -20.092  17.361  -0.240
  411    HA   PRO   4           HA       PRO   4 -26.269  14.189  -0.604
  412    HB2  PRO   4           2HB      PRO   4 -28.427  15.374  -1.765
  413    HB3  PRO   4           1HB      PRO   4 -28.119  15.418  -0.027
  414    HG2  PRO   4           2HG      PRO   4 -27.553  17.497  -2.103
  415    HG3  PRO   4           1HG      PRO   4 -28.237  17.695  -0.477
  416    HD2  PRO   4           2HD      PRO   4 -25.640  18.217  -1.029
  417    HD3  PRO   4           1HD      PRO   4 -26.166  17.577   0.541
  418    H    GLU   5           H        GLU   5 -24.729  16.000  -2.910
  419    HA   GLU   5           HA       GLU   5 -25.911  14.842  -5.263
  420    HB2  GLU   5           2HB      GLU   5 -23.268  16.288  -4.998
  421    HB3  GLU   5           1HB      GLU   5 -24.173  16.010  -6.481
  422    HG2  GLU   5           2HG      GLU   5 -24.986  17.771  -4.178
  423    HG3  GLU   5           1HG      GLU   5 -24.427  18.297  -5.764
  424    H    ALA   6           H        ALA   6 -23.534  13.963  -2.969
  425    HA   ALA   6           HA       ALA   6 -22.161  12.104  -4.734
  426    HB1  ALA   6           1HB      ALA   6 -21.800  12.476  -1.762
  427    HB2  ALA   6           2HB      ALA   6 -20.948  13.416  -2.985
  428    HB3  ALA   6           3HB      ALA   6 -20.699  11.672  -2.883
  429    H    ASP   7           H        ASP   7 -22.371   9.890  -4.660
  430    HA   ASP   7           HA       ASP   7 -24.840   8.853  -3.759
  431    HB2  ASP   7           2HB      ASP   7 -23.554   7.934  -5.685
  432    HB3  ASP   7           1HB      ASP   7 -22.372   7.287  -4.548
  433    HA   PRO   8           HA       PRO   8 -23.743   8.334   0.521
  434    HB2  PRO   8           2HB      PRO   8 -25.932   6.839   1.206
  435    HB3  PRO   8           1HB      PRO   8 -25.933   8.598   1.066
  436    HG2  PRO   8           2HG      PRO   8 -26.861   6.539  -0.893
  437    HG3  PRO   8           1HG      PRO   8 -27.599   8.092  -0.464
  438    HD2  PRO   8           2HD      PRO   8 -26.164   7.760  -2.718
  439    HD3  PRO   8           1HD      PRO   8 -26.168   9.291  -1.821
  440    H    ARG   9           H        ARG   9 -24.165   5.746  -1.739
  441    HA   ARG   9           HA       ARG   9 -23.294   3.762   0.218
  442    HB2  ARG   9           2HB      ARG   9 -23.948   3.390  -2.705
  443    HB3  ARG   9           1HB      ARG   9 -23.688   2.115  -1.523
  444    HG2  ARG   9           2HG      ARG   9 -25.712   2.502  -0.468
  445    HG3  ARG   9           1HG      ARG   9 -25.843   4.142  -1.110
  446    HD2  ARG   9           2HD      ARG   9 -26.048   1.598  -2.715
  447    HD3  ARG   9           1HD      ARG   9 -27.405   2.605  -2.206
  448    HE   ARG   9           HE       ARG   9 -25.601   4.210  -3.624
  449   HH11  ARG   9          1HH1      ARG   9 -27.763   1.518  -4.182
  450   HH12  ARG   9          2HH1      ARG   9 -28.074   1.944  -5.835
  451   HH21  ARG   9          1HH2      ARG   9 -26.011   4.797  -5.780
  452   HH22  ARG   9          2HH2      ARG   9 -27.087   3.826  -6.747
  453    H    LEU  10           H        LEU  10 -22.147   5.563  -2.528
  454    HA   LEU  10           HA       LEU  10 -19.771   4.104  -3.003
  455    HB2  LEU  10           2HB      LEU  10 -20.668   5.660  -4.643
  456    HB3  LEU  10           1HB      LEU  10 -20.450   6.999  -3.534
  457    HG   LEU  10           HG       LEU  10 -17.967   6.546  -3.630
  458   HD11  LEU  10          1HD1      LEU  10 -17.170   5.298  -5.595
  459   HD12  LEU  10          2HD1      LEU  10 -18.825   4.776  -5.911
  460   HD13  LEU  10          3HD1      LEU  10 -18.009   4.275  -4.428
  461   HD21  LEU  10          3HD2      LEU  10 -19.438   7.337  -6.135
  462   HD22  LEU  10          1HD2      LEU  10 -17.717   7.598  -5.863
  463   HD23  LEU  10          2HD2      LEU  10 -18.904   8.393  -4.831
  464    H    ILE  11           H        ILE  11 -20.574   6.795  -0.886
  465    HA   ILE  11           HA       ILE  11 -17.899   7.255  -0.014
  466    HB   ILE  11           HB       ILE  11 -19.823   8.912   0.096
  467   HG12  ILE  11          2HG1      ILE  11 -18.277   8.501   2.661
  468   HG13  ILE  11          1HG1      ILE  11 -17.614   9.226   1.204
  469   HG21  ILE  11          1HG2      ILE  11 -21.215   8.896   2.091
  470   HG22  ILE  11          2HG2      ILE  11 -20.501   7.361   2.588
  471   HG23  ILE  11          3HG2      ILE  11 -21.476   7.448   1.120
  472   HD11  ILE  11          3HD1      ILE  11 -19.267  11.027   1.357
  473   HD12  ILE  11          1HD1      ILE  11 -18.237  10.937   2.787
  474   HD13  ILE  11          2HD1      ILE  11 -19.885  10.313   2.845
  475    H    GLU  12           H        GLU  12 -20.234   4.893   0.706
  476    HA   GLU  12           HA       GLU  12 -19.475   4.333   3.396
  477    HB2  GLU  12           2HB      GLU  12 -21.108   2.917   1.323
  478    HB3  GLU  12           1HB      GLU  12 -20.646   2.078   2.798
  479    HG2  GLU  12           2HG      GLU  12 -22.209   4.647   2.636
  480    HG3  GLU  12           1HG      GLU  12 -22.866   3.050   2.986
  481    H    SER  13           H        SER  13 -18.235   3.424   0.294
  482    HA   SER  13           HA       SER  13 -16.939   1.036   0.984
  483    HB2  SER  13           2HB      SER  13 -15.941   3.036  -1.050
  484    HB3  SER  13           1HB      SER  13 -15.721   1.285  -1.054
  485    HG   SER  13           HG       SER  13 -17.384   1.828  -2.471
  486    H    LEU  14           H        LEU  14 -16.022   4.387   1.439
  487    HA   LEU  14           HA       LEU  14 -13.308   3.821   2.133
  488    HB2  LEU  14           2HB      LEU  14 -15.004   6.260   2.678
  489    HB3  LEU  14           1HB      LEU  14 -13.277   6.158   2.960
  490    HG   LEU  14           HG       LEU  14 -13.447   5.428   0.327
  491   HD11  LEU  14          1HD1      LEU  14 -14.891   7.073  -0.763
  492   HD12  LEU  14          2HD1      LEU  14 -15.500   7.584   0.809
  493   HD13  LEU  14          3HD1      LEU  14 -15.824   5.950   0.226
  494   HD21  LEU  14          3HD2      LEU  14 -13.136   8.233   1.391
  495   HD22  LEU  14          1HD2      LEU  14 -12.536   7.617  -0.149
  496   HD23  LEU  14          2HD2      LEU  14 -11.865   7.009   1.362
  497    H    SER  15           H        SER  15 -16.285   4.397   3.973
  498    HA   SER  15           HA       SER  15 -15.033   4.227   6.522
  499    HB2  SER  15           2HB      SER  15 -17.581   3.685   7.133
  500    HB3  SER  15           1HB      SER  15 -17.049   5.315   6.725
  501    HG   SER  15           HG       SER  15 -18.428   3.438   5.128
  502    H    GLN  16           H        GLN  16 -16.325   1.930   4.265
  503    HA   GLN  16           HA       GLN  16 -16.690  -0.258   5.988
  504    HB2  GLN  16           2HB      GLN  16 -17.473   0.007   3.569
  505    HB3  GLN  16           1HB      GLN  16 -15.850  -0.482   3.105
  506    HG2  GLN  16           2HG      GLN  16 -17.435  -2.341   3.060
  507    HG3  GLN  16           1HG      GLN  16 -16.126  -2.604   4.210
  508   HE21  GLN  16          1HE2      GLN  16 -17.329  -4.089   5.388
  509   HE22  GLN  16          2HE2      GLN  16 -18.644  -3.613   6.407
  510    H    MET  17           H        MET  17 -13.866   0.917   4.240
  511    HA   MET  17           HA       MET  17 -12.175  -1.270   4.747
  512    HB2  MET  17           2HB      MET  17 -11.409   1.640   4.422
  513    HB3  MET  17           1HB      MET  17 -10.312   0.275   4.297
  514    HG2  MET  17           2HG      MET  17 -12.585   0.953   2.456
  515    HG3  MET  17           1HG      MET  17 -10.862   1.025   2.100
  516    HE1  MET  17           3HE      MET  17  -9.353  -1.041   1.586
  517    HE2  MET  17           1HE      MET  17  -9.831  -2.708   1.900
  518    HE3  MET  17           2HE      MET  17  -9.638  -1.579   3.241
  519    H    LEU  18           H        LEU  18 -12.837   1.687   6.544
  520    HA   LEU  18           HA       LEU  18 -10.976   1.308   8.617
  521    HB2  LEU  18           2HB      LEU  18 -12.060   3.447   8.191
  522    HB3  LEU  18           1HB      LEU  18 -13.621   2.762   8.590
  523    HG   LEU  18           HG       LEU  18 -12.761   2.385  10.925
  524   HD11  LEU  18          1HD1      LEU  18 -10.509   4.139   9.962
  525   HD12  LEU  18          2HD1      LEU  18 -10.378   2.446  10.441
  526   HD13  LEU  18          3HD1      LEU  18 -10.816   3.668  11.635
  527   HD21  LEU  18          3HD2      LEU  18 -14.215   4.264  10.335
  528   HD22  LEU  18          1HD2      LEU  18 -12.797   5.231   9.937
  529   HD23  LEU  18          2HD2      LEU  18 -13.063   4.701  11.597
  530    H    SER  19           H        SER  19 -14.333   0.281   8.221
  531    HA   SER  19           HA       SER  19 -14.575  -0.853  10.827
  532    HB2  SER  19           2HB      SER  19 -16.483  -0.101   9.294
  533    HB3  SER  19           1HB      SER  19 -16.225  -1.602   8.407
  534    HG   SER  19           HG       SER  19 -16.819  -1.415  11.185
  535    H    MET  20           H        MET  20 -13.520  -2.018   7.701
  536    HA   MET  20           HA       MET  20 -13.550  -4.791   8.326
  537    HB2  MET  20           2HB      MET  20 -13.430  -3.648   6.021
  538    HB3  MET  20           1HB      MET  20 -11.705  -3.502   6.324
  539    HG2  MET  20           2HG      MET  20 -11.598  -5.962   6.611
  540    HG3  MET  20           1HG      MET  20 -13.298  -6.048   6.159
  541    HE1  MET  20           3HE      MET  20 -13.266  -3.633   3.843
  542    HE2  MET  20           1HE      MET  20 -14.209  -5.125   3.834
  543    HE3  MET  20           2HE      MET  20 -13.186  -4.721   2.456
  544    H    GLY  21           H        GLY  21 -11.301  -2.198   8.871
  545    HA2  GLY  21           2HA      GLY  21  -9.813  -2.471  10.790
  546    HA3  GLY  21           1HA      GLY  21  -9.520  -4.116  10.243
  547    H    PHE  22           H        PHE  22  -9.712  -1.508   7.967
  548    HA   PHE  22           HA       PHE  22  -6.788  -1.628   7.618
  549    HB2  PHE  22           2HB      PHE  22  -9.003  -1.443   5.569
  550    HB3  PHE  22           1HB      PHE  22  -7.339  -1.010   5.190
  551    HD1  PHE  22           2HD      PHE  22  -5.564  -2.727   5.299
  552    HD2  PHE  22           1HD      PHE  22  -9.683  -3.701   5.704
  553    HE1  PHE  22           2HE      PHE  22  -5.047  -5.082   4.813
  554    HE2  PHE  22           1HE      PHE  22  -9.176  -6.064   5.224
  555    HZ   PHE  22           HZ       PHE  22  -6.858  -6.754   4.775
  556    H    SER  23           H        SER  23  -5.816   0.207   8.036
  557    HA   SER  23           HA       SER  23  -6.633   2.728   7.082
  558    HB2  SER  23           2HB      SER  23  -6.863   3.692   9.511
  559    HB3  SER  23           1HB      SER  23  -8.261   2.931   8.757
  560    HG   SER  23           HG       SER  23  -7.629   2.293  11.010
  561    H    ASP  24           H        ASP  24  -4.798   3.852   6.838
  562    HA   ASP  24           HA       ASP  24  -2.501   3.011   8.460
  563    HB2  ASP  24           2HB      ASP  24  -1.095   3.302   6.649
  564    HB3  ASP  24           1HB      ASP  24  -2.559   2.719   5.870
  565    H    GLU  25           H        GLU  25  -0.730   4.904   8.306
  566    HA   GLU  25           HA       GLU  25  -2.089   7.233   9.483
  567    HB2  GLU  25           2HB      GLU  25   0.718   7.233  10.029
  568    HB3  GLU  25           1HB      GLU  25  -0.625   7.100  11.155
  569    HG2  GLU  25           2HG      GLU  25   0.565   5.186  11.598
  570    HG3  GLU  25           1HG      GLU  25  -0.644   4.608  10.455
  571    H    GLY  26           H        GLY  26   0.598   6.319   7.357
  572    HA2  GLY  26           2HA      GLY  26   1.459   8.912   6.698
  573    HA3  GLY  26           1HA      GLY  26   1.698   7.483   5.707
  574    H    GLY  27           H        GLY  27  -1.240   7.064   5.530
  575    HA2  GLY  27           2HA      GLY  27  -3.118   8.136   4.523
  576    HA3  GLY  27           1HA      GLY  27  -2.042   9.392   3.920
  577    H    TRP  28           H        TRP  28  -1.026   6.105   3.698
  578    HA   TRP  28           HA       TRP  28  -0.887   6.354   0.845
  579    HB2  TRP  28           2HB      TRP  28   0.453   4.463   0.843
  580    HB3  TRP  28           1HB      TRP  28   0.773   5.127   2.430
  581    HD1  TRP  28           HD       TRP  28   0.234   3.629   4.491
  582    HE1  TRP  28           1HE      TRP  28  -0.542   1.192   4.763
  583    HE3  TRP  28           3HE      TRP  28  -1.122   2.654  -0.345
  584    HZ2  TRP  28           2HZ      TRP  28  -1.584  -0.872   3.150
  585    HZ3  TRP  28           3HZ      TRP  28  -1.992   0.417  -0.897
  586    HH2  TRP  28           HH       TRP  28  -2.218  -1.306   0.812
  587    H    LEU  29           H        LEU  29  -3.032   4.824   3.130
  588    HA   LEU  29           HA       LEU  29  -4.339   3.135   1.242
  589    HB2  LEU  29           2HB      LEU  29  -4.381   2.865   3.738
  590    HB3  LEU  29           1HB      LEU  29  -5.477   4.234   3.811
  591    HG   LEU  29           HG       LEU  29  -6.978   2.859   2.227
  592   HD11  LEU  29          1HD1      LEU  29  -5.371   1.165   1.608
  593   HD12  LEU  29          2HD1      LEU  29  -6.718   0.424   2.473
  594   HD13  LEU  29          3HD1      LEU  29  -5.179   0.692   3.295
  595   HD21  LEU  29          3HD2      LEU  29  -7.526   3.341   4.552
  596   HD22  LEU  29          1HD2      LEU  29  -6.541   1.974   5.075
  597   HD23  LEU  29          2HD2      LEU  29  -7.996   1.698   4.118
  598    H    THR  30           H        THR  30  -4.953   6.402   2.455
  599    HA   THR  30           HA       THR  30  -7.431   6.709   1.101
  600    HB   THR  30           HB       THR  30  -6.491   8.084   3.099
  601    HG1  THR  30           1HG      THR  30  -7.923   9.236   0.921
  602   HG21  THR  30          3HG2      THR  30  -5.412   9.668   0.766
  603   HG22  THR  30          1HG2      THR  30  -4.472   8.925   2.062
  604   HG23  THR  30          2HG2      THR  30  -5.552  10.268   2.419
  605    H    ARG  31           H        ARG  31  -4.174   6.838   0.068
  606    HA   ARG  31           HA       ARG  31  -4.758   8.446  -2.282
  607    HB2  ARG  31           2HB      ARG  31  -2.239   6.999  -1.422
  608    HB3  ARG  31           1HB      ARG  31  -2.371   7.995  -2.865
  609    HG2  ARG  31           2HG      ARG  31  -2.837   9.011  -0.069
  610    HG3  ARG  31           1HG      ARG  31  -1.293   9.104  -0.916
  611    HD2  ARG  31           2HD      ARG  31  -3.853  10.277  -1.985
  612    HD3  ARG  31           1HD      ARG  31  -2.706  11.182  -1.001
  613    HE   ARG  31           HE       ARG  31  -1.260  10.096  -3.104
  614   HH11  ARG  31          1HH1      ARG  31  -3.890  12.375  -2.679
  615   HH12  ARG  31          2HH1      ARG  31  -3.515  13.248  -4.129
  616   HH21  ARG  31          1HH2      ARG  31  -0.766  11.269  -4.996
  617   HH22  ARG  31          2HH2      ARG  31  -1.741  12.640  -5.434
  618    H    LEU  32           H        LEU  32  -4.129   5.106  -1.383
  619    HA   LEU  32           HA       LEU  32  -3.967   3.991  -3.950
  620    HB2  LEU  32           2HB      LEU  32  -3.333   2.854  -1.833
  621    HB3  LEU  32           1HB      LEU  32  -5.033   2.699  -1.432
  622    HG   LEU  32           HG       LEU  32  -5.151   1.459  -3.747
  623   HD11  LEU  32          1HD1      LEU  32  -2.894   1.867  -4.461
  624   HD12  LEU  32          2HD1      LEU  32  -3.093   0.143  -4.147
  625   HD13  LEU  32          3HD1      LEU  32  -2.255   1.162  -2.977
  626   HD21  LEU  32          3HD2      LEU  32  -5.749   0.407  -1.688
  627   HD22  LEU  32          1HD2      LEU  32  -4.058   0.280  -1.202
  628   HD23  LEU  32          2HD2      LEU  32  -4.660  -0.672  -2.560
  629    H    LEU  33           H        LEU  33  -6.734   4.751  -1.909
  630    HA   LEU  33           HA       LEU  33  -8.683   3.367  -3.425
  631    HB2  LEU  33           2HB      LEU  33  -8.897   5.722  -1.558
  632    HB3  LEU  33           1HB      LEU  33 -10.285   4.912  -2.256
  633    HG   LEU  33           HG       LEU  33  -8.258   3.625  -0.423
  634   HD11  LEU  33          1HD1      LEU  33 -10.084   3.646   1.216
  635   HD12  LEU  33          2HD1      LEU  33 -11.081   4.560   0.083
  636   HD13  LEU  33          3HD1      LEU  33  -9.607   5.274   0.737
  637   HD21  LEU  33          3HD2      LEU  33  -9.161   1.967  -1.877
  638   HD22  LEU  33          1HD2      LEU  33 -10.795   2.608  -1.692
  639   HD23  LEU  33          2HD2      LEU  33 -10.000   1.820  -0.331
  640    H    GLN  34           H        GLN  34  -6.870   6.071  -4.231
  641    HA   GLN  34           HA       GLN  34  -8.983   7.231  -5.887
  642    HB2  GLN  34           2HB      GLN  34  -6.229   8.154  -5.112
  643    HB3  GLN  34           1HB      GLN  34  -7.105   8.909  -6.439
  644    HG2  GLN  34           2HG      GLN  34  -8.029   8.727  -3.577
  645    HG3  GLN  34           1HG      GLN  34  -7.381  10.157  -4.378
  646   HE21  GLN  34          1HE2      GLN  34 -10.114   8.072  -4.014
  647   HE22  GLN  34          2HE2      GLN  34 -11.240   9.051  -4.888
  648    H    THR  35           H        THR  35  -5.716   5.844  -6.236
  649    HA   THR  35           HA       THR  35  -5.878   5.929  -9.109
  650    HB   THR  35           HB       THR  35  -3.731   4.514  -8.905
  651    HG1  THR  35           1HG      THR  35  -2.900   4.234  -6.932
  652   HG21  THR  35          3HG2      THR  35  -3.691   6.882  -9.439
  653   HG22  THR  35          1HG2      THR  35  -2.401   6.512  -8.293
  654   HG23  THR  35          2HG2      THR  35  -3.880   7.297  -7.735
  655    H    LYS  36           H        LYS  36  -6.444   3.550  -6.603
  656    HA   LYS  36           HA       LYS  36  -6.829   1.464  -8.633
  657    HB2  LYS  36           2HB      LYS  36  -6.168   1.493  -5.754
  658    HB3  LYS  36           1HB      LYS  36  -7.246   0.202  -6.267
  659    HG2  LYS  36           2HG      LYS  36  -4.858  -0.441  -6.257
  660    HG3  LYS  36           1HG      LYS  36  -5.622  -0.604  -7.838
  661    HD2  LYS  36           2HD      LYS  36  -4.618   1.470  -8.579
  662    HD3  LYS  36           1HD      LYS  36  -3.941   1.749  -6.973
  663    HE2  LYS  36           2HE      LYS  36  -2.429  -0.042  -7.187
  664    HE3  LYS  36           1HE      LYS  36  -3.291  -0.707  -8.571
  665    HZ1  LYS  36           3HZ      LYS  36  -1.883   1.903  -8.588
  666    HZ2  LYS  36           1HZ      LYS  36  -2.582   1.111  -9.914
  667    HZ3  LYS  36           2HZ      LYS  36  -1.217   0.454  -9.166
  668    H    ASN  37           H        ASN  37  -8.593   3.826  -7.457
  669    HA   ASN  37           HA       ASN  37 -10.808   4.303  -7.413
  670    HB2  ASN  37           2HB      ASN  37 -10.777   2.490  -9.339
  671    HB3  ASN  37           1HB      ASN  37 -11.599   1.506  -8.133
  672   HD21  ASN  37          1HD2      ASN  37 -11.826   4.228 -10.246
  673   HD22  ASN  37          2HD2      ASN  37 -13.522   4.500 -10.045
  674    H    TYR  38           H        TYR  38 -12.998   3.203  -6.462
  675    HA   TYR  38           HA       TYR  38 -12.258   2.534  -3.716
  676    HB2  TYR  38           2HB      TYR  38 -15.065   3.075  -4.651
  677    HB3  TYR  38           1HB      TYR  38 -14.363   3.339  -3.059
  678    HD1  TYR  38           1HD      TYR  38 -12.861   5.294  -2.687
  679    HD2  TYR  38           2HD      TYR  38 -14.978   4.754  -6.336
  680    HE1  TYR  38           1HE      TYR  38 -12.488   7.660  -3.243
  681    HE2  TYR  38           2HE      TYR  38 -14.612   7.119  -6.907
  682    HH   TYR  38           HH       TYR  38 -14.170   9.322  -5.457
  683    H    ASP  39           H        ASP  39 -11.984   0.535  -5.743
  684    HA   ASP  39           HA       ASP  39 -14.247  -1.260  -5.453
  685    HB2  ASP  39           2HB      ASP  39 -12.723  -0.933  -7.554
  686    HB3  ASP  39           1HB      ASP  39 -11.636  -2.033  -6.716
  687    H    ILE  40           H        ILE  40 -14.406  -2.123  -3.496
  688    HA   ILE  40           HA       ILE  40 -12.355  -2.612  -1.676
  689    HB   ILE  40           HB       ILE  40 -15.041  -3.975  -1.914
  690   HG12  ILE  40          2HG1      ILE  40 -14.161  -1.705  -0.117
  691   HG13  ILE  40          1HG1      ILE  40 -15.035  -1.485  -1.627
  692   HG21  ILE  40          1HG2      ILE  40 -13.571  -5.337  -0.561
  693   HG22  ILE  40          2HG2      ILE  40 -14.757  -4.538   0.471
  694   HG23  ILE  40          3HG2      ILE  40 -13.103  -3.929   0.395
  695   HD11  ILE  40          3HD1      ILE  40 -16.045  -2.975   0.784
  696   HD12  ILE  40          1HD1      ILE  40 -16.924  -2.735  -0.726
  697   HD13  ILE  40          2HD1      ILE  40 -16.520  -1.352   0.293
  698    H    GLY  41           H        GLY  41 -13.869  -4.834  -4.001
  699    HA2  GLY  41           2HA      GLY  41 -12.535  -7.172  -3.237
  700    HA3  GLY  41           1HA      GLY  41 -13.194  -6.857  -4.832
  701    H    ALA  42           H        ALA  42 -11.621  -4.732  -5.646
  702    HA   ALA  42           HA       ALA  42  -9.295  -6.090  -6.528
  703    HB1  ALA  42           1HB      ALA  42  -8.739  -4.082  -7.688
  704    HB2  ALA  42           2HB      ALA  42  -9.808  -3.126  -6.664
  705    HB3  ALA  42           3HB      ALA  42 -10.485  -4.301  -7.790
  706    H    ALA  43           H        ALA  43  -9.772  -3.460  -4.195
  707    HA   ALA  43           HA       ALA  43  -7.083  -3.001  -3.565
  708    HB1  ALA  43           1HB      ALA  43  -9.455  -2.688  -1.733
  709    HB2  ALA  43           2HB      ALA  43  -8.934  -1.508  -2.936
  710    HB3  ALA  43           3HB      ALA  43  -7.883  -1.897  -1.573
  711    H    LEU  44           H        LEU  44  -9.371  -5.326  -2.259
  712    HA   LEU  44           HA       LEU  44  -7.859  -6.227  -0.072
  713    HB2  LEU  44           2HB      LEU  44 -10.322  -6.793  -1.206
  714    HB3  LEU  44           1HB      LEU  44  -9.439  -8.296  -1.382
  715    HG   LEU  44           HG       LEU  44  -8.994  -8.280   1.061
  716   HD11  LEU  44          1HD1      LEU  44 -10.355  -6.762   2.459
  717   HD12  LEU  44          2HD1      LEU  44 -10.819  -5.882   1.003
  718   HD13  LEU  44          3HD1      LEU  44  -9.131  -5.920   1.512
  719   HD21  LEU  44          3HD2      LEU  44 -10.865  -9.546   0.147
  720   HD22  LEU  44          1HD2      LEU  44 -11.901  -8.124   0.274
  721   HD23  LEU  44          2HD2      LEU  44 -11.265  -8.885   1.732
  722    H    ASP  45           H        ASP  45  -7.946  -7.283  -3.443
  723    HA   ASP  45           HA       ASP  45  -6.069  -9.431  -2.961
  724    HB2  ASP  45           2HB      ASP  45  -8.001  -9.360  -4.689
  725    HB3  ASP  45           1HB      ASP  45  -6.875  -8.437  -5.679
  726    H    THR  46           H        THR  46  -5.766  -6.146  -3.368
  727    HA   THR  46           HA       THR  46  -3.548  -5.950  -5.104
  728    HB   THR  46           HB       THR  46  -4.409  -4.074  -2.889
  729    HG1  THR  46           1HG      THR  46  -5.815  -4.620  -4.861
  730   HG21  THR  46          3HG2      THR  46  -3.105  -2.372  -4.009
  731   HG22  THR  46          1HG2      THR  46  -2.637  -3.510  -5.274
  732   HG23  THR  46          2HG2      THR  46  -2.056  -3.738  -3.624
  733    H    ILE  47           H        ILE  47  -3.779  -6.427  -1.598
  734    HA   ILE  47           HA       ILE  47  -0.844  -6.686  -1.562
  735    HB   ILE  47           HB       ILE  47  -0.949  -6.183   0.863
  736   HG12  ILE  47          2HG1      ILE  47  -3.798  -5.327   0.295
  737   HG13  ILE  47          1HG1      ILE  47  -3.368  -6.823   1.114
  738   HG21  ILE  47          1HG2      ILE  47  -2.126  -4.002  -0.862
  739   HG22  ILE  47          2HG2      ILE  47  -0.427  -4.474  -0.866
  740   HG23  ILE  47          3HG2      ILE  47  -1.148  -3.799   0.594
  741   HD11  ILE  47          3HD1      ILE  47  -2.273  -5.509   2.884
  742   HD12  ILE  47          1HD1      ILE  47  -3.994  -5.149   2.726
  743   HD13  ILE  47          2HD1      ILE  47  -2.795  -4.033   2.075
  744    H    GLN  48           H        GLN  48  -3.146  -8.663  -2.000
  745    HA   GLN  48           HA       GLN  48  -3.398 -10.900  -1.727
  746    HB2  GLN  48           2HB      GLN  48  -0.764 -10.601  -1.157
  747    HB3  GLN  48           1HB      GLN  48  -1.347 -11.257   0.366
  748    HG2  GLN  48           2HG      GLN  48  -1.960 -12.552  -2.269
  749    HG3  GLN  48           1HG      GLN  48  -0.487 -12.899  -1.367
  750   HE21  GLN  48          1HE2      GLN  48  -2.830 -14.572  -2.086
  751   HE22  GLN  48          2HE2      GLN  48  -3.393 -15.240  -0.593
  752    H    TYR  49           H        TYR  49  -2.827  -9.139   1.291
  753    HA   TYR  49           HA       TYR  49  -4.155 -10.837   3.055
  754    HB2  TYR  49           2HB      TYR  49  -3.836  -7.831   3.094
  755    HB3  TYR  49           1HB      TYR  49  -4.514  -8.749   4.430
  756    HD1  TYR  49           1HD      TYR  49  -3.102 -10.182   5.800
  757    HD2  TYR  49           2HD      TYR  49  -1.446  -7.900   2.613
  758    HE1  TYR  49           1HE      TYR  49  -0.850 -10.549   6.711
  759    HE2  TYR  49           2HE      TYR  49   0.816  -8.269   3.517
  760    HH   TYR  49           HH       TYR  49   1.931  -8.874   5.491
  761    H    SER  50           H        SER  50  -6.073 -11.664   2.385
  762    HA   SER  50           HA       SER  50  -8.304  -9.774   2.241
  763    HB2  SER  50           2HB      SER  50  -9.206 -11.578   0.484
  764    HB3  SER  50           1HB      SER  50  -8.261 -10.178  -0.015
  765    HG   SER  50           HG       SER  50  -6.377 -11.645   0.246
  766    H    LYS  51           H        LYS  51  -7.239 -13.103   2.719
  767    HA   LYS  51           HA       LYS  51  -9.779 -13.870   3.873
  768    HB2  LYS  51           2HB      LYS  51  -7.183 -15.406   3.698
  769    HB3  LYS  51           1HB      LYS  51  -8.726 -16.060   4.225
  770    HG2  LYS  51           2HG      LYS  51  -9.406 -15.062   1.808
  771    HG3  LYS  51           1HG      LYS  51  -7.726 -15.522   1.521
  772    HD2  LYS  51           2HD      LYS  51  -8.976 -17.437   0.974
  773    HD3  LYS  51           1HD      LYS  51  -8.332 -17.763   2.583
  774    HE2  LYS  51           2HE      LYS  51 -10.478 -17.045   3.558
  775    HE3  LYS  51           1HE      LYS  51 -11.112 -16.776   1.939
  776    HZ1  LYS  51           3HZ      LYS  51 -10.475 -19.308   3.279
  777    HZ2  LYS  51           1HZ      LYS  51 -10.445 -19.228   1.592
  778    HZ3  LYS  51           2HZ      LYS  51 -11.870 -18.870   2.430
  779    H    HIS  52           H        HIS  52  -6.407 -13.842   5.059
  780    HA   HIS  52           HA       HIS  52  -7.243 -12.734   7.576
  781    HB2  HIS  52           2HB      HIS  52  -7.607 -15.360   7.548
  782    HB3  HIS  52           1HB      HIS  52  -5.873 -15.377   7.852
  783    HD1  HIS  52           1HD      HIS  52  -5.091 -14.781  10.199
  784    HD2  HIS  52           2HD      HIS  52  -9.162 -14.172   9.610
  785    HE1  HIS  52           1HE      HIS  52  -6.039 -14.301  12.475
  786    HE2  HIS  52           2HE      HIS  52  -8.525 -14.120  12.116
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1  19.569  20.059  -3.000
    2    H2   GLY   1           2HT      GLY   1  17.955  19.584  -2.822
    3    H3   GLY   1           3HT      GLY   1  18.506  20.163  -4.311
    4    HA2  GLY   1           1HA      GLY   1  18.282  17.772  -4.373
    5    HA3  GLY   1           2HA      GLY   1  19.960  18.268  -4.563
    6    H    SER   2           H        SER   2  20.970  16.502  -3.736
    7    HA   SER   2           HA       SER   2  20.209  15.627  -1.043
    8    HB2  SER   2           2HB      SER   2  22.217  13.954  -2.166
    9    HB3  SER   2           1HB      SER   2  20.522  13.567  -1.870
   10    HG   SER   2           HG       SER   2  20.019  14.344  -3.920
   11    HA   PRO   3           HA       PRO   3  23.909  17.800   0.265
   12    HB2  PRO   3           2HB      PRO   3  23.568  17.455   2.918
   13    HB3  PRO   3           1HB      PRO   3  22.628  18.628   1.989
   14    HG2  PRO   3           2HG      PRO   3  21.847  15.911   2.952
   15    HG3  PRO   3           1HG      PRO   3  20.888  17.398   2.892
   16    HD2  PRO   3           2HD      PRO   3  20.713  15.371   1.045
   17    HD3  PRO   3           1HD      PRO   3  20.288  17.063   0.712
   18    HA   PRO   4           HA       PRO   4  26.867  14.493   0.537
   19    HB2  PRO   4           2HB      PRO   4  28.350  16.381   2.290
   20    HB3  PRO   4           1HB      PRO   4  28.887  15.533   0.837
   21    HG2  PRO   4           2HG      PRO   4  28.312  18.133   0.771
   22    HG3  PRO   4           1HG      PRO   4  27.907  17.067  -0.585
   23    HD2  PRO   4           2HD      PRO   4  26.132  18.236   1.503
   24    HD3  PRO   4           1HD      PRO   4  25.803  17.904  -0.210
   25    H    GLU   5           H        GLU   5  25.515  16.013   3.349
   26    HA   GLU   5           HA       GLU   5  26.697  14.296   5.291
   27    HB2  GLU   5           2HB      GLU   5  24.245  16.051   5.415
   28    HB3  GLU   5           1HB      GLU   5  24.959  15.233   6.799
   29    HG2  GLU   5           2HG      GLU   5  26.391  17.251   5.090
   30    HG3  GLU   5           1HG      GLU   5  25.578  17.620   6.608
   31    H    ALA   6           H        ALA   6  24.014  14.031   3.145
   32    HA   ALA   6           HA       ALA   6  22.581  12.046   4.628
   33    HB1  ALA   6           1HB      ALA   6  22.432  12.781   1.705
   34    HB2  ALA   6           2HB      ALA   6  21.434  13.448   2.998
   35    HB3  ALA   6           3HB      ALA   6  21.291  11.745   2.563
   36    H    ASP   7           H        ASP   7  22.732   9.867   4.514
   37    HA   ASP   7           HA       ASP   7  25.171   8.722   3.655
   38    HB2  ASP   7           2HB      ASP   7  23.560   7.914   5.502
   39    HB3  ASP   7           1HB      ASP   7  22.670   7.138   4.196
   40    HA   PRO   8           HA       PRO   8  24.086   8.309  -0.659
   41    HB2  PRO   8           2HB      PRO   8  26.323   6.914  -1.383
   42    HB3  PRO   8           1HB      PRO   8  26.293   8.668  -1.159
   43    HG2  PRO   8           2HG      PRO   8  27.224   6.533   0.718
   44    HG3  PRO   8           1HG      PRO   8  27.957   8.105   0.355
   45    HD2  PRO   8           2HD      PRO   8  26.497   7.678   2.583
   46    HD3  PRO   8           1HD      PRO   8  26.514   9.246   1.748
   47    H    ARG   9           H        ARG   9  24.630   5.754   1.601
   48    HA   ARG   9           HA       ARG   9  23.807   3.702  -0.311
   49    HB2  ARG   9           2HB      ARG   9  24.552   3.436   2.608
   50    HB3  ARG   9           1HB      ARG   9  24.270   2.110   1.488
   51    HG2  ARG   9           2HG      ARG   9  26.261   2.437   0.384
   52    HG3  ARG   9           1HG      ARG   9  26.364   4.135   0.854
   53    HD2  ARG   9           2HD      ARG   9  26.733   1.764   2.682
   54    HD3  ARG   9           1HD      ARG   9  28.019   2.784   2.042
   55    HE   ARG   9           HE       ARG   9  26.010   4.252   3.486
   56   HH11  ARG   9          1HH1      ARG   9  28.966   2.396   3.778
   57   HH12  ARG   9          2HH1      ARG   9  29.419   3.126   5.282
   58   HH21  ARG   9          1HH2      ARG   9  26.610   5.210   5.467
   59   HH22  ARG   9          2HH2      ARG   9  28.084   4.713   6.245
   60    H    LEU  10           H        LEU  10  22.685   5.341   2.600
   61    HA   LEU  10           HA       LEU  10  20.332   3.802   2.950
   62    HB2  LEU  10           2HB      LEU  10  21.359   5.271   4.688
   63    HB3  LEU  10           1HB      LEU  10  20.792   6.665   3.783
   64    HG   LEU  10           HG       LEU  10  18.448   5.803   4.077
   65   HD11  LEU  10          1HD1      LEU  10  18.097   4.185   5.918
   66   HD12  LEU  10          2HD1      LEU  10  19.838   3.896   5.949
   67   HD13  LEU  10          3HD1      LEU  10  18.902   3.486   4.513
   68   HD21  LEU  10          3HD2      LEU  10  20.031   6.444   6.560
   69   HD22  LEU  10          1HD2      LEU  10  18.276   6.529   6.418
   70   HD23  LEU  10          2HD2      LEU  10  19.289   7.600   5.455
   71    H    ILE  11           H        ILE  11  21.073   6.696   1.089
   72    HA   ILE  11           HA       ILE  11  18.381   7.298   0.393
   73    HB   ILE  11           HB       ILE  11  20.328   8.902   0.265
   74   HG12  ILE  11          2HG1      ILE  11  18.691   8.633  -2.264
   75   HG13  ILE  11          1HG1      ILE  11  18.101   9.328  -0.758
   76   HG21  ILE  11          1HG2      ILE  11  21.665   8.927  -1.778
   77   HG22  ILE  11          2HG2      ILE  11  20.892   7.433  -2.304
   78   HG23  ILE  11          3HG2      ILE  11  21.911   7.438  -0.866
   79   HD11  ILE  11          3HD1      ILE  11  19.734  11.109  -0.913
   80   HD12  ILE  11          1HD1      ILE  11  18.751  11.036  -2.375
   81   HD13  ILE  11          2HD1      ILE  11  20.394  10.397  -2.386
   82    H    GLU  12           H        GLU  12  20.559   4.894  -0.599
   83    HA   GLU  12           HA       GLU  12  19.512   4.535  -3.246
   84    HB2  GLU  12           2HB      GLU  12  21.415   2.968  -1.530
   85    HB3  GLU  12           1HB      GLU  12  20.804   2.311  -3.046
   86    HG2  GLU  12           2HG      GLU  12  22.308   4.900  -2.732
   87    HG3  GLU  12           1HG      GLU  12  22.974   3.381  -3.329
   88    H    SER  13           H        SER  13  18.433   3.707  -0.151
   89    HA   SER  13           HA       SER  13  17.194   1.234  -0.656
   90    HB2  SER  13           2HB      SER  13  16.360   3.440   1.250
   91    HB3  SER  13           1HB      SER  13  15.756   1.782   1.288
   92    HG   SER  13           HG       SER  13  18.355   1.557   1.279
   93    H    LEU  14           H        LEU  14  16.304   4.523  -1.393
   94    HA   LEU  14           HA       LEU  14  13.601   3.928  -2.143
   95    HB2  LEU  14           2HB      LEU  14  15.378   6.284  -2.797
   96    HB3  LEU  14           1HB      LEU  14  13.679   6.184  -3.211
   97    HG   LEU  14           HG       LEU  14  13.594   5.741  -0.515
   98   HD11  LEU  14          1HD1      LEU  14  15.022   7.404   0.552
   99   HD12  LEU  14          2HD1      LEU  14  15.776   7.768  -1.001
  100   HD13  LEU  14          3HD1      LEU  14  15.987   6.178  -0.270
  101   HD21  LEU  14          3HD2      LEU  14  13.471   8.384  -1.968
  102   HD22  LEU  14          1HD2      LEU  14  12.828   8.074  -0.356
  103   HD23  LEU  14          2HD2      LEU  14  12.144   7.243  -1.754
  104    H    SER  15           H        SER  15  16.652   4.473  -3.848
  105    HA   SER  15           HA       SER  15  15.709   4.151  -6.463
  106    HB2  SER  15           2HB      SER  15  18.469   3.255  -5.788
  107    HB3  SER  15           1HB      SER  15  17.916   4.336  -7.070
  108    HG   SER  15           HG       SER  15  19.097   5.178  -5.032
  109    H    GLN  16           H        GLN  16  16.955   1.816  -4.120
  110    HA   GLN  16           HA       GLN  16  17.090  -0.421  -5.781
  111    HB2  GLN  16           2HB      GLN  16  17.959  -0.178  -3.406
  112    HB3  GLN  16           1HB      GLN  16  16.319  -0.513  -2.869
  113    HG2  GLN  16           2HG      GLN  16  17.799  -2.493  -2.843
  114    HG3  GLN  16           1HG      GLN  16  16.371  -2.695  -3.858
  115   HE21  GLN  16          1HE2      GLN  16  16.617  -2.860  -6.081
  116   HE22  GLN  16          2HE2      GLN  16  18.158  -3.090  -6.833
  117    H    MET  17           H        MET  17  14.378   0.892  -3.933
  118    HA   MET  17           HA       MET  17  12.574  -1.215  -4.459
  119    HB2  MET  17           2HB      MET  17  12.095   1.700  -3.827
  120    HB3  MET  17           1HB      MET  17  10.806   0.512  -3.951
  121    HG2  MET  17           2HG      MET  17  13.096   0.381  -2.004
  122    HG3  MET  17           1HG      MET  17  11.481   0.972  -1.627
  123    HE1  MET  17           3HE      MET  17   9.420  -0.448  -1.259
  124    HE2  MET  17           1HE      MET  17   9.276  -2.162  -1.649
  125    HE3  MET  17           2HE      MET  17   9.446  -0.976  -2.941
  126    H    LEU  18           H        LEU  18  13.283   1.815  -6.093
  127    HA   LEU  18           HA       LEU  18  11.340   1.681  -8.108
  128    HB2  LEU  18           2HB      LEU  18  12.566   3.715  -7.600
  129    HB3  LEU  18           1HB      LEU  18  14.075   2.959  -8.071
  130    HG   LEU  18           HG       LEU  18  12.921   2.719 -10.400
  131   HD11  LEU  18          1HD1      LEU  18  11.371   5.014  -9.205
  132   HD12  LEU  18          2HD1      LEU  18  10.704   3.442  -9.645
  133   HD13  LEU  18          3HD1      LEU  18  11.347   4.507 -10.894
  134   HD21  LEU  18          3HD2      LEU  18  14.894   4.059  -9.987
  135   HD22  LEU  18          1HD2      LEU  18  13.904   5.353  -9.313
  136   HD23  LEU  18          2HD2      LEU  18  13.771   4.940 -11.022
  137    H    SER  19           H        SER  19  14.697   0.538  -8.002
  138    HA   SER  19           HA       SER  19  14.834  -0.427 -10.642
  139    HB2  SER  19           2HB      SER  19  16.372  -1.362  -8.205
  140    HB3  SER  19           1HB      SER  19  16.832  -1.622  -9.889
  141    HG   SER  19           HG       SER  19  17.537   0.363 -10.008
  142    H    MET  20           H        MET  20  13.505  -1.825  -7.730
  143    HA   MET  20           HA       MET  20  13.440  -4.500  -8.790
  144    HB2  MET  20           2HB      MET  20  12.515  -3.191  -6.287
  145    HB3  MET  20           1HB      MET  20  11.737  -4.697  -6.753
  146    HG2  MET  20           2HG      MET  20  14.029  -5.712  -6.920
  147    HG3  MET  20           1HG      MET  20  14.650  -4.229  -6.196
  148    HE1  MET  20           3HE      MET  20  12.228  -3.545  -4.137
  149    HE2  MET  20           1HE      MET  20  13.951  -3.357  -3.804
  150    HE3  MET  20           2HE      MET  20  12.926  -4.252  -2.684
  151    H    GLY  21           H        GLY  21  11.678  -1.774  -9.445
  152    HA2  GLY  21           2HA      GLY  21   9.974  -1.765 -11.091
  153    HA3  GLY  21           1HA      GLY  21   9.557  -3.408 -10.631
  154    H    PHE  22           H        PHE  22  10.054  -1.275  -8.009
  155    HA   PHE  22           HA       PHE  22   7.150  -1.165  -7.610
  156    HB2  PHE  22           2HB      PHE  22   9.470  -1.310  -5.746
  157    HB3  PHE  22           1HB      PHE  22   8.033  -0.449  -5.203
  158    HD1  PHE  22           1HD      PHE  22   9.401  -3.698  -6.189
  159    HD2  PHE  22           2HD      PHE  22   5.984  -1.610  -4.751
  160    HE1  PHE  22           1HE      PHE  22   8.351  -5.841  -5.585
  161    HE2  PHE  22           2HE      PHE  22   4.927  -3.746  -4.146
  162    HZ   PHE  22           HZ       PHE  22   6.110  -5.867  -4.563
  163    H    SER  23           H        SER  23   6.138   0.659  -7.880
  164    HA   SER  23           HA       SER  23   7.311   3.187  -7.138
  165    HB2  SER  23           2HB      SER  23   6.520   2.681 -10.019
  166    HB3  SER  23           1HB      SER  23   7.035   4.226  -9.347
  167    HG   SER  23           HG       SER  23   8.883   2.422  -8.729
  168    H    ASP  24           H        ASP  24   5.742   4.782  -6.812
  169    HA   ASP  24           HA       ASP  24   3.039   3.700  -6.705
  170    HB2  ASP  24           2HB      ASP  24   2.611   5.811  -5.318
  171    HB3  ASP  24           1HB      ASP  24   3.612   4.553  -4.609
  172    H    GLU  25           H        GLU  25   1.233   4.897  -7.378
  173    HA   GLU  25           HA       GLU  25   1.791   6.588  -9.710
  174    HB2  GLU  25           2HB      GLU  25  -0.999   5.956  -9.384
  175    HB3  GLU  25           1HB      GLU  25   0.083   5.527 -10.699
  176    HG2  GLU  25           2HG      GLU  25  -0.673   3.475  -9.959
  177    HG3  GLU  25           1HG      GLU  25   0.878   3.642  -9.135
  178    H    GLY  26           H        GLY  26  -0.190   6.404  -6.791
  179    HA2  GLY  26           2HA      GLY  26  -0.876   9.244  -7.049
  180    HA3  GLY  26           1HA      GLY  26  -1.591   8.105  -5.917
  181    H    GLY  27           H        GLY  27   1.676   7.629  -5.896
  182    HA2  GLY  27           2HA      GLY  27   3.420   8.393  -4.581
  183    HA3  GLY  27           1HA      GLY  27   2.435   9.778  -4.138
  184    H    TRP  28           H        TRP  28   1.815   6.304  -3.739
  185    HA   TRP  28           HA       TRP  28   1.270   6.822  -0.928
  186    HB2  TRP  28           2HB      TRP  28   0.018   4.816  -0.892
  187    HB3  TRP  28           1HB      TRP  28  -0.373   5.589  -2.413
  188    HD1  TRP  28           HD       TRP  28   0.215   4.286  -4.625
  189    HE1  TRP  28           1HE      TRP  28   0.986   1.872  -5.093
  190    HE3  TRP  28           3HE      TRP  28   1.546   2.921   0.119
  191    HZ2  TRP  28           2HZ      TRP  28   2.024  -0.315  -3.639
  192    HZ3  TRP  28           3HZ      TRP  28   2.425   0.655   0.492
  193    HH2  TRP  28           HH       TRP  28   2.662  -0.927  -1.348
  194    H    LEU  29           H        LEU  29   3.534   5.135  -2.960
  195    HA   LEU  29           HA       LEU  29   4.627   3.474  -0.912
  196    HB2  LEU  29           2HB      LEU  29   4.770   3.046  -3.391
  197    HB3  LEU  29           1HB      LEU  29   5.951   4.337  -3.482
  198    HG   LEU  29           HG       LEU  29   7.369   3.025  -1.857
  199   HD11  LEU  29          1HD1      LEU  29   5.703   1.590  -0.885
  200   HD12  LEU  29          2HD1      LEU  29   6.882   0.590  -1.737
  201   HD13  LEU  29          3HD1      LEU  29   5.307   0.908  -2.463
  202   HD21  LEU  29          3HD2      LEU  29   6.704   1.799  -4.526
  203   HD22  LEU  29          1HD2      LEU  29   8.141   1.430  -3.576
  204   HD23  LEU  29          2HD2      LEU  29   7.897   3.058  -4.207
  205    H    THR  30           H        THR  30   5.438   6.626  -2.281
  206    HA   THR  30           HA       THR  30   7.875   6.985  -0.925
  207    HB   THR  30           HB       THR  30   6.962   8.367  -2.853
  208    HG1  THR  30           1HG      THR  30   8.122   9.602  -0.569
  209   HG21  THR  30          3HG2      THR  30   5.581   9.852  -0.617
  210   HG22  THR  30          1HG2      THR  30   4.780   8.922  -1.885
  211   HG23  THR  30          2HG2      THR  30   5.688  10.377  -2.296
  212    H    ARG  31           H        ARG  31   4.644   7.024   0.197
  213    HA   ARG  31           HA       ARG  31   5.285   8.538   2.610
  214    HB2  ARG  31           2HB      ARG  31   2.698   7.242   1.720
  215    HB3  ARG  31           1HB      ARG  31   2.884   8.264   3.138
  216    HG2  ARG  31           2HG      ARG  31   3.620   9.308   0.440
  217    HG3  ARG  31           1HG      ARG  31   1.929   9.261   0.942
  218    HD2  ARG  31           2HD      ARG  31   4.108  10.550   2.569
  219    HD3  ARG  31           1HD      ARG  31   3.138  11.426   1.385
  220    HE   ARG  31           HE       ARG  31   1.386  10.110   3.115
  221   HH11  ARG  31          1HH1      ARG  31   3.766  12.670   3.258
  222   HH12  ARG  31          2HH1      ARG  31   2.963  13.526   4.536
  223   HH21  ARG  31          1HH2      ARG  31   0.333  11.214   4.793
  224   HH22  ARG  31          2HH2      ARG  31   1.006  12.687   5.419
  225    H    LEU  32           H        LEU  32   4.638   5.292   1.504
  226    HA   LEU  32           HA       LEU  32   4.272   4.015   3.976
  227    HB2  LEU  32           2HB      LEU  32   3.830   3.086   1.660
  228    HB3  LEU  32           1HB      LEU  32   5.551   2.790   1.532
  229    HG   LEU  32           HG       LEU  32   5.179   1.470   3.779
  230   HD11  LEU  32          1HD1      LEU  32   2.878   2.089   4.120
  231   HD12  LEU  32          2HD1      LEU  32   2.978   0.356   3.803
  232   HD13  LEU  32          3HD1      LEU  32   2.436   1.455   2.535
  233   HD21  LEU  32          3HD2      LEU  32   4.411   0.465   1.044
  234   HD22  LEU  32          1HD2      LEU  32   4.716  -0.575   2.435
  235   HD23  LEU  32          2HD2      LEU  32   6.010   0.430   1.783
  236    H    LEU  33           H        LEU  33   7.173   4.796   2.149
  237    HA   LEU  33           HA       LEU  33   8.983   3.343   3.789
  238    HB2  LEU  33           2HB      LEU  33   9.468   5.718   1.994
  239    HB3  LEU  33           1HB      LEU  33  10.722   4.714   2.694
  240    HG   LEU  33           HG       LEU  33   8.612   3.716   0.782
  241   HD11  LEU  33          1HD1      LEU  33  10.381   3.685  -0.886
  242   HD12  LEU  33          2HD1      LEU  33  11.503   4.406   0.267
  243   HD13  LEU  33          3HD1      LEU  33  10.105   5.322  -0.296
  244   HD21  LEU  33          3HD2      LEU  33   9.503   2.000   2.284
  245   HD22  LEU  33          1HD2      LEU  33  11.142   2.427   1.795
  246   HD23  LEU  33          2HD2      LEU  33  10.022   1.742   0.617
  247    H    GLN  34           H        GLN  34   7.306   6.250   4.258
  248    HA   GLN  34           HA       GLN  34   9.245   7.263   6.188
  249    HB2  GLN  34           2HB      GLN  34   6.598   8.455   5.346
  250    HB3  GLN  34           1HB      GLN  34   7.841   9.239   6.307
  251    HG2  GLN  34           2HG      GLN  34   8.022   8.438   3.413
  252    HG3  GLN  34           1HG      GLN  34   7.916  10.075   4.059
  253   HE21  GLN  34          1HE2      GLN  34   9.935   8.751   2.373
  254   HE22  GLN  34          2HE2      GLN  34  11.442   8.962   3.196
  255    H    THR  35           H        THR  35   6.414   5.370   6.049
  256    HA   THR  35           HA       THR  35   5.776   5.857   8.869
  257    HB   THR  35           HB       THR  35   3.843   4.150   8.120
  258    HG1  THR  35           1HG      THR  35   4.484   5.604   5.743
  259   HG21  THR  35          3HG2      THR  35   3.931   7.125   7.597
  260   HG22  THR  35          1HG2      THR  35   3.434   6.323   9.089
  261   HG23  THR  35          2HG2      THR  35   2.459   6.158   7.629
  262    H    LYS  36           H        LYS  36   6.659   3.238   6.637
  263    HA   LYS  36           HA       LYS  36   7.026   1.490   8.980
  264    HB2  LYS  36           2HB      LYS  36   6.630   0.802   6.067
  265    HB3  LYS  36           1HB      LYS  36   6.972  -0.380   7.325
  266    HG2  LYS  36           2HG      LYS  36   4.911   0.208   8.467
  267    HG3  LYS  36           1HG      LYS  36   4.578   1.444   7.258
  268    HD2  LYS  36           2HD      LYS  36   4.341  -0.209   5.540
  269    HD3  LYS  36           1HD      LYS  36   4.870  -1.489   6.633
  270    HE2  LYS  36           2HE      LYS  36   2.480  -1.594   6.426
  271    HE3  LYS  36           1HE      LYS  36   2.882  -1.032   8.049
  272    HZ1  LYS  36           3HZ      LYS  36   2.242   1.152   7.521
  273    HZ2  LYS  36           1HZ      LYS  36   1.034   0.181   6.835
  274    HZ3  LYS  36           2HZ      LYS  36   2.236   0.852   5.854
  275    H    ASN  37           H        ASN  37   8.828   3.583   7.656
  276    HA   ASN  37           HA       ASN  37  11.046   3.950   7.464
  277    HB2  ASN  37           2HB      ASN  37  11.073   2.277   9.446
  278    HB3  ASN  37           1HB      ASN  37  11.648   1.112   8.261
  279   HD21  ASN  37          1HD2      ASN  37  13.496   1.088   9.769
  280   HD22  ASN  37          2HD2      ASN  37  14.760   2.252   9.541
  281    H    TYR  38           H        TYR  38  13.116   2.977   6.356
  282    HA   TYR  38           HA       TYR  38  12.282   2.312   3.654
  283    HB2  TYR  38           2HB      TYR  38  15.015   2.912   4.801
  284    HB3  TYR  38           1HB      TYR  38  14.666   2.679   3.094
  285    HD1  TYR  38           1HD      TYR  38  13.452   4.377   1.833
  286    HD2  TYR  38           2HD      TYR  38  14.424   4.960   5.932
  287    HE1  TYR  38           1HE      TYR  38  13.011   6.783   1.593
  288    HE2  TYR  38           2HE      TYR  38  13.980   7.367   5.706
  289    HH   TYR  38           HH       TYR  38  13.835   9.055   4.077
  290    H    ASP  39           H        ASP  39  12.159   0.246   5.825
  291    HA   ASP  39           HA       ASP  39  14.292  -1.593   5.224
  292    HB2  ASP  39           2HB      ASP  39  13.113  -1.517   7.451
  293    HB3  ASP  39           1HB      ASP  39  11.708  -2.233   6.660
  294    H    ILE  40           H        ILE  40  14.397  -2.540   3.345
  295    HA   ILE  40           HA       ILE  40  12.327  -2.804   1.490
  296    HB   ILE  40           HB       ILE  40  14.827  -4.491   1.670
  297   HG12  ILE  40          2HG1      ILE  40  14.376  -1.907   0.162
  298   HG13  ILE  40          1HG1      ILE  40  15.245  -2.024   1.688
  299   HG21  ILE  40          1HG2      ILE  40  13.184  -5.412   0.139
  300   HG22  ILE  40          2HG2      ILE  40  14.544  -4.738  -0.760
  301   HG23  ILE  40          3HG2      ILE  40  13.025  -3.846  -0.659
  302   HD11  ILE  40          3HD1      ILE  40  16.037  -3.320  -0.911
  303   HD12  ILE  40          1HD1      ILE  40  16.897  -3.482   0.619
  304   HD13  ILE  40          2HD1      ILE  40  16.790  -1.910  -0.165
  305    H    GLY  41           H        GLY  41  13.590  -5.113   3.868
  306    HA2  GLY  41           2HA      GLY  41  12.125  -7.356   3.042
  307    HA3  GLY  41           1HA      GLY  41  12.725  -7.084   4.669
  308    H    ALA  42           H        ALA  42  11.323  -4.955   5.547
  309    HA   ALA  42           HA       ALA  42   8.827  -6.073   6.218
  310    HB1  ALA  42           1HB      ALA  42   8.376  -3.975   7.346
  311    HB2  ALA  42           2HB      ALA  42   9.704  -3.201   6.483
  312    HB3  ALA  42           3HB      ALA  42  10.039  -4.482   7.647
  313    H    ALA  43           H        ALA  43   9.686  -3.443   3.986
  314    HA   ALA  43           HA       ALA  43   7.079  -2.747   3.231
  315    HB1  ALA  43           1HB      ALA  43   9.599  -2.550   1.582
  316    HB2  ALA  43           2HB      ALA  43   9.042  -1.358   2.757
  317    HB3  ALA  43           3HB      ALA  43   8.097  -1.668   1.302
  318    H    LEU  44           H        LEU  44   9.305  -5.143   1.881
  319    HA   LEU  44           HA       LEU  44   7.626  -5.845  -0.309
  320    HB2  LEU  44           2HB      LEU  44  10.201  -6.259   0.200
  321    HB3  LEU  44           1HB      LEU  44   9.589  -7.779   0.818
  322    HG   LEU  44           HG       LEU  44   8.522  -8.176  -1.406
  323   HD11  LEU  44          1HD1      LEU  44   9.485  -6.853  -3.304
  324   HD12  LEU  44          2HD1      LEU  44  10.054  -5.688  -2.106
  325   HD13  LEU  44          3HD1      LEU  44   8.328  -5.991  -2.292
  326   HD21  LEU  44          3HD2      LEU  44  11.511  -7.781  -1.452
  327   HD22  LEU  44          1HD2      LEU  44  10.575  -8.859  -2.490
  328   HD23  LEU  44          2HD2      LEU  44  10.675  -9.173  -0.757
  329    H    ASP  45           H        ASP  45   7.864  -6.886   3.003
  330    HA   ASP  45           HA       ASP  45   6.262  -9.258   2.636
  331    HB2  ASP  45           2HB      ASP  45   8.000  -9.104   4.396
  332    HB3  ASP  45           1HB      ASP  45   7.070  -7.832   5.182
  333    H    THR  46           H        THR  46   5.703  -5.931   3.169
  334    HA   THR  46           HA       THR  46   3.336  -5.889   4.629
  335    HB   THR  46           HB       THR  46   4.204  -4.010   2.423
  336    HG1  THR  46           1HG      THR  46   5.567  -4.394   4.430
  337   HG21  THR  46          3HG2      THR  46   2.792  -2.362   3.715
  338   HG22  THR  46          1HG2      THR  46   2.113  -3.743   4.578
  339   HG23  THR  46          2HG2      THR  46   1.896  -3.598   2.833
  340    H    ILE  47           H        ILE  47   3.836  -6.491   1.182
  341    HA   ILE  47           HA       ILE  47   0.925  -6.826   0.912
  342    HB   ILE  47           HB       ILE  47   1.127  -6.452  -1.462
  343   HG12  ILE  47          2HG1      ILE  47   3.544  -7.381  -1.542
  344   HG13  ILE  47          1HG1      ILE  47   3.109  -6.083  -2.641
  345   HG21  ILE  47          1HG2      ILE  47   2.521  -4.296   0.117
  346   HG22  ILE  47          2HG2      ILE  47   0.781  -4.531  -0.006
  347   HG23  ILE  47          3HG2      ILE  47   1.712  -4.081  -1.435
  348   HD11  ILE  47          3HD1      ILE  47   5.276  -5.640  -1.770
  349   HD12  ILE  47          1HD1      ILE  47   4.718  -5.857  -0.112
  350   HD13  ILE  47          2HD1      ILE  47   4.157  -4.479  -1.056
  351    H    GLN  48           H        GLN  48   3.274  -8.720   1.672
  352    HA   GLN  48           HA       GLN  48   3.598 -10.960   1.618
  353    HB2  GLN  48           2HB      GLN  48   0.922 -10.665   0.576
  354    HB3  GLN  48           1HB      GLN  48   1.734 -12.049  -0.140
  355    HG2  GLN  48           2HG      GLN  48   1.258 -11.514   2.775
  356    HG3  GLN  48           1HG      GLN  48   0.548 -12.786   1.787
  357   HE21  GLN  48          1HE2      GLN  48   3.315 -11.748   3.569
  358   HE22  GLN  48          2HE2      GLN  48   4.204 -13.228   3.462
  359    H    TYR  49           H        TYR  49   3.171  -9.388  -1.489
  360    HA   TYR  49           HA       TYR  49   4.362 -11.446  -3.041
  361    HB2  TYR  49           2HB      TYR  49   4.070  -8.494  -3.644
  362    HB3  TYR  49           1HB      TYR  49   4.512  -9.730  -4.816
  363    HD1  TYR  49           1HD      TYR  49   2.782 -11.758  -4.924
  364    HD2  TYR  49           2HD      TYR  49   1.864  -7.834  -3.564
  365    HE1  TYR  49           1HE      TYR  49   0.406 -12.145  -5.417
  366    HE2  TYR  49           2HE      TYR  49  -0.514  -8.212  -4.055
  367    HH   TYR  49           HH       TYR  49  -2.005  -9.578  -4.967
  368    H    SER  50           H        SER  50   6.157 -11.850  -1.557
  369    HA   SER  50           HA       SER  50   8.387  -9.975  -1.867
  370    HB2  SER  50           2HB      SER  50   8.332 -12.382  -0.052
  371    HB3  SER  50           1HB      SER  50   9.372 -10.962   0.056
  372    HG   SER  50           HG       SER  50   7.007  -9.969   0.216
  373    H    LYS  51           H        LYS  51   7.157 -12.626  -3.361
  374    HA   LYS  51           HA       LYS  51   9.829 -13.536  -4.198
  375    HB2  LYS  51           2HB      LYS  51   7.319 -15.200  -3.959
  376    HB3  LYS  51           1HB      LYS  51   8.853 -15.771  -4.596
  377    HG2  LYS  51           2HG      LYS  51   9.877 -15.233  -2.374
  378    HG3  LYS  51           1HG      LYS  51   8.248 -14.908  -1.781
  379    HD2  LYS  51           2HD      LYS  51   8.646 -17.128  -1.163
  380    HD3  LYS  51           1HD      LYS  51   7.675 -17.258  -2.630
  381    HE2  LYS  51           2HE      LYS  51  10.071 -17.283  -3.768
  382    HE3  LYS  51           1HE      LYS  51  10.545 -17.889  -2.184
  383    HZ1  LYS  51           3HZ      LYS  51   8.532 -19.080  -4.010
  384    HZ2  LYS  51           1HZ      LYS  51   8.828 -19.629  -2.435
  385    HZ3  LYS  51           2HZ      LYS  51  10.043 -19.724  -3.603
  386    H    HIS  52           H        HIS  52   6.439 -13.747  -5.302
  387    HA   HIS  52           HA       HIS  52   7.154 -12.494  -7.812
  388    HB2  HIS  52           2HB      HIS  52   7.473 -15.111  -7.896
  389    HB3  HIS  52           1HB      HIS  52   5.719 -15.118  -8.015
  390    HD1  HIS  52           1HD      HIS  52   5.159 -12.864  -9.941
  391    HD2  HIS  52           2HD      HIS  52   8.341 -15.508 -10.424
  392    HE1  HIS  52           1HE      HIS  52   5.738 -12.796 -12.393
  393    HE2  HIS  52           2HE      HIS  52   7.757 -14.280 -12.630
  394    H1   GLY   1           1HT      GLY   1 -18.000  19.281   1.907
  395    H2   GLY   1           2HT      GLY   1 -16.867  18.343   2.735
  396    H3   GLY   1           3HT      GLY   1 -17.411  19.797   3.405
  397    HA2  GLY   1           1HA      GLY   1 -18.420  17.833   4.452
  398    HA3  GLY   1           2HA      GLY   1 -19.593  18.927   3.731
  399    H    SER   2           H        SER   2 -20.872  16.848   3.883
  400    HA   SER   2           HA       SER   2 -20.328  15.091   1.585
  401    HB2  SER   2           2HB      SER   2 -22.381  14.387   3.635
  402    HB3  SER   2           1HB      SER   2 -21.275  13.336   2.748
  403    HG   SER   2           HG       SER   2 -20.933  14.667   5.147
  404    HA   PRO   3           HA       PRO   3 -23.909  17.479   0.116
  405    HB2  PRO   3           2HB      PRO   3 -23.333  17.324  -2.509
  406    HB3  PRO   3           1HB      PRO   3 -22.492  18.448  -1.435
  407    HG2  PRO   3           2HG      PRO   3 -21.593  15.801  -2.493
  408    HG3  PRO   3           1HG      PRO   3 -20.668  17.295  -2.281
  409    HD2  PRO   3           2HD      PRO   3 -20.605  15.173  -0.535
  410    HD3  PRO   3           1HD      PRO   3 -20.212  16.846  -0.090
  411    HA   PRO   4           HA       PRO   4 -26.580  14.061  -0.798
  412    HB2  PRO   4           2HB      PRO   4 -28.573  15.362  -2.115
  413    HB3  PRO   4           1HB      PRO   4 -28.350  15.454  -0.364
  414    HG2  PRO   4           2HG      PRO   4 -27.512  17.392  -2.486
  415    HG3  PRO   4           1HG      PRO   4 -28.259  17.712  -0.910
  416    HD2  PRO   4           2HD      PRO   4 -25.607  18.010  -1.332
  417    HD3  PRO   4           1HD      PRO   4 -26.260  17.464   0.226
  418    H    GLU   5           H        GLU   5 -24.921  15.804  -3.136
  419    HA   GLU   5           HA       GLU   5 -26.021  14.608  -5.490
  420    HB2  GLU   5           2HB      GLU   5 -23.298  15.874  -5.168
  421    HB3  GLU   5           1HB      GLU   5 -24.207  15.667  -6.657
  422    HG2  GLU   5           2HG      GLU   5 -24.815  17.526  -4.373
  423    HG3  GLU   5           1HG      GLU   5 -24.340  17.952  -6.016
  424    H    ALA   6           H        ALA   6 -23.745  13.722  -3.090
  425    HA   ALA   6           HA       ALA   6 -22.481  11.680  -4.728
  426    HB1  ALA   6           1HB      ALA   6 -22.099  12.436  -1.830
  427    HB2  ALA   6           2HB      ALA   6 -21.071  12.897  -3.187
  428    HB3  ALA   6           3HB      ALA   6 -21.168  11.207  -2.688
  429    H    ASP   7           H        ASP   7 -22.591   9.444  -4.209
  430    HA   ASP   7           HA       ASP   7 -25.196   8.635  -3.290
  431    HB2  ASP   7           2HB      ASP   7 -24.037   7.603  -5.265
  432    HB3  ASP   7           1HB      ASP   7 -22.899   6.871  -4.140
  433    HA   PRO   8           HA       PRO   8 -24.010   8.014   0.941
  434    HB2  PRO   8           2HB      PRO   8 -26.085   6.388   1.658
  435    HB3  PRO   8           1HB      PRO   8 -26.224   8.143   1.495
  436    HG2  PRO   8           2HG      PRO   8 -26.966   5.993  -0.454
  437    HG3  PRO   8           1HG      PRO   8 -27.865   7.456  -0.005
  438    HD2  PRO   8           2HD      PRO   8 -26.439   7.321  -2.277
  439    HD3  PRO   8           1HD      PRO   8 -26.547   8.820  -1.333
  440    H    ARG   9           H        ARG   9 -24.444   5.428  -1.336
  441    HA   ARG   9           HA       ARG   9 -23.298   3.471   0.512
  442    HB2  ARG   9           2HB      ARG   9 -24.283   3.146  -2.332
  443    HB3  ARG   9           1HB      ARG   9 -23.747   1.842  -1.285
  444    HG2  ARG   9           2HG      ARG   9 -25.657   1.836  -0.070
  445    HG3  ARG   9           1HG      ARG   9 -25.899   3.573  -0.246
  446    HD2  ARG   9           2HD      ARG   9 -26.263   1.624  -2.504
  447    HD3  ARG   9           1HD      ARG   9 -27.570   2.112  -1.431
  448    HE   ARG   9           HE       ARG   9 -26.053   4.062  -3.045
  449   HH11  ARG   9          1HH1      ARG   9 -29.093   2.745  -1.870
  450   HH12  ARG   9          2HH1      ARG   9 -30.065   3.912  -2.700
  451   HH21  ARG   9          1HH2      ARG   9 -27.325   5.580  -4.144
  452   HH22  ARG   9          2HH2      ARG   9 -29.060   5.531  -3.996
  453    H    LEU  10           H        LEU  10 -22.571   5.209  -2.461
  454    HA   LEU  10           HA       LEU  10 -20.148   3.901  -3.068
  455    HB2  LEU  10           2HB      LEU  10 -21.417   5.313  -4.655
  456    HB3  LEU  10           1HB      LEU  10 -20.975   6.730  -3.719
  457    HG   LEU  10           HG       LEU  10 -18.549   6.110  -4.206
  458   HD11  LEU  10          1HD1      LEU  10 -18.163   4.766  -6.197
  459   HD12  LEU  10          2HD1      LEU  10 -19.886   4.407  -6.304
  460   HD13  LEU  10          3HD1      LEU  10 -18.944   3.815  -4.935
  461   HD21  LEU  10          3HD2      LEU  10 -20.384   6.933  -6.452
  462   HD22  LEU  10          1HD2      LEU  10 -18.635   7.156  -6.431
  463   HD23  LEU  10          2HD2      LEU  10 -19.643   7.992  -5.251
  464    H    ILE  11           H        ILE  11 -20.856   6.799  -1.148
  465    HA   ILE  11           HA       ILE  11 -18.118   7.417  -0.639
  466    HB   ILE  11           HB       ILE  11 -20.013   9.057  -0.495
  467   HG12  ILE  11          2HG1      ILE  11 -18.408   8.919   2.059
  468   HG13  ILE  11          1HG1      ILE  11 -17.708   9.380   0.511
  469   HG21  ILE  11          1HG2      ILE  11 -21.271   9.181   1.612
  470   HG22  ILE  11          2HG2      ILE  11 -20.543   7.658   2.122
  471   HG23  ILE  11          3HG2      ILE  11 -21.612   7.698   0.719
  472   HD11  ILE  11          3HD1      ILE  11 -19.159  11.297   0.379
  473   HD12  ILE  11          1HD1      ILE  11 -18.304  11.304   1.923
  474   HD13  ILE  11          2HD1      ILE  11 -19.994  10.804   1.854
  475    H    GLU  12           H        GLU  12 -20.250   5.096   0.619
  476    HA   GLU  12           HA       GLU  12 -19.160   4.893   3.245
  477    HB2  GLU  12           2HB      GLU  12 -21.047   3.273   1.606
  478    HB3  GLU  12           1HB      GLU  12 -20.302   2.524   3.014
  479    HG2  GLU  12           2HG      GLU  12 -21.925   5.059   3.009
  480    HG3  GLU  12           1HG      GLU  12 -22.464   3.475   3.558
  481    H    SER  13           H        SER  13 -18.011   3.959   0.208
  482    HA   SER  13           HA       SER  13 -16.717   1.556   0.703
  483    HB2  SER  13           2HB      SER  13 -15.604   3.831  -0.956
  484    HB3  SER  13           1HB      SER  13 -15.261   2.111  -1.140
  485    HG   SER  13           HG       SER  13 -17.493   3.582  -1.923
  486    H    LEU  14           H        LEU  14 -15.883   4.804   1.691
  487    HA   LEU  14           HA       LEU  14 -13.218   4.218   2.528
  488    HB2  LEU  14           2HB      LEU  14 -15.103   6.480   3.201
  489    HB3  LEU  14           1HB      LEU  14 -13.440   6.404   3.751
  490    HG   LEU  14           HG       LEU  14 -14.037   6.256   0.820
  491   HD11  LEU  14          1HD1      LEU  14 -13.808   8.706   0.712
  492   HD12  LEU  14          2HD1      LEU  14 -13.861   8.769   2.474
  493   HD13  LEU  14          3HD1      LEU  14 -15.264   8.202   1.569
  494   HD21  LEU  14          3HD2      LEU  14 -11.768   5.786   1.547
  495   HD22  LEU  14          1HD2      LEU  14 -11.724   7.296   2.457
  496   HD23  LEU  14          2HD2      LEU  14 -11.816   7.330   0.698
  497    H    SER  15           H        SER  15 -16.358   4.380   4.121
  498    HA   SER  15           HA       SER  15 -15.389   3.910   6.754
  499    HB2  SER  15           2HB      SER  15 -18.168   3.126   6.162
  500    HB3  SER  15           1HB      SER  15 -17.548   4.268   7.355
  501    HG   SER  15           HG       SER  15 -18.834   5.065   5.419
  502    H    GLN  16           H        GLN  16 -16.563   1.889   4.142
  503    HA   GLN  16           HA       GLN  16 -16.880  -0.528   5.521
  504    HB2  GLN  16           2HB      GLN  16 -17.629  -0.028   3.180
  505    HB3  GLN  16           1HB      GLN  16 -15.958  -0.193   2.665
  506    HG2  GLN  16           2HG      GLN  16 -17.050  -2.235   2.179
  507    HG3  GLN  16           1HG      GLN  16 -16.003  -2.527   3.566
  508   HE21  GLN  16          1HE2      GLN  16 -16.906  -3.020   5.542
  509   HE22  GLN  16          2HE2      GLN  16 -18.590  -3.367   5.742
  510    H    MET  17           H        MET  17 -14.056   0.846   3.876
  511    HA   MET  17           HA       MET  17 -12.323  -1.336   4.326
  512    HB2  MET  17           2HB      MET  17 -11.608   1.585   3.996
  513    HB3  MET  17           1HB      MET  17 -10.496   0.234   3.838
  514    HG2  MET  17           2HG      MET  17 -12.848   0.845   2.068
  515    HG3  MET  17           1HG      MET  17 -11.143   1.027   1.667
  516    HE1  MET  17           3HE      MET  17  -9.615  -0.800   0.849
  517    HE2  MET  17           1HE      MET  17  -9.887  -2.528   1.068
  518    HE3  MET  17           2HE      MET  17  -9.616  -1.494   2.470
  519    H    LEU  18           H        LEU  18 -13.092   1.523   6.220
  520    HA   LEU  18           HA       LEU  18 -11.106   1.223   8.193
  521    HB2  LEU  18           2HB      LEU  18 -12.448   3.277   7.815
  522    HB3  LEU  18           1HB      LEU  18 -13.855   2.451   8.455
  523    HG   LEU  18           HG       LEU  18 -12.668   2.218  10.636
  524   HD11  LEU  18          1HD1      LEU  18 -10.642   4.006   9.300
  525   HD12  LEU  18          2HD1      LEU  18 -10.378   2.356   9.865
  526   HD13  LEU  18          3HD1      LEU  18 -10.701   3.644  11.025
  527   HD21  LEU  18          3HD2      LEU  18 -14.267   4.030  10.195
  528   HD22  LEU  18          1HD2      LEU  18 -12.940   5.046   9.636
  529   HD23  LEU  18          2HD2      LEU  18 -12.995   4.513  11.316
  530    H    SER  19           H        SER  19 -14.469   0.093   8.030
  531    HA   SER  19           HA       SER  19 -14.427  -1.176  10.574
  532    HB2  SER  19           2HB      SER  19 -16.499  -0.434   9.357
  533    HB3  SER  19           1HB      SER  19 -16.260  -1.779   8.243
  534    HG   SER  19           HG       SER  19 -16.265  -3.120  10.237
  535    H    MET  20           H        MET  20 -13.244  -2.043   7.482
  536    HA   MET  20           HA       MET  20 -13.271  -4.883   7.948
  537    HB2  MET  20           2HB      MET  20 -13.369  -3.682   5.671
  538    HB3  MET  20           1HB      MET  20 -11.636  -3.463   5.855
  539    HG2  MET  20           2HG      MET  20 -11.220  -5.767   5.755
  540    HG3  MET  20           1HG      MET  20 -12.912  -6.171   6.037
  541    HE1  MET  20           3HE      MET  20 -14.275  -3.953   3.811
  542    HE2  MET  20           1HE      MET  20 -14.799  -5.510   4.451
  543    HE3  MET  20           2HE      MET  20 -14.632  -5.281   2.710
  544    H    GLY  21           H        GLY  21 -11.367  -2.306   8.945
  545    HA2  GLY  21           2HA      GLY  21  -9.662  -2.612  10.583
  546    HA3  GLY  21           1HA      GLY  21  -9.300  -4.174   9.865
  547    H    PHE  22           H        PHE  22  -9.762  -1.753   7.544
  548    HA   PHE  22           HA       PHE  22  -6.871  -1.663   7.078
  549    HB2  PHE  22           2HB      PHE  22  -8.867  -2.212   5.344
  550    HB3  PHE  22           1HB      PHE  22  -8.740  -0.473   5.106
  551    HD1  PHE  22           2HD      PHE  22  -5.836  -0.066   5.401
  552    HD2  PHE  22           1HD      PHE  22  -8.002  -3.140   3.409
  553    HE1  PHE  22           2HE      PHE  22  -3.930  -0.429   3.888
  554    HE2  PHE  22           1HE      PHE  22  -6.098  -3.506   1.897
  555    HZ   PHE  22           HZ       PHE  22  -4.058  -2.146   2.138
  556    H    SER  23           H        SER  23  -5.754   0.090   7.570
  557    HA   SER  23           HA       SER  23  -6.939   2.730   7.341
  558    HB2  SER  23           2HB      SER  23  -5.712   1.804   9.955
  559    HB3  SER  23           1HB      SER  23  -6.358   3.409   9.610
  560    HG   SER  23           HG       SER  23  -8.296   1.785   9.021
  561    H    ASP  24           H        ASP  24  -5.387   4.390   7.136
  562    HA   ASP  24           HA       ASP  24  -2.662   3.380   6.687
  563    HB2  ASP  24           2HB      ASP  24  -2.451   5.465   5.214
  564    HB3  ASP  24           1HB      ASP  24  -3.417   4.132   4.604
  565    H    GLU  25           H        GLU  25  -0.947   4.346   7.619
  566    HA   GLU  25           HA       GLU  25  -1.506   6.177   9.804
  567    HB2  GLU  25           2HB      GLU  25   1.292   5.408   9.186
  568    HB3  GLU  25           1HB      GLU  25   0.458   5.474  10.731
  569    HG2  GLU  25           2HG      GLU  25   0.739   3.231  10.545
  570    HG3  GLU  25           1HG      GLU  25  -0.822   3.399   9.747
  571    H    GLY  26           H        GLY  26  -0.260   6.290   6.598
  572    HA2  GLY  26           2HA      GLY  26   0.532   9.098   7.048
  573    HA3  GLY  26           1HA      GLY  26   1.407   8.039   5.952
  574    H    GLY  27           H        GLY  27  -2.034   7.783   6.091
  575    HA2  GLY  27           2HA      GLY  27  -3.677   8.267   4.562
  576    HA3  GLY  27           1HA      GLY  27  -2.769   9.728   4.208
  577    H    TRP  28           H        TRP  28  -1.842   6.339   3.737
  578    HA   TRP  28           HA       TRP  28  -1.276   6.981   0.952
  579    HB2  TRP  28           2HB      TRP  28   0.153   5.063   0.900
  580    HB3  TRP  28           1HB      TRP  28   0.500   5.940   2.377
  581    HD1  TRP  28           HD       TRP  28   0.095   4.699   4.658
  582    HE1  TRP  28           1HE      TRP  28  -0.442   2.255   5.266
  583    HE3  TRP  28           3HE      TRP  28  -1.218   2.986   0.032
  584    HZ2  TRP  28           2HZ      TRP  28  -1.295  -0.102   3.942
  585    HZ3  TRP  28           3HZ      TRP  28  -1.877   0.630  -0.215
  586    HH2  TRP  28           HH       TRP  28  -1.919  -0.879   1.698
  587    H    LEU  29           H        LEU  29  -3.448   5.104   2.900
  588    HA   LEU  29           HA       LEU  29  -4.323   3.367   0.788
  589    HB2  LEU  29           2HB      LEU  29  -4.634   2.552   2.992
  590    HB3  LEU  29           1HB      LEU  29  -5.403   4.039   3.516
  591    HG   LEU  29           HG       LEU  29  -7.290   3.441   1.885
  592   HD11  LEU  29          1HD1      LEU  29  -6.076   1.726   0.631
  593   HD12  LEU  29          2HD1      LEU  29  -7.539   1.073   1.370
  594   HD13  LEU  29          3HD1      LEU  29  -5.964   0.738   2.088
  595   HD21  LEU  29          3HD2      LEU  29  -6.804   1.690   4.294
  596   HD22  LEU  29          1HD2      LEU  29  -8.363   1.987   3.527
  597   HD23  LEU  29          2HD2      LEU  29  -7.502   3.310   4.316
  598    H    THR  30           H        THR  30  -5.356   6.398   2.217
  599    HA   THR  30           HA       THR  30  -7.781   6.694   0.849
  600    HB   THR  30           HB       THR  30  -6.432   8.148   2.741
  601    HG1  THR  30           1HG      THR  30  -8.735   8.007   2.332
  602   HG21  THR  30          3HG2      THR  30  -6.536   9.858   0.250
  603   HG22  THR  30          1HG2      THR  30  -5.076   9.329   1.089
  604   HG23  THR  30          2HG2      THR  30  -6.195  10.437   1.881
  605    H    ARG  31           H        ARG  31  -4.493   7.111  -0.181
  606    HA   ARG  31           HA       ARG  31  -5.164   8.571  -2.591
  607    HB2  ARG  31           2HB      ARG  31  -2.567   7.252  -1.765
  608    HB3  ARG  31           1HB      ARG  31  -2.775   8.369  -3.108
  609    HG2  ARG  31           2HG      ARG  31  -3.544   9.256  -0.374
  610    HG3  ARG  31           1HG      ARG  31  -1.834   9.181  -0.805
  611    HD2  ARG  31           2HD      ARG  31  -3.771  10.536  -2.630
  612    HD3  ARG  31           1HD      ARG  31  -3.188  11.378  -1.195
  613    HE   ARG  31           HE       ARG  31  -1.415  10.327  -3.316
  614   HH11  ARG  31          1HH1      ARG  31  -2.311  12.832  -1.031
  615   HH12  ARG  31          2HH1      ARG  31  -0.899  13.786  -1.338
  616   HH21  ARG  31          1HH2      ARG  31   0.426  11.570  -3.731
  617   HH22  ARG  31          2HH2      ARG  31   0.674  13.069  -2.892
  618    H    LEU  32           H        LEU  32  -4.400   5.307  -1.591
  619    HA   LEU  32           HA       LEU  32  -4.046   4.103  -4.096
  620    HB2  LEU  32           2HB      LEU  32  -3.582   3.160  -1.773
  621    HB3  LEU  32           1HB      LEU  32  -5.292   2.787  -1.688
  622    HG   LEU  32           HG       LEU  32  -4.697   1.585  -4.017
  623   HD11  LEU  32          1HD1      LEU  32  -2.353   2.159  -3.966
  624   HD12  LEU  32          2HD1      LEU  32  -2.545   0.420  -3.746
  625   HD13  LEU  32          3HD1      LEU  32  -2.185   1.448  -2.360
  626   HD21  LEU  32          3HD2      LEU  32  -4.564  -0.506  -2.749
  627   HD22  LEU  32          1HD2      LEU  32  -5.832   0.554  -2.130
  628   HD23  LEU  32          2HD2      LEU  32  -4.302   0.415  -1.267
  629    H    LEU  33           H        LEU  33  -6.936   4.835  -2.241
  630    HA   LEU  33           HA       LEU  33  -8.732   3.344  -3.879
  631    HB2  LEU  33           2HB      LEU  33  -9.204   5.578  -1.908
  632    HB3  LEU  33           1HB      LEU  33 -10.486   4.670  -2.689
  633    HG   LEU  33           HG       LEU  33  -8.376   3.419  -0.935
  634   HD11  LEU  33          1HD1      LEU  33 -10.126   3.314   0.780
  635   HD12  LEU  33          2HD1      LEU  33 -11.184   4.270  -0.259
  636   HD13  LEU  33          3HD1      LEU  33  -9.695   4.973   0.370
  637   HD21  LEU  33          3HD2      LEU  33  -9.421   1.901  -2.548
  638   HD22  LEU  33          1HD2      LEU  33 -11.014   2.373  -1.955
  639   HD23  LEU  33          2HD2      LEU  33  -9.895   1.519  -0.893
  640    H    GLN  34           H        GLN  34  -7.055   6.176  -4.474
  641    HA   GLN  34           HA       GLN  34  -9.153   7.292  -6.176
  642    HB2  GLN  34           2HB      GLN  34  -6.371   8.385  -5.722
  643    HB3  GLN  34           1HB      GLN  34  -7.732   9.219  -6.452
  644    HG2  GLN  34           2HG      GLN  34  -7.398   8.419  -3.578
  645    HG3  GLN  34           1HG      GLN  34  -7.451  10.050  -4.241
  646   HE21  GLN  34          1HE2      GLN  34  -9.074   8.614  -2.213
  647   HE22  GLN  34          2HE2      GLN  34 -10.723   8.802  -2.720
  648    H    THR  35           H        THR  35  -5.843   6.034  -6.375
  649    HA   THR  35           HA       THR  35  -5.763   6.203  -9.238
  650    HB   THR  35           HB       THR  35  -3.651   4.716  -8.832
  651    HG1  THR  35           1HG      THR  35  -2.994   4.546  -6.765
  652   HG21  THR  35          3HG2      THR  35  -3.964   7.565  -7.890
  653   HG22  THR  35          1HG2      THR  35  -3.422   7.003  -9.473
  654   HG23  THR  35          2HG2      THR  35  -2.398   6.772  -8.054
  655    H    LYS  36           H        LYS  36  -6.261   3.602  -6.879
  656    HA   LYS  36           HA       LYS  36  -6.664   1.728  -9.102
  657    HB2  LYS  36           2HB      LYS  36  -6.616   0.937  -6.207
  658    HB3  LYS  36           1HB      LYS  36  -6.183  -0.016  -7.622
  659    HG2  LYS  36           2HG      LYS  36  -4.265   1.718  -7.884
  660    HG3  LYS  36           1HG      LYS  36  -4.594   2.072  -6.189
  661    HD2  LYS  36           2HD      LYS  36  -3.076   0.429  -5.858
  662    HD3  LYS  36           1HD      LYS  36  -4.486  -0.609  -6.083
  663    HE2  LYS  36           2HE      LYS  36  -2.754  -1.478  -7.456
  664    HE3  LYS  36           1HE      LYS  36  -3.921  -0.695  -8.521
  665    HZ1  LYS  36           3HZ      LYS  36  -2.086   0.252  -9.360
  666    HZ2  LYS  36           1HZ      LYS  36  -1.164  -0.006  -7.966
  667    HZ3  LYS  36           2HZ      LYS  36  -2.218   1.319  -8.047
  668    H    ASN  37           H        ASN  37  -8.487   3.850  -7.670
  669    HA   ASN  37           HA       ASN  37 -10.714   4.183  -7.485
  670    HB2  ASN  37           2HB      ASN  37 -10.671   2.523  -9.515
  671    HB3  ASN  37           1HB      ASN  37 -11.348   1.385  -8.354
  672   HD21  ASN  37          1HD2      ASN  37 -11.888   4.334 -10.123
  673   HD22  ASN  37          2HD2      ASN  37 -13.594   4.415  -9.842
  674    H    TYR  38           H        TYR  38 -12.795   3.004  -6.476
  675    HA   TYR  38           HA       TYR  38 -11.938   2.266  -3.785
  676    HB2  TYR  38           2HB      TYR  38 -14.587   3.131  -4.949
  677    HB3  TYR  38           1HB      TYR  38 -14.400   2.613  -3.280
  678    HD1  TYR  38           2HD      TYR  38 -13.569   5.227  -5.727
  679    HD2  TYR  38           1HD      TYR  38 -13.374   4.041  -1.648
  680    HE1  TYR  38           2HE      TYR  38 -12.968   7.526  -5.091
  681    HE2  TYR  38           1HE      TYR  38 -12.778   6.335  -0.998
  682    HH   TYR  38           HH       TYR  38 -13.222   8.953  -2.933
  683    H    ASP  39           H        ASP  39 -11.667   0.266  -5.846
  684    HA   ASP  39           HA       ASP  39 -13.891  -1.560  -5.444
  685    HB2  ASP  39           2HB      ASP  39 -12.657  -1.338  -7.655
  686    HB3  ASP  39           1HB      ASP  39 -11.295  -2.144  -6.880
  687    H    ILE  40           H        ILE  40 -13.979  -2.495  -3.532
  688    HA   ILE  40           HA       ILE  40 -11.912  -2.856  -1.710
  689    HB   ILE  40           HB       ILE  40 -14.440  -4.492  -1.935
  690   HG12  ILE  40          2HG1      ILE  40 -13.955  -1.996  -0.303
  691   HG13  ILE  40          1HG1      ILE  40 -14.736  -1.985  -1.879
  692   HG21  ILE  40          1HG2      ILE  40 -12.905  -5.536  -0.421
  693   HG22  ILE  40          2HG2      ILE  40 -14.156  -4.731   0.526
  694   HG23  ILE  40          3HG2      ILE  40 -12.563  -3.993   0.366
  695   HD11  ILE  40          3HD1      ILE  40 -15.733  -3.431   0.564
  696   HD12  ILE  40          1HD1      ILE  40 -16.523  -3.385  -1.011
  697   HD13  ILE  40          2HD1      ILE  40 -16.357  -1.905  -0.066
  698    H    GLY  41           H        GLY  41 -13.267  -5.178  -4.029
  699    HA2  GLY  41           2HA      GLY  41 -11.797  -7.428  -3.268
  700    HA3  GLY  41           1HA      GLY  41 -12.437  -7.143  -4.880
  701    H    ALA  42           H        ALA  42 -11.043  -5.077  -5.836
  702    HA   ALA  42           HA       ALA  42  -8.562  -6.225  -6.531
  703    HB1  ALA  42           1HB      ALA  42  -8.119  -4.130  -7.692
  704    HB2  ALA  42           2HB      ALA  42  -9.457  -3.361  -6.841
  705    HB3  ALA  42           3HB      ALA  42  -9.774  -4.665  -7.984
  706    H    ALA  43           H        ALA  43  -9.450  -3.720  -4.214
  707    HA   ALA  43           HA       ALA  43  -6.871  -2.848  -3.536
  708    HB1  ALA  43           1HB      ALA  43  -9.364  -2.914  -1.839
  709    HB2  ALA  43           2HB      ALA  43  -8.854  -1.604  -2.903
  710    HB3  ALA  43           3HB      ALA  43  -7.903  -1.999  -1.470
  711    H    LEU  44           H        LEU  44  -8.891  -5.380  -2.067
  712    HA   LEU  44           HA       LEU  44  -7.068  -6.075  -0.026
  713    HB2  LEU  44           2HB      LEU  44  -9.591  -7.032  -1.033
  714    HB3  LEU  44           1HB      LEU  44  -8.529  -8.380  -0.677
  715    HG   LEU  44           HG       LEU  44  -8.212  -7.466   1.615
  716   HD11  LEU  44          1HD1      LEU  44  -9.826  -5.784   2.415
  717   HD12  LEU  44          2HD1      LEU  44 -10.353  -5.531   0.751
  718   HD13  LEU  44          3HD1      LEU  44  -8.701  -5.136   1.218
  719   HD21  LEU  44          3HD2      LEU  44  -9.843  -9.230   1.143
  720   HD22  LEU  44          1HD2      LEU  44 -11.071  -8.005   0.828
  721   HD23  LEU  44          2HD2      LEU  44 -10.384  -8.169   2.443
  722    H    ASP  45           H        ASP  45  -7.571  -7.348  -3.287
  723    HA   ASP  45           HA       ASP  45  -5.723  -9.478  -3.100
  724    HB2  ASP  45           2HB      ASP  45  -7.447  -9.336  -4.860
  725    HB3  ASP  45           1HB      ASP  45  -6.599  -7.964  -5.571
  726    H    THR  46           H        THR  46  -5.341  -6.085  -3.714
  727    HA   THR  46           HA       THR  46  -2.849  -6.056  -4.978
  728    HB   THR  46           HB       THR  46  -4.011  -4.003  -3.082
  729    HG1  THR  46           1HG      THR  46  -5.347  -4.347  -4.887
  730   HG21  THR  46          3HG2      THR  46  -2.531  -2.411  -4.235
  731   HG22  THR  46          1HG2      THR  46  -1.819  -3.743  -5.144
  732   HG23  THR  46          2HG2      THR  46  -1.614  -3.664  -3.394
  733    H    ILE  47           H        ILE  47  -3.672  -6.246  -1.532
  734    HA   ILE  47           HA       ILE  47  -0.809  -6.347  -0.909
  735    HB   ILE  47           HB       ILE  47  -1.374  -6.012   1.409
  736   HG12  ILE  47          2HG1      ILE  47  -4.289  -5.793   0.676
  737   HG13  ILE  47          1HG1      ILE  47  -3.582  -7.322   1.194
  738   HG21  ILE  47          1HG2      ILE  47  -1.180  -4.035  -0.038
  739   HG22  ILE  47          2HG2      ILE  47  -2.305  -3.770   1.294
  740   HG23  ILE  47          3HG2      ILE  47  -2.918  -4.088  -0.328
  741   HD11  ILE  47          3HD1      ILE  47  -3.733  -4.769   2.771
  742   HD12  ILE  47          1HD1      ILE  47  -2.860  -6.212   3.285
  743   HD13  ILE  47          2HD1      ILE  47  -4.612  -6.270   3.070
  744    H    GLN  48           H        GLN  48  -3.050  -8.407  -1.829
  745    HA   GLN  48           HA       GLN  48  -3.231 -10.657  -1.866
  746    HB2  GLN  48           2HB      GLN  48  -0.578 -10.296  -1.158
  747    HB3  GLN  48           1HB      GLN  48  -1.192 -11.383   0.082
  748    HG2  GLN  48           2HG      GLN  48  -1.469 -11.856  -2.880
  749    HG3  GLN  48           1HG      GLN  48  -0.182 -12.524  -1.877
  750   HE21  GLN  48          1HE2      GLN  48  -2.252 -13.860  -3.446
  751   HE22  GLN  48          2HE2      GLN  48  -3.111 -14.876  -2.341
  752    H    TYR  49           H        TYR  49  -2.449  -9.561   1.440
  753    HA   TYR  49           HA       TYR  49  -3.785 -11.538   2.862
  754    HB2  TYR  49           2HB      TYR  49  -3.541  -8.617   3.614
  755    HB3  TYR  49           1HB      TYR  49  -3.909  -9.936   4.716
  756    HD1  TYR  49           1HD      TYR  49  -2.137 -11.707   5.117
  757    HD2  TYR  49           2HD      TYR  49  -1.321  -8.052   3.097
  758    HE1  TYR  49           1HE      TYR  49   0.266 -12.012   5.542
  759    HE2  TYR  49           2HE      TYR  49   1.081  -8.354   3.513
  760    HH   TYR  49           HH       TYR  49   2.588  -9.499   4.820
  761    H    SER  50           H        SER  50  -5.775 -12.163   2.217
  762    HA   SER  50           HA       SER  50  -7.885 -10.099   2.173
  763    HB2  SER  50           2HB      SER  50  -8.064 -12.792   0.821
  764    HB3  SER  50           1HB      SER  50  -9.061 -11.365   0.544
  765    HG   SER  50           HG       SER  50  -6.290 -11.218   0.103
  766    H    LYS  51           H        LYS  51  -6.942 -13.291   3.272
  767    HA   LYS  51           HA       LYS  51  -9.436 -13.589   4.754
  768    HB2  LYS  51           2HB      LYS  51  -7.113 -15.506   4.482
  769    HB3  LYS  51           1HB      LYS  51  -8.666 -15.859   5.230
  770    HG2  LYS  51           2HG      LYS  51  -9.798 -15.690   3.138
  771    HG3  LYS  51           1HG      LYS  51  -8.352 -15.064   2.343
  772    HD2  LYS  51           2HD      LYS  51  -8.604 -17.381   1.763
  773    HD3  LYS  51           1HD      LYS  51  -7.215 -17.219   2.836
  774    HE2  LYS  51           2HE      LYS  51  -8.528 -17.994   4.713
  775    HE3  LYS  51           1HE      LYS  51  -9.978 -18.043   3.715
  776    HZ1  LYS  51           3HZ      LYS  51  -7.557 -19.687   3.250
  777    HZ2  LYS  51           1HZ      LYS  51  -9.014 -19.787   2.400
  778    HZ3  LYS  51           2HZ      LYS  51  -8.950 -20.232   4.030
  779    H    HIS  52           H        HIS  52  -6.023 -14.212   5.544
  780    HA   HIS  52           HA       HIS  52  -6.041 -12.432   7.782
  781    HB2  HIS  52           2HB      HIS  52  -7.316 -14.282   8.776
  782    HB3  HIS  52           1HB      HIS  52  -6.050 -15.413   8.321
  783    HD1  HIS  52           1HD      HIS  52  -5.053 -16.129  10.472
  784    HD2  HIS  52           2HD      HIS  52  -5.610 -12.010  10.304
  785    HE1  HIS  52           1HE      HIS  52  -3.998 -15.215  12.563
  786    HE2  HIS  52           2HE      HIS  52  -4.213 -12.720  12.363
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1  18.908  20.206  -2.570
    2    H2   GLY   1           2HT      GLY   1  17.781  18.967  -2.781
    3    H3   GLY   1           3HT      GLY   1  18.234  19.927  -4.096
    4    HA2  GLY   1           1HA      GLY   1  19.337  17.832  -4.289
    5    HA3  GLY   1           2HA      GLY   1  20.517  19.081  -3.911
    6    H    SER   2           H        SER   2  20.811  16.269  -3.436
    7    HA   SER   2           HA       SER   2  20.439  15.876  -0.598
    8    HB2  SER   2           2HB      SER   2  21.971  14.072  -2.463
    9    HB3  SER   2           1HB      SER   2  21.115  13.641  -0.981
   10    HG   SER   2           HG       SER   2  20.148  13.399  -3.327
   11    HA   PRO   3           HA       PRO   3  24.435  17.816   0.171
   12    HB2  PRO   3           2HB      PRO   3  23.841  17.135   2.968
   13    HB3  PRO   3           1HB      PRO   3  24.116  18.717   2.236
   14    HG2  PRO   3           2HG      PRO   3  21.684  17.947   3.073
   15    HG3  PRO   3           1HG      PRO   3  21.905  18.979   1.649
   16    HD2  PRO   3           2HD      PRO   3  21.343  16.040   1.792
   17    HD3  PRO   3           1HD      PRO   3  20.674  17.266   0.692
   18    HA   PRO   4           HA       PRO   4  27.202  14.398   0.661
   19    HB2  PRO   4           2HB      PRO   4  28.906  16.037   2.426
   20    HB3  PRO   4           1HB      PRO   4  29.267  15.341   0.841
   21    HG2  PRO   4           2HG      PRO   4  28.896  17.976   1.163
   22    HG3  PRO   4           1HG      PRO   4  28.352  17.134  -0.298
   23    HD2  PRO   4           2HD      PRO   4  26.767  18.032   2.075
   24    HD3  PRO   4           1HD      PRO   4  26.358  18.113   0.348
   25    H    GLU   5           H        GLU   5  25.571  15.713   3.284
   26    HA   GLU   5           HA       GLU   5  26.763  14.112   5.358
   27    HB2  GLU   5           2HB      GLU   5  24.127  15.593   5.398
   28    HB3  GLU   5           1HB      GLU   5  25.005  14.981   6.792
   29    HG2  GLU   5           2HG      GLU   5  25.730  17.271   5.001
   30    HG3  GLU   5           1HG      GLU   5  25.411  17.288   6.733
   31    H    ALA   6           H        ALA   6  24.333  13.707   2.979
   32    HA   ALA   6           HA       ALA   6  22.873  11.633   4.332
   33    HB1  ALA   6           1HB      ALA   6  22.859  12.483   1.436
   34    HB2  ALA   6           2HB      ALA   6  21.761  13.051   2.695
   35    HB3  ALA   6           3HB      ALA   6  21.719  11.365   2.184
   36    H    ASP   7           H        ASP   7  23.218   9.484   4.250
   37    HA   ASP   7           HA       ASP   7  25.700   8.503   3.264
   38    HB2  ASP   7           2HB      ASP   7  24.569   7.555   5.259
   39    HB3  ASP   7           1HB      ASP   7  23.297   6.929   4.217
   40    HA   PRO   8           HA       PRO   8  24.508   7.940  -0.973
   41    HB2  PRO   8           2HB      PRO   8  26.566   6.253  -1.651
   42    HB3  PRO   8           1HB      PRO   8  26.722   8.012  -1.536
   43    HG2  PRO   8           2HG      PRO   8  27.405   5.903   0.488
   44    HG3  PRO   8           1HG      PRO   8  28.346   7.327  -0.006
   45    HD2  PRO   8           2HD      PRO   8  26.937   7.355   2.250
   46    HD3  PRO   8           1HD      PRO   8  27.002   8.794   1.210
   47    H    ARG   9           H        ARG   9  24.886   5.278   1.272
   48    HA   ARG   9           HA       ARG   9  23.731   3.402  -0.655
   49    HB2  ARG   9           2HB      ARG   9  24.711   2.963   2.171
   50    HB3  ARG   9           1HB      ARG   9  24.153   1.702   1.080
   51    HG2  ARG   9           2HG      ARG   9  26.049   1.762  -0.187
   52    HG3  ARG   9           1HG      ARG   9  26.357   3.467   0.162
   53    HD2  ARG   9           2HD      ARG   9  26.671   1.214   2.149
   54    HD3  ARG   9           1HD      ARG   9  27.991   1.920   1.213
   55    HE   ARG   9           HE       ARG   9  26.402   3.722   2.881
   56   HH11  ARG   9          1HH1      ARG   9  29.380   1.919   2.426
   57   HH12  ARG   9          2HH1      ARG   9  30.245   2.818   3.632
   58   HH21  ARG   9          1HH2      ARG   9  27.550   4.912   4.448
   59   HH22  ARG   9          2HH2      ARG   9  29.220   4.515   4.774
   60    H    LEU  10           H        LEU  10  23.001   4.931   2.450
   61    HA   LEU  10           HA       LEU  10  20.592   3.593   2.967
   62    HB2  LEU  10           2HB      LEU  10  21.830   5.003   4.595
   63    HB3  LEU  10           1HB      LEU  10  21.298   6.428   3.723
   64    HG   LEU  10           HG       LEU  10  18.950   5.867   4.258
   65   HD11  LEU  10          1HD1      LEU  10  18.478   4.146   5.938
   66   HD12  LEU  10          2HD1      LEU  10  20.168   3.645   5.894
   67   HD13  LEU  10          3HD1      LEU  10  19.153   3.454   4.464
   68   HD21  LEU  10          3HD2      LEU  10  20.763   6.007   6.667
   69   HD22  LEU  10          1HD2      LEU  10  19.055   6.442   6.624
   70   HD23  LEU  10          2HD2      LEU  10  20.228   7.379   5.699
   71    H    ILE  11           H        ILE  11  21.216   6.561   1.117
   72    HA   ILE  11           HA       ILE  11  18.464   7.112   0.651
   73    HB   ILE  11           HB       ILE  11  20.280   8.805   0.507
   74   HG12  ILE  11          2HG1      ILE  11  18.681   8.577  -2.051
   75   HG13  ILE  11          1HG1      ILE  11  18.016   9.126  -0.514
   76   HG21  ILE  11          1HG2      ILE  11  21.570   8.978  -1.586
   77   HG22  ILE  11          2HG2      ILE  11  20.930   7.413  -2.083
   78   HG23  ILE  11          3HG2      ILE  11  21.963   7.530  -0.658
   79   HD11  ILE  11          3HD1      ILE  11  19.552  11.012  -0.519
   80   HD12  ILE  11          1HD1      ILE  11  18.575  10.986  -1.986
   81   HD13  ILE  11          2HD1      ILE  11  20.251  10.445  -2.036
   82    H    GLU  12           H        GLU  12  20.737   4.981  -0.831
   83    HA   GLU  12           HA       GLU  12  19.510   4.762  -3.377
   84    HB2  GLU  12           2HB      GLU  12  21.461   3.048  -1.873
   85    HB3  GLU  12           1HB      GLU  12  20.807   2.539  -3.425
   86    HG2  GLU  12           2HG      GLU  12  22.115   5.207  -3.070
   87    HG3  GLU  12           1HG      GLU  12  23.050   3.750  -3.395
   88    H    SER  13           H        SER  13  18.509   3.687  -0.337
   89    HA   SER  13           HA       SER  13  17.332   1.227  -0.880
   90    HB2  SER  13           2HB      SER  13  16.166   3.366   0.915
   91    HB3  SER  13           1HB      SER  13  15.928   1.622   1.040
   92    HG   SER  13           HG       SER  13  18.085   3.187   1.817
   93    H    LEU  14           H        LEU  14  16.265   4.476  -1.639
   94    HA   LEU  14           HA       LEU  14  13.629   3.746  -2.462
   95    HB2  LEU  14           2HB      LEU  14  15.351   6.177  -2.915
   96    HB3  LEU  14           1HB      LEU  14  13.779   6.012  -3.671
   97    HG   LEU  14           HG       LEU  14  12.908   5.652  -1.251
   98   HD11  LEU  14          1HD1      LEU  14  14.198   6.797   0.464
   99   HD12  LEU  14          2HD1      LEU  14  15.497   7.089  -0.690
  100   HD13  LEU  14          3HD1      LEU  14  15.106   5.439  -0.202
  101   HD21  LEU  14          3HD2      LEU  14  13.871   8.352  -2.187
  102   HD22  LEU  14          1HD2      LEU  14  12.623   8.063  -0.974
  103   HD23  LEU  14          2HD2      LEU  14  12.356   7.572  -2.645
  104    H    SER  15           H        SER  15  16.696   4.360  -4.121
  105    HA   SER  15           HA       SER  15  15.801   3.946  -6.748
  106    HB2  SER  15           2HB      SER  15  18.577   3.150  -6.042
  107    HB3  SER  15           1HB      SER  15  18.002   4.218  -7.322
  108    HG   SER  15           HG       SER  15  19.174   5.143  -5.377
  109    H    GLN  16           H        GLN  16  17.006   1.755  -4.278
  110    HA   GLN  16           HA       GLN  16  17.262  -0.550  -5.853
  111    HB2  GLN  16           2HB      GLN  16  18.127  -0.201  -3.502
  112    HB3  GLN  16           1HB      GLN  16  16.489  -0.493  -2.934
  113    HG2  GLN  16           2HG      GLN  16  17.902  -2.482  -2.766
  114    HG3  GLN  16           1HG      GLN  16  16.533  -2.730  -3.850
  115   HE21  GLN  16          1HE2      GLN  16  16.896  -3.052  -6.022
  116   HE22  GLN  16          2HE2      GLN  16  18.471  -3.324  -6.681
  117    H    MET  17           H        MET  17  14.532   0.706  -3.972
  118    HA   MET  17           HA       MET  17  12.769  -1.435  -4.481
  119    HB2  MET  17           2HB      MET  17  12.202   1.470  -3.852
  120    HB3  MET  17           1HB      MET  17  10.965   0.227  -3.931
  121    HG2  MET  17           2HG      MET  17  13.231   0.441  -1.973
  122    HG3  MET  17           1HG      MET  17  11.502   0.554  -1.649
  123    HE1  MET  17           3HE      MET  17   9.863  -1.465  -1.539
  124    HE2  MET  17           1HE      MET  17  10.275  -3.102  -2.038
  125    HE3  MET  17           2HE      MET  17  10.199  -1.809  -3.236
  126    H    LEU  18           H        LEU  18  13.396   1.603  -6.163
  127    HA   LEU  18           HA       LEU  18  11.402   1.391  -8.122
  128    HB2  LEU  18           2HB      LEU  18  12.616   3.455  -7.725
  129    HB3  LEU  18           1HB      LEU  18  14.117   2.704  -8.231
  130    HG   LEU  18           HG       LEU  18  13.038   2.390 -10.513
  131   HD11  LEU  18          1HD1      LEU  18  11.081   4.380  -9.376
  132   HD12  LEU  18          2HD1      LEU  18  10.720   2.716  -9.834
  133   HD13  LEU  18          3HD1      LEU  18  11.195   3.887 -11.065
  134   HD21  LEU  18          3HD2      LEU  18  14.740   4.076 -10.066
  135   HD22  LEU  18          1HD2      LEU  18  13.496   5.194  -9.508
  136   HD23  LEU  18          2HD2      LEU  18  13.530   4.679 -11.196
  137    H    SER  19           H        SER  19  14.703   0.168  -7.989
  138    HA   SER  19           HA       SER  19  14.692  -0.898 -10.641
  139    HB2  SER  19           2HB      SER  19  16.508  -1.650  -8.341
  140    HB3  SER  19           1HB      SER  19  16.832  -1.855 -10.064
  141    HG   SER  19           HG       SER  19  16.574   0.584  -8.628
  142    H    MET  20           H        MET  20  13.415  -1.941  -7.658
  143    HA   MET  20           HA       MET  20  13.470  -4.761  -8.314
  144    HB2  MET  20           2HB      MET  20  13.632  -3.823  -5.961
  145    HB3  MET  20           1HB      MET  20  11.927  -3.421  -6.091
  146    HG2  MET  20           2HG      MET  20  11.355  -5.746  -6.372
  147    HG3  MET  20           1HG      MET  20  13.059  -6.192  -6.377
  148    HE1  MET  20           3HE      MET  20  14.413  -4.603  -4.114
  149    HE2  MET  20           1HE      MET  20  14.570  -6.352  -4.286
  150    HE3  MET  20           2HE      MET  20  14.163  -5.652  -2.719
  151    H    GLY  21           H        GLY  21  11.637  -2.128  -9.197
  152    HA2  GLY  21           2HA      GLY  21   9.910  -2.365 -10.839
  153    HA3  GLY  21           1HA      GLY  21   9.479  -3.905 -10.110
  154    H    PHE  22           H        PHE  22  10.073  -1.517  -7.795
  155    HA   PHE  22           HA       PHE  22   7.193  -1.263  -7.353
  156    HB2  PHE  22           2HB      PHE  22   9.122  -1.886  -5.589
  157    HB3  PHE  22           1HB      PHE  22   9.133  -0.137  -5.407
  158    HD1  PHE  22           2HD      PHE  22   6.601   0.854  -5.291
  159    HD2  PHE  22           1HD      PHE  22   7.841  -3.032  -4.090
  160    HE1  PHE  22           2HE      PHE  22   4.659   0.702  -3.789
  161    HE2  PHE  22           1HE      PHE  22   5.898  -3.197  -2.589
  162    HZ   PHE  22           HZ       PHE  22   4.307  -1.324  -2.438
  163    H    SER  23           H        SER  23   6.161   0.531  -7.871
  164    HA   SER  23           HA       SER  23   7.527   3.100  -7.789
  165    HB2  SER  23           2HB      SER  23   6.125   2.082 -10.274
  166    HB3  SER  23           1HB      SER  23   6.788   3.702 -10.058
  167    HG   SER  23           HG       SER  23   8.692   1.961  -9.451
  168    H    ASP  24           H        ASP  24   6.139   4.818  -7.413
  169    HA   ASP  24           HA       ASP  24   3.419   4.012  -6.667
  170    HB2  ASP  24           2HB      ASP  24   3.379   5.990  -5.237
  171    HB3  ASP  24           1HB      ASP  24   4.786   4.996  -4.878
  172    H    GLU  25           H        GLU  25   1.671   5.444  -7.028
  173    HA   GLU  25           HA       GLU  25   1.984   7.108  -9.440
  174    HB2  GLU  25           2HB      GLU  25  -0.742   6.471  -9.110
  175    HB3  GLU  25           1HB      GLU  25   0.347   5.871 -10.350
  176    HG2  GLU  25           2HG      GLU  25  -0.614   3.965  -9.397
  177    HG3  GLU  25           1HG      GLU  25   1.002   4.058  -8.700
  178    H    GLY  26           H        GLY  26   0.186   6.679  -6.417
  179    HA2  GLY  26           2HA      GLY  26  -0.625   9.491  -6.439
  180    HA3  GLY  26           1HA      GLY  26  -1.150   8.262  -5.297
  181    H    GLY  27           H        GLY  27   2.138   8.044  -5.707
  182    HA2  GLY  27           2HA      GLY  27   3.979   8.828  -4.571
  183    HA3  GLY  27           1HA      GLY  27   2.990  10.138  -3.946
  184    H    TRP  28           H        TRP  28   2.466   6.637  -3.570
  185    HA   TRP  28           HA       TRP  28   2.414   7.097  -0.693
  186    HB2  TRP  28           2HB      TRP  28   1.215   5.049  -0.471
  187    HB3  TRP  28           1HB      TRP  28   0.490   5.973  -1.776
  188    HD1  TRP  28           HD       TRP  28   1.296   5.090  -4.348
  189    HE1  TRP  28           1HE      TRP  28   1.531   2.654  -5.141
  190    HE3  TRP  28           3HE      TRP  28   1.747   2.804   0.195
  191    HZ2  TRP  28           2HZ      TRP  28   1.870   0.087  -3.980
  192    HZ3  TRP  28           3HZ      TRP  28   2.020   0.364   0.271
  193    HH2  TRP  28           HH       TRP  28   2.081  -0.964  -1.775
  194    H    LEU  29           H        LEU  29   4.406   5.521  -3.052
  195    HA   LEU  29           HA       LEU  29   5.656   3.628  -1.390
  196    HB2  LEU  29           2HB      LEU  29   5.931   3.514  -3.781
  197    HB3  LEU  29           1HB      LEU  29   6.675   5.100  -3.822
  198    HG   LEU  29           HG       LEU  29   8.616   4.210  -2.583
  199   HD11  LEU  29          1HD1      LEU  29   7.507   2.398  -1.394
  200   HD12  LEU  29          2HD1      LEU  29   8.898   1.808  -2.306
  201   HD13  LEU  29          3HD1      LEU  29   7.264   1.540  -2.915
  202   HD21  LEU  29          3HD2      LEU  29   7.930   2.698  -5.099
  203   HD22  LEU  29          1HD2      LEU  29   9.547   2.891  -4.420
  204   HD23  LEU  29          2HD2      LEU  29   8.665   4.299  -5.012
  205    H    THR  30           H        THR  30   6.397   7.015  -2.059
  206    HA   THR  30           HA       THR  30   8.779   7.095  -0.523
  207    HB   THR  30           HB       THR  30   8.228   8.739  -2.313
  208    HG1  THR  30           1HG      THR  30   8.935   9.573   0.298
  209   HG21  THR  30          3HG2      THR  30   6.313   9.853  -0.264
  210   HG22  THR  30          1HG2      THR  30   5.872   9.092  -1.791
  211   HG23  THR  30          2HG2      THR  30   6.749  10.624  -1.791
  212    H    ARG  31           H        ARG  31   5.534   6.909   0.382
  213    HA   ARG  31           HA       ARG  31   5.921   8.270   2.938
  214    HB2  ARG  31           2HB      ARG  31   3.435   6.828   2.031
  215    HB3  ARG  31           1HB      ARG  31   3.576   8.085   3.253
  216    HG2  ARG  31           2HG      ARG  31   4.297   8.686   0.421
  217    HG3  ARG  31           1HG      ARG  31   2.604   8.645   0.911
  218    HD2  ARG  31           2HD      ARG  31   4.615  10.257   2.442
  219    HD3  ARG  31           1HD      ARG  31   3.871  10.896   0.978
  220    HE   ARG  31           HE       ARG  31   1.987   9.886   2.897
  221   HH11  ARG  31          1HH1      ARG  31   3.857  12.665   1.898
  222   HH12  ARG  31          2HH1      ARG  31   2.780  13.807   2.635
  223   HH21  ARG  31          1HH2      ARG  31   0.571  11.369   3.858
  224   HH22  ARG  31          2HH2      ARG  31   0.910  13.072   3.760
  225    H    LEU  32           H        LEU  32   5.321   5.084   1.571
  226    HA   LEU  32           HA       LEU  32   4.994   3.628   3.930
  227    HB2  LEU  32           2HB      LEU  32   4.569   2.822   1.597
  228    HB3  LEU  32           1HB      LEU  32   6.302   2.676   1.381
  229    HG   LEU  32           HG       LEU  32   6.266   1.074   3.364
  230   HD11  LEU  32          1HD1      LEU  32   4.113   1.578   4.289
  231   HD12  LEU  32          2HD1      LEU  32   4.085  -0.081   3.692
  232   HD13  LEU  32          3HD1      LEU  32   3.317   1.202   2.761
  233   HD21  LEU  32          3HD2      LEU  32   5.635  -0.813   1.965
  234   HD22  LEU  32          1HD2      LEU  32   6.577   0.360   1.047
  235   HD23  LEU  32          2HD2      LEU  32   4.829   0.278   0.836
  236    H    LEU  33           H        LEU  33   7.899   4.605   2.200
  237    HA   LEU  33           HA       LEU  33   9.700   3.115   3.845
  238    HB2  LEU  33           2HB      LEU  33  10.192   5.447   1.992
  239    HB3  LEU  33           1HB      LEU  33  11.446   4.479   2.738
  240    HG   LEU  33           HG       LEU  33   9.392   3.420   0.797
  241   HD11  LEU  33          1HD1      LEU  33  11.278   3.316  -0.776
  242   HD12  LEU  33          2HD1      LEU  33  12.292   4.139   0.409
  243   HD13  LEU  33          3HD1      LEU  33  10.905   4.971  -0.292
  244   HD21  LEU  33          3HD2      LEU  33  10.216   1.737   2.380
  245   HD22  LEU  33          1HD2      LEU  33  11.874   2.148   1.945
  246   HD23  LEU  33          2HD2      LEU  33  10.803   1.430   0.745
  247    H    GLN  34           H        GLN  34   7.906   5.878   4.401
  248    HA   GLN  34           HA       GLN  34   9.873   7.025   6.239
  249    HB2  GLN  34           2HB      GLN  34   7.190   8.026   5.271
  250    HB3  GLN  34           1HB      GLN  34   8.130   8.833   6.517
  251    HG2  GLN  34           2HG      GLN  34   9.116   8.307   3.725
  252    HG3  GLN  34           1HG      GLN  34   8.378   9.816   4.258
  253   HE21  GLN  34          1HE2      GLN  34  11.157   7.743   4.498
  254   HE22  GLN  34          2HE2      GLN  34  12.220   8.915   5.199
  255    H    THR  35           H        THR  35   6.579   5.718   6.197
  256    HA   THR  35           HA       THR  35   6.274   5.912   9.035
  257    HB   THR  35           HB       THR  35   4.191   4.596   8.679
  258    HG1  THR  35           1HG      THR  35   3.728   3.736   6.761
  259   HG21  THR  35          3HG2      THR  35   4.755   7.043   7.032
  260   HG22  THR  35          1HG2      THR  35   3.870   6.908   8.551
  261   HG23  THR  35          2HG2      THR  35   3.151   6.307   7.056
  262    H    LYS  36           H        LYS  36   7.170   3.319   6.796
  263    HA   LYS  36           HA       LYS  36   7.504   1.547   9.124
  264    HB2  LYS  36           2HB      LYS  36   7.147   0.826   6.214
  265    HB3  LYS  36           1HB      LYS  36   7.374  -0.324   7.525
  266    HG2  LYS  36           2HG      LYS  36   5.291   0.579   8.575
  267    HG3  LYS  36           1HG      LYS  36   5.039   1.530   7.111
  268    HD2  LYS  36           2HD      LYS  36   4.879  -0.459   5.777
  269    HD3  LYS  36           1HD      LYS  36   5.331  -1.468   7.153
  270    HE2  LYS  36           2HE      LYS  36   2.993  -1.670   6.970
  271    HE3  LYS  36           1HE      LYS  36   3.269  -0.563   8.314
  272    HZ1  LYS  36           3HZ      LYS  36   2.783   0.443   5.582
  273    HZ2  LYS  36           1HZ      LYS  36   2.593   1.261   7.055
  274    HZ3  LYS  36           2HZ      LYS  36   1.501   0.042   6.605
  275    H    ASN  37           H        ASN  37   9.336   3.614   7.823
  276    HA   ASN  37           HA       ASN  37  11.577   3.940   7.666
  277    HB2  ASN  37           2HB      ASN  37  11.616   2.288   9.609
  278    HB3  ASN  37           1HB      ASN  37  12.003   1.046   8.424
  279   HD21  ASN  37          1HD2      ASN  37  14.041   0.586   9.107
  280   HD22  ASN  37          2HD2      ASN  37  15.349   1.718   9.041
  281    H    TYR  38           H        TYR  38  13.601   3.063   6.488
  282    HA   TYR  38           HA       TYR  38  12.775   2.369   3.802
  283    HB2  TYR  38           2HB      TYR  38  15.622   2.724   4.726
  284    HB3  TYR  38           1HB      TYR  38  14.955   2.991   3.120
  285    HD1  TYR  38           1HD      TYR  38  13.587   5.023   2.679
  286    HD2  TYR  38           2HD      TYR  38  15.607   4.435   6.381
  287    HE1  TYR  38           1HE      TYR  38  13.349   7.415   3.186
  288    HE2  TYR  38           2HE      TYR  38  15.376   6.827   6.893
  289    HH   TYR  38           HH       TYR  38  15.085   8.971   5.581
  290    H    ASP  39           H        ASP  39  12.466   0.308   5.803
  291    HA   ASP  39           HA       ASP  39  14.617  -1.578   5.371
  292    HB2  ASP  39           2HB      ASP  39  12.303  -1.375   7.150
  293    HB3  ASP  39           1HB      ASP  39  12.547  -3.004   6.524
  294    H    ILE  40           H        ILE  40  14.755  -2.415   3.417
  295    HA   ILE  40           HA       ILE  40  12.707  -2.685   1.543
  296    HB   ILE  40           HB       ILE  40  15.233  -4.327   1.708
  297   HG12  ILE  40          2HG1      ILE  40  14.734  -1.707   0.279
  298   HG13  ILE  40          1HG1      ILE  40  15.624  -1.873   1.787
  299   HG21  ILE  40          1HG2      ILE  40  13.611  -5.243   0.137
  300   HG22  ILE  40          2HG2      ILE  40  14.983  -4.543  -0.723
  301   HG23  ILE  40          3HG2      ILE  40  13.455  -3.666  -0.638
  302   HD11  ILE  40          3HD1      ILE  40  16.389  -2.931  -0.915
  303   HD12  ILE  40          1HD1      ILE  40  17.225  -3.352   0.577
  304   HD13  ILE  40          2HD1      ILE  40  17.201  -1.679   0.024
  305    H    GLY  41           H        GLY  41  14.044  -5.079   3.796
  306    HA2  GLY  41           2HA      GLY  41  12.530  -7.280   2.938
  307    HA3  GLY  41           1HA      GLY  41  13.215  -7.086   4.545
  308    H    ALA  42           H        ALA  42  11.813  -4.799   5.355
  309    HA   ALA  42           HA       ALA  42   9.401  -5.973   6.256
  310    HB1  ALA  42           1HB      ALA  42   8.961  -3.830   7.313
  311    HB2  ALA  42           2HB      ALA  42  10.235  -3.075   6.356
  312    HB3  ALA  42           3HB      ALA  42  10.643  -4.299   7.557
  313    H    ALA  43           H        ALA  43  10.149  -3.564   3.780
  314    HA   ALA  43           HA       ALA  43   7.530  -2.814   3.129
  315    HB1  ALA  43           1HB      ALA  43   9.623  -1.659   2.394
  316    HB2  ALA  43           2HB      ALA  43   8.429  -1.896   1.117
  317    HB3  ALA  43           3HB      ALA  43   9.847  -2.942   1.206
  318    H    LEU  44           H        LEU  44   9.575  -5.414   1.877
  319    HA   LEU  44           HA       LEU  44   7.818  -6.297  -0.138
  320    HB2  LEU  44           2HB      LEU  44  10.212  -7.332   1.225
  321    HB3  LEU  44           1HB      LEU  44   9.151  -8.561   0.568
  322    HG   LEU  44           HG       LEU  44   9.339  -7.574  -1.657
  323   HD11  LEU  44          1HD1      LEU  44  10.994  -5.781  -2.064
  324   HD12  LEU  44          2HD1      LEU  44  11.169  -5.584  -0.320
  325   HD13  LEU  44          3HD1      LEU  44   9.623  -5.244  -1.093
  326   HD21  LEU  44          3HD2      LEU  44  10.934  -9.285  -1.042
  327   HD22  LEU  44          1HD2      LEU  44  11.988  -8.077  -0.305
  328   HD23  LEU  44          2HD2      LEU  44  11.720  -8.068  -2.047
  329    H    ASP  45           H        ASP  45   8.173  -7.231   3.249
  330    HA   ASP  45           HA       ASP  45   6.242  -9.329   3.137
  331    HB2  ASP  45           2HB      ASP  45   8.137  -9.026   4.833
  332    HB3  ASP  45           1HB      ASP  45   7.077  -7.873   5.634
  333    H    THR  46           H        THR  46   6.037  -5.925   3.468
  334    HA   THR  46           HA       THR  46   3.674  -5.626   4.934
  335    HB   THR  46           HB       THR  46   4.729  -3.878   2.702
  336    HG1  THR  46           1HG      THR  46   6.165  -4.152   4.503
  337   HG21  THR  46          3HG2      THR  46   3.392  -2.098   3.664
  338   HG22  THR  46          1HG2      THR  46   2.801  -3.181   4.924
  339   HG23  THR  46          2HG2      THR  46   2.345  -3.452   3.240
  340    H    ILE  47           H        ILE  47   4.176  -6.282   1.496
  341    HA   ILE  47           HA       ILE  47   1.252  -6.444   1.195
  342    HB   ILE  47           HB       ILE  47   1.579  -6.138  -1.211
  343   HG12  ILE  47          2HG1      ILE  47   4.483  -5.553  -0.610
  344   HG13  ILE  47          1HG1      ILE  47   3.924  -7.116  -1.201
  345   HG21  ILE  47          1HG2      ILE  47   3.002  -3.946   0.292
  346   HG22  ILE  47          2HG2      ILE  47   1.261  -4.207   0.376
  347   HG23  ILE  47          3HG2      ILE  47   2.015  -3.796  -1.164
  348   HD11  ILE  47          3HD1      ILE  47   4.784  -5.751  -3.009
  349   HD12  ILE  47          1HD1      ILE  47   3.622  -4.481  -2.620
  350   HD13  ILE  47          2HD1      ILE  47   3.056  -6.042  -3.212
  351    H    GLN  48           H        GLN  48   3.663  -8.392   1.883
  352    HA   GLN  48           HA       GLN  48   3.942 -10.635   1.872
  353    HB2  GLN  48           2HB      GLN  48   1.263 -10.451   0.596
  354    HB3  GLN  48           1HB      GLN  48   2.125 -11.981   0.499
  355    HG2  GLN  48           2HG      GLN  48   1.549 -10.513   3.062
  356    HG3  GLN  48           1HG      GLN  48   0.558 -11.818   2.406
  357   HE21  GLN  48          1HE2      GLN  48   2.225 -11.509   4.879
  358   HE22  GLN  48          2HE2      GLN  48   3.234 -12.917   4.893
  359    H    TYR  49           H        TYR  49   3.162  -9.257  -1.277
  360    HA   TYR  49           HA       TYR  49   4.263 -11.221  -2.914
  361    HB2  TYR  49           2HB      TYR  49   3.911  -8.251  -3.259
  362    HB3  TYR  49           1HB      TYR  49   4.647  -9.235  -4.522
  363    HD1  TYR  49           2HD      TYR  49   3.334 -10.863  -5.749
  364    HD2  TYR  49           1HD      TYR  49   1.542  -8.442  -2.748
  365    HE1  TYR  49           2HE      TYR  49   1.112 -11.486  -6.583
  366    HE2  TYR  49           1HE      TYR  49  -0.693  -9.065  -3.572
  367    HH   TYR  49           HH       TYR  49  -1.818 -10.030  -5.287
  368    H    SER  50           H        SER  50   6.174 -12.067  -2.328
  369    HA   SER  50           HA       SER  50   8.480 -10.258  -2.084
  370    HB2  SER  50           2HB      SER  50   9.326 -12.717  -1.166
  371    HB3  SER  50           1HB      SER  50   8.729 -11.405  -0.144
  372    HG   SER  50           HG       SER  50   6.649 -12.317  -0.275
  373    H    LYS  51           H        LYS  51   7.205 -13.101  -3.689
  374    HA   LYS  51           HA       LYS  51   9.551 -13.084  -5.469
  375    HB2  LYS  51           2HB      LYS  51   7.908 -15.417  -4.496
  376    HB3  LYS  51           1HB      LYS  51   9.031 -15.523  -5.840
  377    HG2  LYS  51           2HG      LYS  51  10.892 -15.087  -4.424
  378    HG3  LYS  51           1HG      LYS  51   9.840 -14.652  -3.077
  379    HD2  LYS  51           2HD      LYS  51  10.707 -16.883  -2.731
  380    HD3  LYS  51           1HD      LYS  51   8.975 -16.972  -3.055
  381    HE2  LYS  51           2HE      LYS  51   9.824 -17.271  -5.546
  382    HE3  LYS  51           1HE      LYS  51  11.277 -17.846  -4.727
  383    HZ1  LYS  51           3HZ      LYS  51   8.555 -18.892  -4.175
  384    HZ2  LYS  51           1HZ      LYS  51  10.027 -19.530  -3.642
  385    HZ3  LYS  51           2HZ      LYS  51   9.623 -19.598  -5.281
  386    H    HIS  52           H        HIS  52   6.248 -14.414  -5.418
  387    HA   HIS  52           HA       HIS  52   5.902 -13.395  -8.154
  388    HB2  HIS  52           2HB      HIS  52   4.922 -15.920  -6.851
  389    HB3  HIS  52           1HB      HIS  52   4.100 -15.248  -8.256
  390    HD1  HIS  52           1HD      HIS  52   5.040 -15.853 -10.490
  391    HD2  HIS  52           2HD      HIS  52   7.708 -16.590  -7.392
  392    HE1  HIS  52           1HE      HIS  52   7.001 -17.007 -11.550
  393    HE2  HIS  52           2HE      HIS  52   8.694 -17.213  -9.695
  394    H1   GLY   1           1HT      GLY   1 -18.742  19.762   1.724
  395    H2   GLY   1           2HT      GLY   1 -17.396  18.786   2.038
  396    H3   GLY   1           3HT      GLY   1 -17.756  20.084   3.059
  397    HA2  GLY   1           1HA      GLY   1 -18.396  18.011   4.091
  398    HA3  GLY   1           2HA      GLY   1 -19.800  19.018   3.755
  399    H    SER   2           H        SER   2 -20.969  16.966   3.909
  400    HA   SER   2           HA       SER   2 -20.612  15.177   1.623
  401    HB2  SER   2           2HB      SER   2 -22.715  14.728   3.704
  402    HB3  SER   2           1HB      SER   2 -21.716  13.555   2.844
  403    HG   SER   2           HG       SER   2 -21.285  14.765   5.234
  404    HA   PRO   3           HA       PRO   3 -24.088  17.496  -0.085
  405    HB2  PRO   3           2HB      PRO   3 -23.457  17.194  -2.659
  406    HB3  PRO   3           1HB      PRO   3 -22.549  18.294  -1.619
  407    HG2  PRO   3           2HG      PRO   3 -21.811  15.582  -2.601
  408    HG3  PRO   3           1HG      PRO   3 -20.783  17.000  -2.333
  409    HD2  PRO   3           2HD      PRO   3 -21.090  14.831  -0.582
  410    HD3  PRO   3           1HD      PRO   3 -20.378  16.406  -0.183
  411    HA   PRO   4           HA       PRO   4 -26.845  14.073  -0.871
  412    HB2  PRO   4           2HB      PRO   4 -28.422  15.938  -2.526
  413    HB3  PRO   4           1HB      PRO   4 -28.889  15.066  -1.065
  414    HG2  PRO   4           2HG      PRO   4 -28.474  17.708  -1.035
  415    HG3  PRO   4           1HG      PRO   4 -28.014  16.683   0.340
  416    HD2  PRO   4           2HD      PRO   4 -26.290  17.840  -1.825
  417    HD3  PRO   4           1HD      PRO   4 -25.978  17.709  -0.082
  418    H    GLU   5           H        GLU   5 -25.054  15.669  -3.197
  419    HA   GLU   5           HA       GLU   5 -26.072  14.373  -5.544
  420    HB2  GLU   5           2HB      GLU   5 -23.368  15.671  -5.202
  421    HB3  GLU   5           1HB      GLU   5 -24.261  15.435  -6.697
  422    HG2  GLU   5           2HG      GLU   5 -25.141  17.227  -4.445
  423    HG3  GLU   5           1HG      GLU   5 -24.280  17.766  -5.885
  424    H    ALA   6           H        ALA   6 -24.005  13.520  -2.984
  425    HA   ALA   6           HA       ALA   6 -22.602  11.467  -4.518
  426    HB1  ALA   6           1HB      ALA   6 -22.329  12.277  -1.622
  427    HB2  ALA   6           2HB      ALA   6 -21.281  12.784  -2.947
  428    HB3  ALA   6           3HB      ALA   6 -21.325  11.092  -2.457
  429    H    ASP   7           H        ASP   7 -23.020   9.334  -4.354
  430    HA   ASP   7           HA       ASP   7 -25.523   8.516  -3.306
  431    HB2  ASP   7           2HB      ASP   7 -24.336   7.467  -5.267
  432    HB3  ASP   7           1HB      ASP   7 -23.241   6.713  -4.115
  433    HA   PRO   8           HA       PRO   8 -24.415   7.899   0.941
  434    HB2  PRO   8           2HB      PRO   8 -26.431   6.134   1.555
  435    HB3  PRO   8           1HB      PRO   8 -26.627   7.888   1.496
  436    HG2  PRO   8           2HG      PRO   8 -27.287   5.838  -0.585
  437    HG3  PRO   8           1HG      PRO   8 -28.224   7.256  -0.074
  438    HD2  PRO   8           2HD      PRO   8 -26.783   7.279  -2.324
  439    HD3  PRO   8           1HD      PRO   8 -26.892   8.719  -1.288
  440    H    ARG   9           H        ARG   9 -24.713   5.302  -1.365
  441    HA   ARG   9           HA       ARG   9 -23.476   3.402   0.479
  442    HB2  ARG   9           2HB      ARG   9 -24.518   3.073  -2.340
  443    HB3  ARG   9           1HB      ARG   9 -23.790   1.776  -1.397
  444    HG2  ARG   9           2HG      ARG   9 -25.617   1.508  -0.102
  445    HG3  ARG   9           1HG      ARG   9 -26.030   3.223  -0.123
  446    HD2  ARG   9           2HD      ARG   9 -26.414   1.321  -2.434
  447    HD3  ARG   9           1HD      ARG   9 -27.679   1.810  -1.309
  448    HE   ARG   9           HE       ARG   9 -26.244   3.789  -2.971
  449   HH11  ARG   9          1HH1      ARG   9 -29.233   2.345  -1.819
  450   HH12  ARG   9          2HH1      ARG   9 -30.245   3.479  -2.651
  451   HH21  ARG   9          1HH2      ARG   9 -27.579   5.251  -4.092
  452   HH22  ARG   9          2HH2      ARG   9 -29.311   5.133  -3.935
  453    H    LEU  10           H        LEU  10 -22.726   5.404  -2.253
  454    HA   LEU  10           HA       LEU  10 -20.306   4.116  -3.004
  455    HB2  LEU  10           2HB      LEU  10 -21.512   5.632  -4.514
  456    HB3  LEU  10           1HB      LEU  10 -21.198   6.970  -3.426
  457    HG   LEU  10           HG       LEU  10 -18.764   6.691  -3.847
  458   HD11  LEU  10          1HD1      LEU  10 -18.077   5.347  -5.797
  459   HD12  LEU  10          2HD1      LEU  10 -19.712   4.692  -5.898
  460   HD13  LEU  10          3HD1      LEU  10 -18.712   4.360  -4.482
  461   HD21  LEU  10          3HD2      LEU  10 -20.454   7.131  -6.308
  462   HD22  LEU  10          1HD2      LEU  10 -18.792   7.675  -6.077
  463   HD23  LEU  10          2HD2      LEU  10 -20.083   8.342  -5.078
  464    H    ILE  11           H        ILE  11 -21.089   6.764  -0.808
  465    HA   ILE  11           HA       ILE  11 -18.370   7.388  -0.210
  466    HB   ILE  11           HB       ILE  11 -20.276   8.989   0.049
  467   HG12  ILE  11          2HG1      ILE  11 -18.716   8.584   2.607
  468   HG13  ILE  11          1HG1      ILE  11 -18.026   9.268   1.141
  469   HG21  ILE  11          1HG2      ILE  11 -21.609   8.909   2.101
  470   HG22  ILE  11          2HG2      ILE  11 -20.883   7.355   2.511
  471   HG23  ILE  11          3HG2      ILE  11 -21.897   7.505   1.077
  472   HD11  ILE  11          3HD1      ILE  11 -19.629  11.105   1.246
  473   HD12  ILE  11          1HD1      ILE  11 -18.645  11.006   2.707
  474   HD13  ILE  11          2HD1      ILE  11 -20.309  10.423   2.725
  475    H    GLU  12           H        GLU  12 -20.531   4.958   0.847
  476    HA   GLU  12           HA       GLU  12 -19.444   4.532   3.442
  477    HB2  GLU  12           2HB      GLU  12 -21.225   2.923   1.643
  478    HB3  GLU  12           1HB      GLU  12 -20.584   2.229   3.128
  479    HG2  GLU  12           2HG      GLU  12 -22.207   4.758   2.957
  480    HG3  GLU  12           1HG      GLU  12 -22.839   3.173   3.398
  481    H    SER  13           H        SER  13 -18.262   3.848   0.347
  482    HA   SER  13           HA       SER  13 -16.932   1.430   0.681
  483    HB2  SER  13           2HB      SER  13 -15.830   3.806  -0.836
  484    HB3  SER  13           1HB      SER  13 -15.535   2.097  -1.159
  485    HG   SER  13           HG       SER  13 -17.743   3.677  -1.781
  486    H    LEU  14           H        LEU  14 -16.063   4.666   1.735
  487    HA   LEU  14           HA       LEU  14 -13.418   4.019   2.585
  488    HB2  LEU  14           2HB      LEU  14 -15.274   6.311   3.237
  489    HB3  LEU  14           1HB      LEU  14 -13.679   6.168   3.947
  490    HG   LEU  14           HG       LEU  14 -12.909   6.026   1.427
  491   HD11  LEU  14          1HD1      LEU  14 -14.299   7.462  -0.007
  492   HD12  LEU  14          2HD1      LEU  14 -15.532   7.507   1.252
  493   HD13  LEU  14          3HD1      LEU  14 -15.136   5.982   0.461
  494   HD21  LEU  14          3HD2      LEU  14 -13.743   8.571   2.818
  495   HD22  LEU  14          1HD2      LEU  14 -12.650   8.483   1.437
  496   HD23  LEU  14          2HD2      LEU  14 -12.193   7.745   2.972
  497    H    SER  15           H        SER  15 -16.535   4.368   4.230
  498    HA   SER  15           HA       SER  15 -15.662   3.837   6.839
  499    HB2  SER  15           2HB      SER  15 -18.366   2.897   6.144
  500    HB3  SER  15           1HB      SER  15 -17.856   4.086   7.345
  501    HG   SER  15           HG       SER  15 -19.090   4.769   5.313
  502    H    GLN  16           H        GLN  16 -16.750   1.691   4.247
  503    HA   GLN  16           HA       GLN  16 -16.917  -0.683   5.733
  504    HB2  GLN  16           2HB      GLN  16 -17.683  -0.220   3.328
  505    HB3  GLN  16           1HB      GLN  16 -16.023  -0.574   2.860
  506    HG2  GLN  16           2HG      GLN  16 -17.361  -2.538   2.574
  507    HG3  GLN  16           1HG      GLN  16 -16.239  -2.795   3.910
  508   HE21  GLN  16          1HE2      GLN  16 -17.501  -4.402   4.827
  509   HE22  GLN  16          2HE2      GLN  16 -19.000  -4.066   5.625
  510    H    MET  17           H        MET  17 -14.198   0.722   3.930
  511    HA   MET  17           HA       MET  17 -12.373  -1.373   4.470
  512    HB2  MET  17           2HB      MET  17 -11.880   1.543   3.828
  513    HB3  MET  17           1HB      MET  17 -10.622   0.316   3.889
  514    HG2  MET  17           2HG      MET  17 -12.945   0.431   1.980
  515    HG3  MET  17           1HG      MET  17 -11.246   0.715   1.611
  516    HE1  MET  17           3HE      MET  17  -9.439  -1.200   1.304
  517    HE2  MET  17           1HE      MET  17  -9.672  -2.826   1.952
  518    HE3  MET  17           2HE      MET  17  -9.649  -1.437   3.038
  519    H    LEU  18           H        LEU  18 -13.170   1.629   6.125
  520    HA   LEU  18           HA       LEU  18 -11.170   1.571   8.087
  521    HB2  LEU  18           2HB      LEU  18 -12.565   3.530   7.618
  522    HB3  LEU  18           1HB      LEU  18 -13.973   2.686   8.231
  523    HG   LEU  18           HG       LEU  18 -12.846   2.590  10.472
  524   HD11  LEU  18          1HD1      LEU  18 -10.885   4.393   9.070
  525   HD12  LEU  18          2HD1      LEU  18 -10.552   2.856   9.870
  526   HD13  LEU  18          3HD1      LEU  18 -11.024   4.262  10.824
  527   HD21  LEU  18          3HD2      LEU  18 -14.563   4.256   9.867
  528   HD22  LEU  18          1HD2      LEU  18 -13.281   5.352   9.349
  529   HD23  LEU  18          2HD2      LEU  18 -13.397   4.867  11.041
  530    H    SER  19           H        SER  19 -14.492   0.297   8.122
  531    HA   SER  19           HA       SER  19 -14.339  -0.798  10.731
  532    HB2  SER  19           2HB      SER  19 -16.185  -1.359   8.405
  533    HB3  SER  19           1HB      SER  19 -16.377  -2.112   9.986
  534    HG   SER  19           HG       SER  19 -16.703  -0.093  10.890
  535    H    MET  20           H        MET  20 -13.197  -1.869   7.672
  536    HA   MET  20           HA       MET  20 -13.056  -4.661   8.363
  537    HB2  MET  20           2HB      MET  20 -13.251  -3.648   6.011
  538    HB3  MET  20           1HB      MET  20 -11.532  -3.307   6.143
  539    HG2  MET  20           2HG      MET  20 -11.035  -5.645   6.354
  540    HG3  MET  20           1HG      MET  20 -12.749  -6.048   6.420
  541    HE1  MET  20           3HE      MET  20 -14.027  -4.216   4.167
  542    HE2  MET  20           1HE      MET  20 -14.385  -5.928   4.398
  543    HE3  MET  20           2HE      MET  20 -13.959  -5.324   2.797
  544    H    GLY  21           H        GLY  21 -11.370  -1.964   9.300
  545    HA2  GLY  21           2HA      GLY  21  -9.626  -2.041  10.885
  546    HA3  GLY  21           1HA      GLY  21  -9.172  -3.627  10.281
  547    H    PHE  22           H        PHE  22  -9.774  -1.375   7.815
  548    HA   PHE  22           HA       PHE  22  -6.900  -1.207   7.328
  549    HB2  PHE  22           2HB      PHE  22  -9.315  -0.924   5.566
  550    HB3  PHE  22           1HB      PHE  22  -7.761  -0.267   5.062
  551    HD1  PHE  22           1HD      PHE  22  -9.378  -3.407   6.212
  552    HD2  PHE  22           2HD      PHE  22  -6.198  -1.625   4.015
  553    HE1  PHE  22           1HE      PHE  22  -8.702  -5.631   5.390
  554    HE2  PHE  22           2HE      PHE  22  -5.518  -3.837   3.196
  555    HZ   PHE  22           HZ       PHE  22  -6.770  -5.847   3.884
  556    H    SER  23           H        SER  23  -5.835   0.550   7.753
  557    HA   SER  23           HA       SER  23  -6.978   3.178   7.374
  558    HB2  SER  23           2HB      SER  23  -5.831   2.476  10.088
  559    HB3  SER  23           1HB      SER  23  -6.672   3.953   9.616
  560    HG   SER  23           HG       SER  23  -8.429   2.220   9.105
  561    H    ASP  24           H        ASP  24  -5.421   4.544   6.675
  562    HA   ASP  24           HA       ASP  24  -2.736   3.469   6.413
  563    HB2  ASP  24           2HB      ASP  24  -2.394   5.577   5.015
  564    HB3  ASP  24           1HB      ASP  24  -3.520   4.379   4.395
  565    H    GLU  25           H        GLU  25  -0.844   4.678   6.913
  566    HA   GLU  25           HA       GLU  25  -1.173   6.302   9.338
  567    HB2  GLU  25           2HB      GLU  25   1.562   5.646   8.474
  568    HB3  GLU  25           1HB      GLU  25   0.816   5.502  10.056
  569    HG2  GLU  25           2HG      GLU  25   1.211   3.315   9.595
  570    HG3  GLU  25           1HG      GLU  25  -0.418   3.474   8.942
  571    H    GLY  26           H        GLY  26  -0.092   6.457   6.043
  572    HA2  GLY  26           2HA      GLY  26   0.731   9.258   6.467
  573    HA3  GLY  26           1HA      GLY  26   1.418   8.217   5.230
  574    H    GLY  27           H        GLY  27  -1.921   7.799   5.622
  575    HA2  GLY  27           2HA      GLY  27  -3.761   8.512   4.439
  576    HA3  GLY  27           1HA      GLY  27  -2.839   9.935   3.976
  577    H    TRP  28           H        TRP  28  -2.036   6.538   3.298
  578    HA   TRP  28           HA       TRP  28  -1.986   7.255   0.471
  579    HB2  TRP  28           2HB      TRP  28  -0.681   5.211   0.119
  580    HB3  TRP  28           1HB      TRP  28   0.062   6.287   1.293
  581    HD1  TRP  28           HD       TRP  28  -0.002   5.469   3.888
  582    HE1  TRP  28           1HE      TRP  28  -0.082   3.099   4.893
  583    HE3  TRP  28           3HE      TRP  28  -1.613   2.918  -0.239
  584    HZ2  TRP  28           2HZ      TRP  28  -0.747   0.478   4.020
  585    HZ3  TRP  28           3HZ      TRP  28  -1.942   0.488  -0.070
  586    HH2  TRP  28           HH       TRP  28  -1.518  -0.702   2.019
  587    H    LEU  29           H        LEU  29  -3.914   5.452   2.655
  588    HA   LEU  29           HA       LEU  29  -4.944   3.559   0.769
  589    HB2  LEU  29           2HB      LEU  29  -5.092   3.175   3.190
  590    HB3  LEU  29           1HB      LEU  29  -6.123   4.583   3.357
  591    HG   LEU  29           HG       LEU  29  -7.772   3.389   1.825
  592   HD11  LEU  29          1HD1      LEU  29  -6.242   1.724   0.917
  593   HD12  LEU  29          2HD1      LEU  29  -7.602   0.956   1.736
  594   HD13  LEU  29          3HD1      LEU  29  -6.027   1.031   2.524
  595   HD21  LEU  29          3HD2      LEU  29  -7.132   2.237   4.535
  596   HD22  LEU  29          1HD2      LEU  29  -8.650   2.005   3.668
  597   HD23  LEU  29          2HD2      LEU  29  -8.172   3.619   4.191
  598    H    THR  30           H        THR  30  -5.814   6.775   1.853
  599    HA   THR  30           HA       THR  30  -8.282   6.925   0.458
  600    HB   THR  30           HB       THR  30  -7.683   8.435   2.344
  601    HG1  THR  30           1HG      THR  30  -8.539   9.422  -0.149
  602   HG21  THR  30          3HG2      THR  30  -5.853   9.740   0.325
  603   HG22  THR  30          1HG2      THR  30  -5.352   8.882   1.779
  604   HG23  THR  30          2HG2      THR  30  -6.257  10.391   1.914
  605    H    ARG  31           H        ARG  31  -5.064   6.950  -0.560
  606    HA   ARG  31           HA       ARG  31  -5.573   8.425  -3.027
  607    HB2  ARG  31           2HB      ARG  31  -3.054   7.013  -2.117
  608    HB3  ARG  31           1HB      ARG  31  -3.192   8.128  -3.469
  609    HG2  ARG  31           2HG      ARG  31  -3.865   8.998  -0.688
  610    HG3  ARG  31           1HG      ARG  31  -2.194   8.962  -1.252
  611    HD2  ARG  31           2HD      ARG  31  -4.124  10.263  -3.051
  612    HD3  ARG  31           1HD      ARG  31  -3.836  11.084  -1.520
  613    HE   ARG  31           HE       ARG  31  -1.478  10.290  -3.030
  614   HH11  ARG  31          1HH1      ARG  31  -3.735  12.835  -2.189
  615   HH12  ARG  31          2HH1      ARG  31  -2.641  14.113  -2.613
  616   HH21  ARG  31          1HH2      ARG  31  -0.043  11.961  -3.602
  617   HH22  ARG  31          2HH2      ARG  31  -0.535  13.613  -3.423
  618    H    LEU  32           H        LEU  32  -4.983   5.199  -1.822
  619    HA   LEU  32           HA       LEU  32  -4.628   3.812  -4.215
  620    HB2  LEU  32           2HB      LEU  32  -4.216   2.914  -1.946
  621    HB3  LEU  32           1HB      LEU  32  -5.948   2.848  -1.675
  622    HG   LEU  32           HG       LEU  32  -5.490   1.417  -4.052
  623   HD11  LEU  32          1HD1      LEU  32  -3.103   1.367  -3.355
  624   HD12  LEU  32          2HD1      LEU  32  -3.853  -0.225  -3.461
  625   HD13  LEU  32          3HD1      LEU  32  -3.597   0.523  -1.886
  626   HD21  LEU  32          3HD2      LEU  32  -6.273  -0.478  -2.727
  627   HD22  LEU  32          1HD2      LEU  32  -7.222   0.973  -2.395
  628   HD23  LEU  32          2HD2      LEU  32  -5.995   0.437  -1.246
  629    H    LEU  33           H        LEU  33  -7.554   4.775  -2.518
  630    HA   LEU  33           HA       LEU  33  -9.369   3.291  -4.127
  631    HB2  LEU  33           2HB      LEU  33  -9.830   5.760  -2.448
  632    HB3  LEU  33           1HB      LEU  33 -11.092   4.745  -3.117
  633    HG   LEU  33           HG       LEU  33  -9.032   3.772  -1.136
  634   HD11  LEU  33          1HD1      LEU  33 -10.799   3.917   0.537
  635   HD12  LEU  33          2HD1      LEU  33 -11.870   4.664  -0.650
  636   HD13  LEU  33          3HD1      LEU  33 -10.409   5.504  -0.127
  637   HD21  LEU  33          3HD2      LEU  33 -10.521   1.883  -0.869
  638   HD22  LEU  33          1HD2      LEU  33 -10.035   2.039  -2.557
  639   HD23  LEU  33          2HD2      LEU  33 -11.641   2.563  -2.049
  640    H    GLN  34           H        GLN  34  -7.495   5.973  -4.847
  641    HA   GLN  34           HA       GLN  34  -9.433   7.116  -6.711
  642    HB2  GLN  34           2HB      GLN  34  -6.596   8.016  -6.201
  643    HB3  GLN  34           1HB      GLN  34  -7.865   8.913  -7.022
  644    HG2  GLN  34           2HG      GLN  34  -7.792   8.183  -4.102
  645    HG3  GLN  34           1HG      GLN  34  -7.513   9.779  -4.797
  646   HE21  GLN  34          1HE2      GLN  34  -9.542   8.684  -2.894
  647   HE22  GLN  34          2HE2      GLN  34 -11.076   9.149  -3.557
  648    H    THR  35           H        THR  35  -6.330   5.433  -6.682
  649    HA   THR  35           HA       THR  35  -6.186   5.473  -9.581
  650    HB   THR  35           HB       THR  35  -4.085   4.019  -9.059
  651    HG1  THR  35           1HG      THR  35  -3.281   4.451  -6.922
  652   HG21  THR  35          3HG2      THR  35  -4.011   6.331  -9.862
  653   HG22  THR  35          1HG2      THR  35  -2.772   6.045  -8.638
  654   HG23  THR  35          2HG2      THR  35  -4.246   6.917  -8.214
  655    H    LYS  36           H        LYS  36  -6.732   3.121  -6.985
  656    HA   LYS  36           HA       LYS  36  -7.112   1.030  -9.008
  657    HB2  LYS  36           2HB      LYS  36  -6.715   0.953  -6.025
  658    HB3  LYS  36           1HB      LYS  36  -7.317  -0.447  -6.903
  659    HG2  LYS  36           2HG      LYS  36  -5.141  -0.977  -7.056
  660    HG3  LYS  36           1HG      LYS  36  -5.150   0.170  -8.395
  661    HD2  LYS  36           2HD      LYS  36  -4.468   1.955  -6.821
  662    HD3  LYS  36           1HD      LYS  36  -4.366   0.747  -5.539
  663    HE2  LYS  36           2HE      LYS  36  -2.217   0.580  -6.160
  664    HE3  LYS  36           1HE      LYS  36  -2.852  -0.404  -7.478
  665    HZ1  LYS  36           3HZ      LYS  36  -1.411   1.234  -8.381
  666    HZ2  LYS  36           1HZ      LYS  36  -2.191   2.492  -7.559
  667    HZ3  LYS  36           2HZ      LYS  36  -2.986   1.663  -8.805
  668    H    ASN  37           H        ASN  37  -8.942   3.349  -7.984
  669    HA   ASN  37           HA       ASN  37 -11.176   3.736  -7.961
  670    HB2  ASN  37           2HB      ASN  37 -11.195   1.997  -9.790
  671    HB3  ASN  37           1HB      ASN  37 -11.569   0.796  -8.559
  672   HD21  ASN  37          1HD2      ASN  37 -13.558   0.279  -9.427
  673   HD22  ASN  37          2HD2      ASN  37 -14.909   1.358  -9.360
  674    H    TYR  38           H        TYR  38 -13.247   3.049  -6.791
  675    HA   TYR  38           HA       TYR  38 -12.533   2.491  -4.041
  676    HB2  TYR  38           2HB      TYR  38 -15.149   3.276  -5.339
  677    HB3  TYR  38           1HB      TYR  38 -14.950   3.026  -3.610
  678    HD1  TYR  38           2HD      TYR  38 -13.973   5.158  -6.461
  679    HD2  TYR  38           1HD      TYR  38 -13.980   4.708  -2.230
  680    HE1  TYR  38           2HE      TYR  38 -13.295   7.511  -6.215
  681    HE2  TYR  38           1HE      TYR  38 -13.306   7.056  -1.974
  682    HH   TYR  38           HH       TYR  38 -13.402   9.293  -4.530
  683    H    ASP  39           H        ASP  39 -12.268   0.297  -5.852
  684    HA   ASP  39           HA       ASP  39 -14.530  -1.448  -5.296
  685    HB2  ASP  39           2HB      ASP  39 -13.358  -1.389  -7.553
  686    HB3  ASP  39           1HB      ASP  39 -11.991  -2.168  -6.762
  687    H    ILE  40           H        ILE  40 -14.582  -2.351  -3.383
  688    HA   ILE  40           HA       ILE  40 -12.446  -2.585  -1.596
  689    HB   ILE  40           HB       ILE  40 -14.993  -4.215  -1.639
  690   HG12  ILE  40          2HG1      ILE  40 -14.421  -1.645  -0.149
  691   HG13  ILE  40          1HG1      ILE  40 -15.289  -1.714  -1.679
  692   HG21  ILE  40          1HG2      ILE  40 -13.125  -5.039  -0.162
  693   HG22  ILE  40          2HG2      ILE  40 -14.630  -4.644   0.670
  694   HG23  ILE  40          3HG2      ILE  40 -13.270  -3.524   0.732
  695   HD11  ILE  40          3HD1      ILE  40 -16.150  -3.093   0.846
  696   HD12  ILE  40          1HD1      ILE  40 -17.044  -3.017  -0.671
  697   HD13  ILE  40          2HD1      ILE  40 -16.774  -1.549   0.267
  698    H    GLY  41           H        GLY  41 -13.827  -4.939  -3.854
  699    HA2  GLY  41           2HA      GLY  41 -12.360  -7.188  -3.030
  700    HA3  GLY  41           1HA      GLY  41 -13.035  -6.944  -4.634
  701    H    ALA  42           H        ALA  42 -11.669  -4.843  -5.609
  702    HA   ALA  42           HA       ALA  42  -9.209  -5.995  -6.380
  703    HB1  ALA  42           1HB      ALA  42  -8.808  -3.932  -7.587
  704    HB2  ALA  42           2HB      ALA  42 -10.081  -3.122  -6.675
  705    HB3  ALA  42           3HB      ALA  42 -10.487  -4.429  -7.786
  706    H    ALA  43           H        ALA  43 -10.023  -3.464  -4.063
  707    HA   ALA  43           HA       ALA  43  -7.403  -2.642  -3.444
  708    HB1  ALA  43           1HB      ALA  43  -9.881  -2.565  -1.728
  709    HB2  ALA  43           2HB      ALA  43  -9.354  -1.317  -2.856
  710    HB3  ALA  43           3HB      ALA  43  -8.394  -1.671  -1.420
  711    H    LEU  44           H        LEU  44  -9.512  -5.042  -1.921
  712    HA   LEU  44           HA       LEU  44  -7.807  -5.763   0.189
  713    HB2  LEU  44           2HB      LEU  44 -10.250  -6.283  -0.075
  714    HB3  LEU  44           1HB      LEU  44  -9.802  -7.525  -1.230
  715    HG   LEU  44           HG       LEU  44  -8.465  -8.619   0.594
  716   HD11  LEU  44          1HD1      LEU  44  -9.015  -8.008   2.910
  717   HD12  LEU  44          2HD1      LEU  44  -9.912  -6.609   2.316
  718   HD13  LEU  44          3HD1      LEU  44  -8.170  -6.714   2.064
  719   HD21  LEU  44          3HD2      LEU  44 -10.688  -9.402  -0.066
  720   HD22  LEU  44          1HD2      LEU  44 -11.421  -8.291   1.093
  721   HD23  LEU  44          2HD2      LEU  44 -10.409  -9.618   1.661
  722    H    ASP  45           H        ASP  45  -8.118  -6.979  -3.093
  723    HA   ASP  45           HA       ASP  45  -6.234  -9.114  -2.751
  724    HB2  ASP  45           2HB      ASP  45  -8.166  -9.038  -4.407
  725    HB3  ASP  45           1HB      ASP  45  -7.191  -7.930  -5.360
  726    H    THR  46           H        THR  46  -5.812  -5.819  -3.006
  727    HA   THR  46           HA       THR  46  -3.582  -5.699  -4.764
  728    HB   THR  46           HB       THR  46  -4.495  -3.770  -2.613
  729    HG1  THR  46           1HG      THR  46  -5.912  -4.069  -4.448
  730   HG21  THR  46          3HG2      THR  46  -3.041  -2.128  -3.619
  731   HG22  THR  46          1HG2      THR  46  -2.502  -3.287  -4.834
  732   HG23  THR  46          2HG2      THR  46  -2.082  -3.524  -3.138
  733    H    ILE  47           H        ILE  47  -3.862  -6.273  -1.280
  734    HA   ILE  47           HA       ILE  47  -0.917  -6.401  -1.179
  735    HB   ILE  47           HB       ILE  47  -1.082  -6.015   1.247
  736   HG12  ILE  47          2HG1      ILE  47  -3.994  -5.401   0.722
  737   HG13  ILE  47          1HG1      ILE  47  -3.424  -6.890   1.463
  738   HG21  ILE  47          1HG2      ILE  47  -2.449  -3.879  -0.384
  739   HG22  ILE  47          2HG2      ILE  47  -0.710  -4.164  -0.343
  740   HG23  ILE  47          3HG2      ILE  47  -1.554  -3.648   1.118
  741   HD11  ILE  47          3HD1      ILE  47  -4.166  -5.403   3.177
  742   HD12  ILE  47          1HD1      ILE  47  -3.145  -4.107   2.555
  743   HD13  ILE  47          2HD1      ILE  47  -2.411  -5.538   3.273
  744    H    GLN  48           H        GLN  48  -3.127  -8.525  -1.728
  745    HA   GLN  48           HA       GLN  48  -3.261 -10.780  -1.519
  746    HB2  GLN  48           2HB      GLN  48  -0.600 -10.218  -0.479
  747    HB3  GLN  48           1HB      GLN  48  -1.322 -11.642   0.261
  748    HG2  GLN  48           2HG      GLN  48  -1.133 -11.206  -2.708
  749    HG3  GLN  48           1HG      GLN  48   0.063 -12.087  -1.759
  750   HE21  GLN  48          1HE2      GLN  48  -1.728 -12.937  -3.938
  751   HE22  GLN  48          2HE2      GLN  48  -2.607 -14.288  -3.316
  752    H    TYR  49           H        TYR  49  -2.746  -9.058   1.525
  753    HA   TYR  49           HA       TYR  49  -3.869 -11.002   3.226
  754    HB2  TYR  49           2HB      TYR  49  -3.759  -7.994   3.543
  755    HB3  TYR  49           1HB      TYR  49  -4.190  -9.121   4.823
  756    HD1  TYR  49           2HD      TYR  49  -2.463 -10.749   5.641
  757    HD2  TYR  49           1HD      TYR  49  -1.492  -7.543   3.025
  758    HE1  TYR  49           2HE      TYR  49  -0.088 -10.990   6.236
  759    HE2  TYR  49           1HE      TYR  49   0.879  -7.766   3.620
  760    HH   TYR  49           HH       TYR  49   2.362  -8.758   4.955
  761    H    SER  50           H        SER  50  -5.725 -11.812   2.244
  762    HA   SER  50           HA       SER  50  -8.023  -9.975   2.185
  763    HB2  SER  50           2HB      SER  50  -7.863 -12.605   0.714
  764    HB3  SER  50           1HB      SER  50  -8.972 -11.264   0.435
  765    HG   SER  50           HG       SER  50  -6.447 -10.393   0.197
  766    H    LYS  51           H        LYS  51  -7.117 -13.366   2.805
  767    HA   LYS  51           HA       LYS  51  -9.533 -13.912   4.238
  768    HB2  LYS  51           2HB      LYS  51  -6.934 -15.432   3.977
  769    HB3  LYS  51           1HB      LYS  51  -8.296 -16.019   4.918
  770    HG2  LYS  51           2HG      LYS  51  -9.678 -15.849   2.826
  771    HG3  LYS  51           1HG      LYS  51  -8.176 -15.546   1.953
  772    HD2  LYS  51           2HD      LYS  51  -8.681 -17.882   1.784
  773    HD3  LYS  51           1HD      LYS  51  -7.303 -17.698   2.868
  774    HE2  LYS  51           2HE      LYS  51  -9.598 -17.549   4.482
  775    HE3  LYS  51           1HE      LYS  51  -9.865 -18.885   3.366
  776    HZ1  LYS  51           3HZ      LYS  51  -7.413 -18.568   5.004
  777    HZ2  LYS  51           1HZ      LYS  51  -7.853 -19.908   4.070
  778    HZ3  LYS  51           2HZ      LYS  51  -8.737 -19.520   5.455
  779    H    HIS  52           H        HIS  52  -6.223 -13.085   5.104
  780    HA   HIS  52           HA       HIS  52  -7.079 -12.061   7.643
  781    HB2  HIS  52           2HB      HIS  52  -5.981 -14.732   7.491
  782    HB3  HIS  52           1HB      HIS  52  -4.930 -13.680   8.432
  783    HD1  HIS  52           1HD      HIS  52  -6.244 -12.332  10.432
  784    HD2  HIS  52           2HD      HIS  52  -8.093 -15.716   8.887
  785    HE1  HIS  52           1HE      HIS  52  -7.949 -13.009  12.146
  786    HE2  HIS  52           2HE      HIS  52  -9.132 -14.987  11.136
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1  18.825  20.062  -2.414
    2    H2   GLY   1           2HT      GLY   1  17.550  18.964  -2.257
    3    H3   GLY   1           3HT      GLY   1  17.666  19.935  -3.634
    4    HA2  GLY   1           1HA      GLY   1  18.394  17.799  -4.271
    5    HA3  GLY   1           2HA      GLY   1  19.813  18.830  -4.161
    6    H    SER   2           H        SER   2  20.650  16.469  -4.038
    7    HA   SER   2           HA       SER   2  20.474  15.362  -1.352
    8    HB2  SER   2           2HB      SER   2  22.084  14.263  -3.653
    9    HB3  SER   2           1HB      SER   2  21.481  13.404  -2.235
   10    HG   SER   2           HG       SER   2  20.274  13.801  -4.598
   11    HA   PRO   3           HA       PRO   3  24.291  17.636  -0.504
   12    HB2  PRO   3           2HB      PRO   3  23.857  17.021   2.280
   13    HB3  PRO   3           1HB      PRO   3  23.701  18.580   1.468
   14    HG2  PRO   3           2HG      PRO   3  21.591  17.178   2.513
   15    HG3  PRO   3           1HG      PRO   3  21.454  18.354   1.197
   16    HD2  PRO   3           2HD      PRO   3  21.526  15.367   1.071
   17    HD3  PRO   3           1HD      PRO   3  20.559  16.519   0.125
   18    HA   PRO   4           HA       PRO   4  27.263  14.397   0.093
   19    HB2  PRO   4           2HB      PRO   4  28.741  16.094   2.006
   20    HB3  PRO   4           1HB      PRO   4  29.258  15.446   0.447
   21    HG2  PRO   4           2HG      PRO   4  28.712  18.051   0.765
   22    HG3  PRO   4           1HG      PRO   4  28.326  17.197  -0.738
   23    HD2  PRO   4           2HD      PRO   4  26.518  17.982   1.510
   24    HD3  PRO   4           1HD      PRO   4  26.233  18.045  -0.242
   25    H    GLU   5           H        GLU   5  25.664  15.823   2.780
   26    HA   GLU   5           HA       GLU   5  26.659  14.081   4.814
   27    HB2  GLU   5           2HB      GLU   5  24.170  15.793   4.733
   28    HB3  GLU   5           1HB      GLU   5  24.827  15.021   6.171
   29    HG2  GLU   5           2HG      GLU   5  26.511  16.901   4.573
   30    HG3  GLU   5           1HG      GLU   5  25.320  17.518   5.713
   31    H    ALA   6           H        ALA   6  24.373  13.761   2.315
   32    HA   ALA   6           HA       ALA   6  22.640  11.890   3.606
   33    HB1  ALA   6           1HB      ALA   6  23.039  12.503   0.681
   34    HB2  ALA   6           2HB      ALA   6  21.819  13.205   1.746
   35    HB3  ALA   6           3HB      ALA   6  21.756  11.489   1.341
   36    H    ASP   7           H        ASP   7  22.919   9.791   3.882
   37    HA   ASP   7           HA       ASP   7  25.361   8.502   3.349
   38    HB2  ASP   7           2HB      ASP   7  23.643   7.941   5.151
   39    HB3  ASP   7           1HB      ASP   7  22.733   7.121   3.891
   40    HA   PRO   8           HA       PRO   8  24.639   7.640  -0.979
   41    HB2  PRO   8           2HB      PRO   8  26.832   6.045  -1.331
   42    HB3  PRO   8           1HB      PRO   8  26.894   7.808  -1.315
   43    HG2  PRO   8           2HG      PRO   8  27.519   5.872   0.882
   44    HG3  PRO   8           1HG      PRO   8  28.386   7.344   0.403
   45    HD2  PRO   8           2HD      PRO   8  26.726   7.286   2.520
   46    HD3  PRO   8           1HD      PRO   8  26.894   8.729   1.497
   47    H    ARG   9           H        ARG   9  24.821   5.318   1.565
   48    HA   ARG   9           HA       ARG   9  24.017   3.133  -0.194
   49    HB2  ARG   9           2HB      ARG   9  24.539   3.144   2.784
   50    HB3  ARG   9           1HB      ARG   9  24.244   1.719   1.804
   51    HG2  ARG   9           2HG      ARG   9  26.325   1.742   0.880
   52    HG3  ARG   9           1HG      ARG   9  26.486   3.494   1.028
   53    HD2  ARG   9           2HD      ARG   9  26.569   1.553   3.336
   54    HD3  ARG   9           1HD      ARG   9  27.986   2.244   2.548
   55    HE   ARG   9           HE       ARG   9  25.987   4.034   3.745
   56   HH11  ARG   9          1HH1      ARG   9  29.237   2.708   3.715
   57   HH12  ARG   9          2HH1      ARG   9  29.850   3.867   4.848
   58   HH21  ARG   9          1HH2      ARG   9  26.802   5.556   5.236
   59   HH22  ARG   9          2HH2      ARG   9  28.479   5.486   5.706
   60    H    LEU  10           H        LEU  10  22.814   5.090   2.472
   61    HA   LEU  10           HA       LEU  10  20.334   3.740   2.744
   62    HB2  LEU  10           2HB      LEU  10  21.380   5.221   4.471
   63    HB3  LEU  10           1HB      LEU  10  20.955   6.598   3.473
   64    HG   LEU  10           HG       LEU  10  18.554   5.963   3.698
   65   HD11  LEU  10          1HD1      LEU  10  17.945   4.405   5.507
   66   HD12  LEU  10          2HD1      LEU  10  19.646   3.972   5.682
   67   HD13  LEU  10          3HD1      LEU  10  18.792   3.604   4.183
   68   HD21  LEU  10          3HD2      LEU  10  20.042   6.454   6.275
   69   HD22  LEU  10          1HD2      LEU  10  18.330   6.773   5.993
   70   HD23  LEU  10          2HD2      LEU  10  19.554   7.683   5.107
   71    H    ILE  11           H        ILE  11  21.389   6.501   0.817
   72    HA   ILE  11           HA       ILE  11  18.799   7.291  -0.031
   73    HB   ILE  11           HB       ILE  11  20.880   8.707  -0.161
   74   HG12  ILE  11          2HG1      ILE  11  19.324   8.442  -2.746
   75   HG13  ILE  11          1HG1      ILE  11  18.749   9.279  -1.305
   76   HG21  ILE  11          1HG2      ILE  11  22.256   8.508  -2.198
   77   HG22  ILE  11          2HG2      ILE  11  21.424   7.001  -2.590
   78   HG23  ILE  11          3HG2      ILE  11  22.410   7.112  -1.131
   79   HD11  ILE  11          3HD1      ILE  11  21.147  10.025  -2.970
   80   HD12  ILE  11          1HD1      ILE  11  20.626  10.852  -1.501
   81   HD13  ILE  11          2HD1      ILE  11  19.593  10.855  -2.929
   82    H    GLU  12           H        GLU  12  20.885   4.729  -0.964
   83    HA   GLU  12           HA       GLU  12  19.866   4.354  -3.602
   84    HB2  GLU  12           2HB      GLU  12  21.746   2.959  -1.804
   85    HB3  GLU  12           1HB      GLU  12  20.931   1.944  -2.987
   86    HG2  GLU  12           2HG      GLU  12  22.390   4.466  -3.715
   87    HG3  GLU  12           1HG      GLU  12  23.151   2.876  -3.691
   88    H    SER  13           H        SER  13  18.604   3.684  -0.538
   89    HA   SER  13           HA       SER  13  17.257   1.268  -0.958
   90    HB2  SER  13           2HB      SER  13  16.249   3.587   0.702
   91    HB3  SER  13           1HB      SER  13  15.869   1.878   0.916
   92    HG   SER  13           HG       SER  13  18.176   3.297   1.590
   93    H    LEU  14           H        LEU  14  16.418   4.567  -1.876
   94    HA   LEU  14           HA       LEU  14  13.735   4.002  -2.640
   95    HB2  LEU  14           2HB      LEU  14  15.636   6.228  -3.349
   96    HB3  LEU  14           1HB      LEU  14  14.010   6.147  -3.994
   97    HG   LEU  14           HG       LEU  14  13.422   5.957  -1.386
   98   HD11  LEU  14          1HD1      LEU  14  14.856   7.517  -0.130
   99   HD12  LEU  14          2HD1      LEU  14  15.970   7.569  -1.495
  100   HD13  LEU  14          3HD1      LEU  14  15.719   6.058  -0.621
  101   HD21  LEU  14          3HD2      LEU  14  13.999   8.530  -2.850
  102   HD22  LEU  14          1HD2      LEU  14  12.956   8.351  -1.441
  103   HD23  LEU  14          2HD2      LEU  14  12.514   7.586  -2.968
  104    H    SER  15           H        SER  15  16.759   4.329  -4.471
  105    HA   SER  15           HA       SER  15  15.659   3.729  -6.990
  106    HB2  SER  15           2HB      SER  15  18.385   2.898  -6.885
  107    HB3  SER  15           1HB      SER  15  17.724   4.388  -7.563
  108    HG   SER  15           HG       SER  15  19.336   4.358  -5.637
  109    H    GLN  16           H        GLN  16  16.918   1.748  -4.392
  110    HA   GLN  16           HA       GLN  16  17.196  -0.694  -5.723
  111    HB2  GLN  16           2HB      GLN  16  18.013  -0.312  -3.442
  112    HB3  GLN  16           1HB      GLN  16  16.359  -0.173  -2.860
  113    HG2  GLN  16           2HG      GLN  16  17.105  -2.336  -2.288
  114    HG3  GLN  16           1HG      GLN  16  15.995  -2.530  -3.643
  115   HE21  GLN  16          1HE2      GLN  16  16.853  -4.493  -4.266
  116   HE22  GLN  16          2HE2      GLN  16  18.409  -4.637  -5.001
  117    H    MET  17           H        MET  17  14.396   0.715  -4.058
  118    HA   MET  17           HA       MET  17  12.633  -1.440  -4.504
  119    HB2  MET  17           2HB      MET  17  12.028   1.500  -4.117
  120    HB3  MET  17           1HB      MET  17  10.829   0.218  -4.070
  121    HG2  MET  17           2HG      MET  17  13.171   0.480  -2.199
  122    HG3  MET  17           1HG      MET  17  11.513   0.954  -1.835
  123    HE1  MET  17           3HE      MET  17   9.622  -0.640  -1.180
  124    HE2  MET  17           1HE      MET  17   9.621  -2.372  -1.519
  125    HE3  MET  17           2HE      MET  17   9.635  -1.215  -2.848
  126    H    LEU  18           H        LEU  18  13.348   1.481  -6.346
  127    HA   LEU  18           HA       LEU  18  11.420   1.177  -8.359
  128    HB2  LEU  18           2HB      LEU  18  12.897   3.191  -7.864
  129    HB3  LEU  18           1HB      LEU  18  14.166   2.357  -8.737
  130    HG   LEU  18           HG       LEU  18  12.401   2.259 -10.670
  131   HD11  LEU  18          1HD1      LEU  18  11.402   4.573  -9.021
  132   HD12  LEU  18          2HD1      LEU  18  10.517   3.096  -9.409
  133   HD13  LEU  18          3HD1      LEU  18  10.941   4.231 -10.689
  134   HD21  LEU  18          3HD2      LEU  18  13.224   4.434 -11.482
  135   HD22  LEU  18          1HD2      LEU  18  14.509   3.431 -10.812
  136   HD23  LEU  18          2HD2      LEU  18  13.860   4.775  -9.872
  137    H    SER  19           H        SER  19  14.743  -0.011  -8.100
  138    HA   SER  19           HA       SER  19  14.854  -1.207 -10.668
  139    HB2  SER  19           2HB      SER  19  16.771  -0.594  -8.996
  140    HB3  SER  19           1HB      SER  19  16.465  -2.198  -8.332
  141    HG   SER  19           HG       SER  19  16.651  -2.193 -11.061
  142    H    MET  20           H        MET  20  13.566  -2.222  -7.605
  143    HA   MET  20           HA       MET  20  13.425  -5.019  -8.262
  144    HB2  MET  20           2HB      MET  20  12.401  -3.310  -6.020
  145    HB3  MET  20           1HB      MET  20  11.804  -4.953  -6.213
  146    HG2  MET  20           2HG      MET  20  14.732  -4.325  -6.052
  147    HG3  MET  20           1HG      MET  20  13.740  -4.589  -4.618
  148    HE1  MET  20           3HE      MET  20  11.771  -6.943  -5.295
  149    HE2  MET  20           1HE      MET  20  12.773  -6.772  -3.855
  150    HE3  MET  20           2HE      MET  20  12.780  -8.287  -4.761
  151    H    GLY  21           H        GLY  21  11.782  -2.409  -9.392
  152    HA2  GLY  21           2HA      GLY  21  10.031  -2.519 -10.957
  153    HA3  GLY  21           1HA      GLY  21   9.594  -4.101 -10.321
  154    H    PHE  22           H        PHE  22  10.165  -1.770  -7.926
  155    HA   PHE  22           HA       PHE  22   7.285  -1.577  -7.443
  156    HB2  PHE  22           2HB      PHE  22   9.360  -2.207  -5.744
  157    HB3  PHE  22           1HB      PHE  22   9.090  -0.506  -5.389
  158    HD1  PHE  22           2HD      PHE  22   6.632   0.185  -4.921
  159    HD2  PHE  22           1HD      PHE  22   8.077  -3.809  -4.712
  160    HE1  PHE  22           2HE      PHE  22   4.729  -0.426  -3.482
  161    HE2  PHE  22           1HE      PHE  22   6.186  -4.430  -3.270
  162    HZ   PHE  22           HZ       PHE  22   4.506  -2.733  -2.655
  163    H    SER  23           H        SER  23   6.266   0.239  -7.830
  164    HA   SER  23           HA       SER  23   7.617   2.797  -7.587
  165    HB2  SER  23           2HB      SER  23   6.113   2.063 -10.114
  166    HB3  SER  23           1HB      SER  23   7.029   3.540  -9.804
  167    HG   SER  23           HG       SER  23   8.768   1.707  -9.408
  168    H    ASP  24           H        ASP  24   6.039   4.597  -7.605
  169    HA   ASP  24           HA       ASP  24   3.372   3.641  -6.815
  170    HB2  ASP  24           2HB      ASP  24   3.237   5.713  -5.377
  171    HB3  ASP  24           1HB      ASP  24   4.353   4.474  -4.827
  172    H    GLU  25           H        GLU  25   1.590   4.822  -7.382
  173    HA   GLU  25           HA       GLU  25   1.969   6.550  -9.724
  174    HB2  GLU  25           2HB      GLU  25  -0.788   5.893  -9.217
  175    HB3  GLU  25           1HB      GLU  25   0.209   5.466 -10.600
  176    HG2  GLU  25           2HG      GLU  25  -0.493   3.410  -9.802
  177    HG3  GLU  25           1HG      GLU  25   1.113   3.583  -9.101
  178    H    GLY  26           H        GLY  26   0.225   6.286  -6.666
  179    HA2  GLY  26           2HA      GLY  26  -0.626   9.074  -6.837
  180    HA3  GLY  26           1HA      GLY  26  -1.080   7.919  -5.592
  181    H    GLY  27           H        GLY  27   2.109   7.494  -5.830
  182    HA2  GLY  27           2HA      GLY  27   3.987   8.440  -4.834
  183    HA3  GLY  27           1HA      GLY  27   3.012   9.826  -4.377
  184    H    TRP  28           H        TRP  28   2.394   6.420  -3.646
  185    HA   TRP  28           HA       TRP  28   2.333   7.162  -0.828
  186    HB2  TRP  28           2HB      TRP  28   1.093   5.128  -0.434
  187    HB3  TRP  28           1HB      TRP  28   0.355   6.031  -1.749
  188    HD1  TRP  28           HD       TRP  28   0.916   5.012  -4.301
  189    HE1  TRP  28           1HE      TRP  28   1.110   2.549  -5.018
  190    HE3  TRP  28           3HE      TRP  28   1.738   2.904   0.282
  191    HZ2  TRP  28           2HZ      TRP  28   1.551   0.027  -3.782
  192    HZ3  TRP  28           3HZ      TRP  28   2.033   0.470   0.430
  193    HH2  TRP  28           HH       TRP  28   1.941  -0.936  -1.560
  194    H    LEU  29           H        LEU  29   4.408   5.611  -3.023
  195    HA   LEU  29           HA       LEU  29   5.546   3.690  -1.248
  196    HB2  LEU  29           2HB      LEU  29   5.819   3.457  -3.654
  197    HB3  LEU  29           1HB      LEU  29   6.679   4.984  -3.732
  198    HG   LEU  29           HG       LEU  29   8.467   3.954  -2.295
  199   HD11  LEU  29          1HD1      LEU  29   7.129   2.156  -1.320
  200   HD12  LEU  29          2HD1      LEU  29   8.558   1.526  -2.140
  201   HD13  LEU  29          3HD1      LEU  29   6.973   1.408  -2.908
  202   HD21  LEU  29          3HD2      LEU  29   7.883   2.667  -4.958
  203   HD22  LEU  29          1HD2      LEU  29   9.445   2.645  -4.137
  204   HD23  LEU  29          2HD2      LEU  29   8.756   4.174  -4.692
  205    H    THR  30           H        THR  30   6.378   7.001  -2.171
  206    HA   THR  30           HA       THR  30   8.717   7.169  -0.599
  207    HB   THR  30           HB       THR  30   8.277   8.769  -2.398
  208    HG1  THR  30           1HG      THR  30   8.603   9.777   0.233
  209   HG21  THR  30          3HG2      THR  30   6.083   9.817  -0.607
  210   HG22  THR  30          1HG2      THR  30   5.867   9.025  -2.163
  211   HG23  THR  30          2HG2      THR  30   6.660  10.601  -2.080
  212    H    ARG  31           H        ARG  31   5.350   7.402   0.173
  213    HA   ARG  31           HA       ARG  31   5.778   8.666   2.735
  214    HB2  ARG  31           2HB      ARG  31   3.344   7.442   1.436
  215    HB3  ARG  31           1HB      ARG  31   3.324   8.114   3.058
  216    HG2  ARG  31           2HG      ARG  31   4.178   9.712   0.668
  217    HG3  ARG  31           1HG      ARG  31   2.498   9.599   1.188
  218    HD2  ARG  31           2HD      ARG  31   4.670  10.421   3.084
  219    HD3  ARG  31           1HD      ARG  31   3.903  11.589   2.012
  220    HE   ARG  31           HE       ARG  31   1.878  10.206   3.345
  221   HH11  ARG  31          1HH1      ARG  31   4.467  12.439   4.088
  222   HH12  ARG  31          2HH1      ARG  31   3.658  13.117   5.463
  223   HH21  ARG  31          1HH2      ARG  31   0.807  11.108   5.170
  224   HH22  ARG  31          2HH2      ARG  31   1.589  12.360   6.078
  225    H    LEU  32           H        LEU  32   5.334   5.453   1.433
  226    HA   LEU  32           HA       LEU  32   4.951   4.112   3.899
  227    HB2  LEU  32           2HB      LEU  32   4.357   3.183   1.672
  228    HB3  LEU  32           1HB      LEU  32   6.067   3.029   1.313
  229    HG   LEU  32           HG       LEU  32   6.236   1.481   3.309
  230   HD11  LEU  32          1HD1      LEU  32   4.215   2.143   4.463
  231   HD12  LEU  32          2HD1      LEU  32   4.142   0.431   4.048
  232   HD13  LEU  32          3HD1      LEU  32   3.231   1.610   3.102
  233   HD21  LEU  32          3HD2      LEU  32   5.301  -0.434   2.091
  234   HD22  LEU  32          1HD2      LEU  32   6.214   0.641   1.031
  235   HD23  LEU  32          2HD2      LEU  32   4.452   0.676   1.015
  236    H    LEU  33           H        LEU  33   7.788   4.858   1.942
  237    HA   LEU  33           HA       LEU  33   9.656   3.419   3.521
  238    HB2  LEU  33           2HB      LEU  33  10.006   5.758   1.650
  239    HB3  LEU  33           1HB      LEU  33  11.338   4.881   2.372
  240    HG   LEU  33           HG       LEU  33   9.281   3.607   0.569
  241   HD11  LEU  33          1HD1      LEU  33  10.538   5.307  -0.648
  242   HD12  LEU  33          2HD1      LEU  33  11.014   3.686  -1.157
  243   HD13  LEU  33          3HD1      LEU  33  12.053   4.606  -0.072
  244   HD21  LEU  33          3HD2      LEU  33  10.385   2.048   2.083
  245   HD22  LEU  33          1HD2      LEU  33  11.959   2.655   1.572
  246   HD23  LEU  33          2HD2      LEU  33  10.929   1.800   0.424
  247    H    GLN  34           H        GLN  34   7.941   6.271   4.077
  248    HA   GLN  34           HA       GLN  34   9.928   7.350   5.919
  249    HB2  GLN  34           2HB      GLN  34   7.364   8.376   4.759
  250    HB3  GLN  34           1HB      GLN  34   7.991   9.087   6.241
  251    HG2  GLN  34           2HG      GLN  34   9.544   8.889   3.669
  252    HG3  GLN  34           1HG      GLN  34   8.624  10.304   4.181
  253   HE21  GLN  34          1HE2      GLN  34  11.469   8.398   4.698
  254   HE22  GLN  34          2HE2      GLN  34  12.261   9.503   5.766
  255    H    THR  35           H        THR  35   6.877   5.628   5.925
  256    HA   THR  35           HA       THR  35   6.540   6.016   8.790
  257    HB   THR  35           HB       THR  35   4.593   4.281   8.257
  258    HG1  THR  35           1HG      THR  35   4.757   5.647   5.774
  259   HG21  THR  35          3HG2      THR  35   4.441   7.182   7.422
  260   HG22  THR  35          1HG2      THR  35   4.377   6.609   9.090
  261   HG23  THR  35          2HG2      THR  35   3.106   6.156   7.956
  262    H    LYS  36           H        LYS  36   7.183   3.348   6.537
  263    HA   LYS  36           HA       LYS  36   7.690   1.573   8.816
  264    HB2  LYS  36           2HB      LYS  36   6.245   1.041   6.676
  265    HB3  LYS  36           1HB      LYS  36   7.807   0.668   5.971
  266    HG2  LYS  36           2HG      LYS  36   8.192  -1.097   7.464
  267    HG3  LYS  36           1HG      LYS  36   6.908  -0.566   8.550
  268    HD2  LYS  36           2HD      LYS  36   5.222  -1.155   6.926
  269    HD3  LYS  36           1HD      LYS  36   6.466  -1.553   5.736
  270    HE2  LYS  36           2HE      LYS  36   5.669  -3.598   6.651
  271    HE3  LYS  36           1HE      LYS  36   7.277  -3.322   7.307
  272    HZ1  LYS  36           3HZ      LYS  36   6.380  -3.609   9.296
  273    HZ2  LYS  36           1HZ      LYS  36   4.804  -3.599   8.675
  274    HZ3  LYS  36           2HZ      LYS  36   5.558  -2.146   9.093
  275    H    ASN  37           H        ASN  37   9.423   3.785   7.490
  276    HA   ASN  37           HA       ASN  37  11.648   4.236   7.349
  277    HB2  ASN  37           2HB      ASN  37  11.777   2.616   9.321
  278    HB3  ASN  37           1HB      ASN  37  12.227   1.382   8.151
  279   HD21  ASN  37          1HD2      ASN  37  14.283   1.018   8.772
  280   HD22  ASN  37          2HD2      ASN  37  15.531   2.221   8.741
  281    H    TYR  38           H        TYR  38  13.719   3.407   6.184
  282    HA   TYR  38           HA       TYR  38  12.906   2.656   3.516
  283    HB2  TYR  38           2HB      TYR  38  15.614   3.366   4.664
  284    HB3  TYR  38           1HB      TYR  38  15.301   3.065   2.961
  285    HD1  TYR  38           1HD      TYR  38  13.766   4.613   1.710
  286    HD2  TYR  38           2HD      TYR  38  15.175   5.484   5.630
  287    HE1  TYR  38           1HE      TYR  38  13.184   6.980   1.387
  288    HE2  TYR  38           2HE      TYR  38  14.598   7.855   5.317
  289    HH   TYR  38           HH       TYR  38  14.202   9.441   3.566
  290    H    ASP  39           H        ASP  39  12.602   0.637   5.511
  291    HA   ASP  39           HA       ASP  39  14.748  -1.266   5.099
  292    HB2  ASP  39           2HB      ASP  39  12.428  -1.025   6.898
  293    HB3  ASP  39           1HB      ASP  39  12.805  -2.669   6.390
  294    H    ILE  40           H        ILE  40  14.809  -2.111   3.154
  295    HA   ILE  40           HA       ILE  40  12.701  -2.485   1.372
  296    HB   ILE  40           HB       ILE  40  15.245  -4.108   1.509
  297   HG12  ILE  40          2HG1      ILE  40  14.922  -1.709  -0.245
  298   HG13  ILE  40          1HG1      ILE  40  15.292  -1.456   1.458
  299   HG21  ILE  40          1HG2      ILE  40  13.602  -5.047  -0.017
  300   HG22  ILE  40          2HG2      ILE  40  14.942  -4.339  -0.919
  301   HG23  ILE  40          3HG2      ILE  40  13.409  -3.478  -0.800
  302   HD11  ILE  40          3HD1      ILE  40  16.926  -3.174  -0.391
  303   HD12  ILE  40          1HD1      ILE  40  17.328  -2.692   1.257
  304   HD13  ILE  40          2HD1      ILE  40  17.270  -1.482  -0.026
  305    H    GLY  41           H        GLY  41  14.173  -4.792   3.644
  306    HA2  GLY  41           2HA      GLY  41  12.670  -7.045   2.892
  307    HA3  GLY  41           1HA      GLY  41  13.441  -6.813   4.452
  308    H    ALA  42           H        ALA  42  11.959  -4.476   5.199
  309    HA   ALA  42           HA       ALA  42   9.667  -5.760   6.302
  310    HB1  ALA  42           1HB      ALA  42   9.241  -3.644   7.404
  311    HB2  ALA  42           2HB      ALA  42  10.397  -2.834   6.350
  312    HB3  ALA  42           3HB      ALA  42  10.955  -4.043   7.506
  313    H    ALA  43           H        ALA  43  10.146  -3.251   3.850
  314    HA   ALA  43           HA       ALA  43   7.424  -2.734   3.340
  315    HB1  ALA  43           1HB      ALA  43   9.744  -2.430   1.441
  316    HB2  ALA  43           2HB      ALA  43   9.283  -1.253   2.671
  317    HB3  ALA  43           3HB      ALA  43   8.185  -1.614   1.340
  318    H    LEU  44           H        LEU  44   9.671  -5.047   1.936
  319    HA   LEU  44           HA       LEU  44   8.061  -5.879  -0.209
  320    HB2  LEU  44           2HB      LEU  44  10.508  -6.284   0.112
  321    HB3  LEU  44           1HB      LEU  44  10.094  -7.516   1.290
  322    HG   LEU  44           HG       LEU  44   8.815  -8.698  -0.536
  323   HD11  LEU  44          1HD1      LEU  44   9.422  -8.114  -2.855
  324   HD12  LEU  44          2HD1      LEU  44  10.226  -6.662  -2.256
  325   HD13  LEU  44          3HD1      LEU  44   8.484  -6.855  -2.051
  326   HD21  LEU  44          3HD2      LEU  44  11.001  -9.491   0.141
  327   HD22  LEU  44          1HD2      LEU  44  11.786  -8.316  -0.917
  328   HD23  LEU  44          2HD2      LEU  44  10.830  -9.627  -1.609
  329    H    ASP  45           H        ASP  45   8.262  -6.986   3.124
  330    HA   ASP  45           HA       ASP  45   6.484  -9.207   2.674
  331    HB2  ASP  45           2HB      ASP  45   8.411  -8.905   4.458
  332    HB3  ASP  45           1HB      ASP  45   7.127  -8.175   5.417
  333    H    THR  46           H        THR  46   6.022  -5.921   3.046
  334    HA   THR  46           HA       THR  46   3.787  -5.840   4.775
  335    HB   THR  46           HB       THR  46   4.593  -3.921   2.572
  336    HG1  THR  46           1HG      THR  46   6.108  -4.280   4.351
  337   HG21  THR  46          3HG2      THR  46   3.235  -2.272   3.773
  338   HG22  THR  46          1HG2      THR  46   2.739  -3.511   4.927
  339   HG23  THR  46          2HG2      THR  46   2.247  -3.631   3.238
  340    H    ILE  47           H        ILE  47   4.070  -6.437   1.308
  341    HA   ILE  47           HA       ILE  47   1.137  -6.531   1.171
  342    HB   ILE  47           HB       ILE  47   1.307  -6.191  -1.225
  343   HG12  ILE  47          2HG1      ILE  47   4.271  -5.743  -0.886
  344   HG13  ILE  47          1HG1      ILE  47   3.616  -7.305  -1.373
  345   HG21  ILE  47          1HG2      ILE  47   2.084  -3.879  -1.220
  346   HG22  ILE  47          2HG2      ILE  47   2.893  -4.144   0.322
  347   HG23  ILE  47          3HG2      ILE  47   1.133  -4.232   0.223
  348   HD11  ILE  47          3HD1      ILE  47   2.536  -6.186  -3.297
  349   HD12  ILE  47          1HD1      ILE  47   4.297  -6.093  -3.326
  350   HD13  ILE  47          2HD1      ILE  47   3.349  -4.691  -2.836
  351    H    GLN  48           H        GLN  48   3.217  -8.660   1.912
  352    HA   GLN  48           HA       GLN  48   3.345 -10.917   1.823
  353    HB2  GLN  48           2HB      GLN  48   0.708 -10.358   0.918
  354    HB3  GLN  48           1HB      GLN  48   1.347 -11.675  -0.054
  355    HG2  GLN  48           2HG      GLN  48   1.269 -11.605   2.953
  356    HG3  GLN  48           1HG      GLN  48   0.138 -12.469   1.911
  357   HE21  GLN  48          1HE2      GLN  48   2.174 -13.270   3.988
  358   HE22  GLN  48          2HE2      GLN  48   3.091 -14.519   3.221
  359    H    TYR  49           H        TYR  49   2.821  -9.485  -1.387
  360    HA   TYR  49           HA       TYR  49   3.968 -11.599  -2.859
  361    HB2  TYR  49           2HB      TYR  49   3.645  -8.674  -3.526
  362    HB3  TYR  49           1HB      TYR  49   4.222  -9.875  -4.671
  363    HD1  TYR  49           2HD      TYR  49   2.661 -11.919  -5.062
  364    HD2  TYR  49           1HD      TYR  49   1.358  -8.231  -3.385
  365    HE1  TYR  49           2HE      TYR  49   0.346 -12.461  -5.683
  366    HE2  TYR  49           1HE      TYR  49  -0.961  -8.767  -4.007
  367    HH   TYR  49           HH       TYR  49  -2.228 -10.136  -5.415
  368    H    SER  50           H        SER  50   5.876 -12.171  -1.709
  369    HA   SER  50           HA       SER  50   8.122 -10.308  -2.105
  370    HB2  SER  50           2HB      SER  50   8.719 -12.588  -0.403
  371    HB3  SER  50           1HB      SER  50   8.876 -10.866  -0.060
  372    HG   SER  50           HG       SER  50   6.322 -11.293  -0.018
  373    H    LYS  51           H        LYS  51   6.743 -13.216  -3.147
  374    HA   LYS  51           HA       LYS  51   9.290 -14.118  -4.311
  375    HB2  LYS  51           2HB      LYS  51   6.755 -15.723  -3.932
  376    HB3  LYS  51           1HB      LYS  51   8.306 -16.329  -4.500
  377    HG2  LYS  51           2HG      LYS  51   9.288 -16.099  -2.373
  378    HG3  LYS  51           1HG      LYS  51   7.966 -15.088  -1.790
  379    HD2  LYS  51           2HD      LYS  51   7.588 -17.186  -0.823
  380    HD3  LYS  51           1HD      LYS  51   6.467 -17.112  -2.180
  381    HE2  LYS  51           2HE      LYS  51   8.077 -18.401  -3.537
  382    HE3  LYS  51           1HE      LYS  51   9.133 -18.518  -2.130
  383    HZ1  LYS  51           3HZ      LYS  51   7.866 -20.515  -2.293
  384    HZ2  LYS  51           1HZ      LYS  51   6.407 -19.661  -2.402
  385    HZ3  LYS  51           2HZ      LYS  51   7.289 -19.648  -0.961
  386    H    HIS  52           H        HIS  52   5.869 -14.600  -5.172
  387    HA   HIS  52           HA       HIS  52   6.024 -13.066  -7.568
  388    HB2  HIS  52           2HB      HIS  52   7.266 -15.339  -8.021
  389    HB3  HIS  52           1HB      HIS  52   5.638 -16.002  -8.071
  390    HD1  HIS  52           1HD      HIS  52   4.224 -13.728  -9.591
  391    HD2  HIS  52           2HD      HIS  52   7.902 -15.332 -10.671
  392    HE1  HIS  52           1HE      HIS  52   4.483 -13.243 -12.045
  393    HE2  HIS  52           2HE      HIS  52   6.619 -14.397 -12.710
  394    H1   GLY   1           1HT      GLY   1 -18.605  19.786   1.103
  395    H2   GLY   1           2HT      GLY   1 -17.114  18.993   1.156
  396    H3   GLY   1           3HT      GLY   1 -17.463  20.204   2.279
  397    HA2  GLY   1           1HA      GLY   1 -17.638  17.968   3.235
  398    HA3  GLY   1           2HA      GLY   1 -19.136  18.886   3.320
  399    H    SER   2           H        SER   2 -20.362  16.986   3.466
  400    HA   SER   2           HA       SER   2 -20.355  15.258   1.103
  401    HB2  SER   2           2HB      SER   2 -21.875  14.827   3.676
  402    HB3  SER   2           1HB      SER   2 -21.485  13.633   2.438
  403    HG   SER   2           HG       SER   2 -20.141  13.756   4.458
  404    HA   PRO   3           HA       PRO   3 -24.071  17.606   0.112
  405    HB2  PRO   3           2HB      PRO   3 -23.877  17.428  -2.541
  406    HB3  PRO   3           1HB      PRO   3 -22.801  18.485  -1.620
  407    HG2  PRO   3           2HG      PRO   3 -22.262  15.800  -2.806
  408    HG3  PRO   3           1HG      PRO   3 -21.201  17.216  -2.702
  409    HD2  PRO   3           2HD      PRO   3 -21.154  15.018  -0.986
  410    HD3  PRO   3           1HD      PRO   3 -20.428  16.602  -0.655
  411    HA   PRO   4           HA       PRO   4 -27.003  14.313  -0.438
  412    HB2  PRO   4           2HB      PRO   4 -28.624  16.124  -2.110
  413    HB3  PRO   4           1HB      PRO   4 -29.019  15.373  -0.563
  414    HG2  PRO   4           2HG      PRO   4 -28.514  17.999  -0.760
  415    HG3  PRO   4           1HG      PRO   4 -28.026  17.059   0.662
  416    HD2  PRO   4           2HD      PRO   4 -26.368  18.001  -1.646
  417    HD3  PRO   4           1HD      PRO   4 -25.972  17.953   0.085
  418    H    GLU   5           H        GLU   5 -25.480  15.877  -3.041
  419    HA   GLU   5           HA       GLU   5 -26.630  14.318  -5.165
  420    HB2  GLU   5           2HB      GLU   5 -24.113  15.997  -5.168
  421    HB3  GLU   5           1HB      GLU   5 -24.991  15.419  -6.578
  422    HG2  GLU   5           2HG      GLU   5 -26.305  17.191  -4.556
  423    HG3  GLU   5           1HG      GLU   5 -25.305  17.854  -5.849
  424    H    ALA   6           H        ALA   6 -24.231  13.809  -2.817
  425    HA   ALA   6           HA       ALA   6 -22.640  11.982  -4.408
  426    HB1  ALA   6           1HB      ALA   6 -22.514  12.597  -1.458
  427    HB2  ALA   6           2HB      ALA   6 -21.551  13.371  -2.718
  428    HB3  ALA   6           3HB      ALA   6 -21.338  11.655  -2.374
  429    H    ASP   7           H        ASP   7 -22.660   9.787  -4.294
  430    HA   ASP   7           HA       ASP   7 -25.056   8.495  -3.548
  431    HB2  ASP   7           2HB      ASP   7 -23.487   7.734  -5.349
  432    HB3  ASP   7           1HB      ASP   7 -22.378   7.208  -4.093
  433    HA   PRO   8           HA       PRO   8 -24.222   8.128   0.817
  434    HB2  PRO   8           2HB      PRO   8 -26.335   6.492   1.378
  435    HB3  PRO   8           1HB      PRO   8 -26.477   8.240   1.156
  436    HG2  PRO   8           2HG      PRO   8 -27.011   6.027  -0.795
  437    HG3  PRO   8           1HG      PRO   8 -27.966   7.487  -0.470
  438    HD2  PRO   8           2HD      PRO   8 -26.329   7.308  -2.592
  439    HD3  PRO   8           1HD      PRO   8 -26.557   8.836  -1.716
  440    H    ARG   9           H        ARG   9 -24.417   5.460  -1.413
  441    HA   ARG   9           HA       ARG   9 -23.423   3.572   0.595
  442    HB2  ARG   9           2HB      ARG   9 -24.046   3.043  -2.312
  443    HB3  ARG   9           1HB      ARG   9 -23.820   1.854  -1.038
  444    HG2  ARG   9           2HG      ARG   9 -25.896   2.190  -0.156
  445    HG3  ARG   9           1HG      ARG   9 -25.985   3.860  -0.723
  446    HD2  ARG   9           2HD      ARG   9 -26.190   1.391  -2.440
  447    HD3  ARG   9           1HD      ARG   9 -27.531   2.425  -1.947
  448    HE   ARG   9           HE       ARG   9 -25.543   3.959  -3.272
  449   HH11  ARG   9          1HH1      ARG   9 -28.072   1.620  -3.875
  450   HH12  ARG   9          2HH1      ARG   9 -28.368   2.158  -5.495
  451   HH21  ARG   9          1HH2      ARG   9 -25.914   4.673  -5.414
  452   HH22  ARG   9          2HH2      ARG   9 -27.154   3.898  -6.363
  453    H    LEU  10           H        LEU  10 -22.488   5.101  -2.446
  454    HA   LEU  10           HA       LEU  10 -20.022   3.781  -2.777
  455    HB2  LEU  10           2HB      LEU  10 -21.249   5.187  -4.483
  456    HB3  LEU  10           1HB      LEU  10 -20.647   6.597  -3.633
  457    HG   LEU  10           HG       LEU  10 -18.312   5.740  -4.069
  458   HD11  LEU  10          1HD1      LEU  10 -18.701   3.451  -4.553
  459   HD12  LEU  10          2HD1      LEU  10 -18.152   4.203  -6.052
  460   HD13  LEU  10          3HD1      LEU  10 -19.863   3.847  -5.818
  461   HD21  LEU  10          3HD2      LEU  10 -20.060   6.450  -6.423
  462   HD22  LEU  10          1HD2      LEU  10 -18.299   6.552  -6.389
  463   HD23  LEU  10          2HD2      LEU  10 -19.262   7.582  -5.329
  464    H    ILE  11           H        ILE  11 -20.928   6.701  -1.023
  465    HA   ILE  11           HA       ILE  11 -18.273   7.465  -0.355
  466    HB   ILE  11           HB       ILE  11 -20.350   8.936  -0.319
  467   HG12  ILE  11          2HG1      ILE  11 -18.611   9.024   2.158
  468   HG13  ILE  11          1HG1      ILE  11 -18.101   9.578   0.566
  469   HG21  ILE  11          1HG2      ILE  11 -21.581   9.052   1.799
  470   HG22  ILE  11          2HG2      ILE  11 -20.697   7.643   2.387
  471   HG23  ILE  11          3HG2      ILE  11 -21.788   7.490   1.008
  472   HD11  ILE  11          3HD1      ILE  11 -19.867  11.253   0.582
  473   HD12  ILE  11          1HD1      ILE  11 -18.799  11.431   1.974
  474   HD13  ILE  11          2HD1      ILE  11 -20.389  10.693   2.171
  475    H    GLU  12           H        GLU  12 -20.309   4.994   0.804
  476    HA   GLU  12           HA       GLU  12 -19.280   4.897   3.479
  477    HB2  GLU  12           2HB      GLU  12 -21.002   3.049   1.854
  478    HB3  GLU  12           1HB      GLU  12 -20.397   2.588   3.437
  479    HG2  GLU  12           2HG      GLU  12 -22.208   4.890   2.771
  480    HG3  GLU  12           1HG      GLU  12 -22.602   3.436   3.685
  481    H    SER  13           H        SER  13 -18.060   3.943   0.481
  482    HA   SER  13           HA       SER  13 -16.756   1.556   0.988
  483    HB2  SER  13           2HB      SER  13 -15.655   3.850  -0.645
  484    HB3  SER  13           1HB      SER  13 -15.255   2.144  -0.815
  485    HG   SER  13           HG       SER  13 -17.503   3.544  -1.656
  486    H    LEU  14           H        LEU  14 -15.883   4.812   1.985
  487    HA   LEU  14           HA       LEU  14 -13.251   4.148   2.847
  488    HB2  LEU  14           2HB      LEU  14 -15.054   6.466   3.537
  489    HB3  LEU  14           1HB      LEU  14 -13.393   6.328   4.080
  490    HG   LEU  14           HG       LEU  14 -13.085   6.026   1.389
  491   HD11  LEU  14          1HD1      LEU  14 -14.415   7.805   0.324
  492   HD12  LEU  14          2HD1      LEU  14 -15.352   7.965   1.809
  493   HD13  LEU  14          3HD1      LEU  14 -15.406   6.460   0.890
  494   HD21  LEU  14          3HD2      LEU  14 -13.069   8.546   3.038
  495   HD22  LEU  14          1HD2      LEU  14 -12.378   8.410   1.421
  496   HD23  LEU  14          2HD2      LEU  14 -11.720   7.450   2.743
  497    H    SER  15           H        SER  15 -16.372   4.497   4.525
  498    HA   SER  15           HA       SER  15 -15.390   3.945   7.112
  499    HB2  SER  15           2HB      SER  15 -18.169   3.134   6.472
  500    HB3  SER  15           1HB      SER  15 -17.565   4.157   7.776
  501    HG   SER  15           HG       SER  15 -18.814   4.996   5.716
  502    H    GLN  16           H        GLN  16 -16.619   1.909   4.511
  503    HA   GLN  16           HA       GLN  16 -16.877  -0.502   5.893
  504    HB2  GLN  16           2HB      GLN  16 -17.065   0.359   3.228
  505    HB3  GLN  16           1HB      GLN  16 -15.874  -0.934   3.218
  506    HG2  GLN  16           2HG      GLN  16 -18.006  -1.895   2.793
  507    HG3  GLN  16           1HG      GLN  16 -17.519  -2.365   4.421
  508   HE21  GLN  16          1HE2      GLN  16 -19.617  -2.754   5.068
  509   HE22  GLN  16          2HE2      GLN  16 -20.752  -1.481   5.349
  510    H    MET  17           H        MET  17 -14.064   0.893   4.255
  511    HA   MET  17           HA       MET  17 -12.344  -1.318   4.728
  512    HB2  MET  17           2HB      MET  17 -11.706   1.583   4.144
  513    HB3  MET  17           1HB      MET  17 -10.513   0.290   4.177
  514    HG2  MET  17           2HG      MET  17 -12.842   0.541   2.291
  515    HG3  MET  17           1HG      MET  17 -11.142   0.793   1.906
  516    HE1  MET  17           3HE      MET  17  -9.359  -1.069   1.725
  517    HE2  MET  17           1HE      MET  17  -9.643  -2.774   2.076
  518    HE3  MET  17           2HE      MET  17  -9.655  -1.591   3.382
  519    H    LEU  18           H        LEU  18 -12.993   1.696   6.444
  520    HA   LEU  18           HA       LEU  18 -10.965   1.455   8.384
  521    HB2  LEU  18           2HB      LEU  18 -12.418   3.482   7.811
  522    HB3  LEU  18           1HB      LEU  18 -13.647   2.753   8.828
  523    HG   LEU  18           HG       LEU  18 -12.130   2.882  10.757
  524   HD11  LEU  18          1HD1      LEU  18 -10.258   4.157   8.771
  525   HD12  LEU  18          2HD1      LEU  18  -9.983   2.707   9.734
  526   HD13  LEU  18          3HD1      LEU  18 -10.069   4.283  10.520
  527   HD21  LEU  18          3HD2      LEU  18 -13.679   4.703  10.335
  528   HD22  LEU  18          1HD2      LEU  18 -12.505   5.481   9.275
  529   HD23  LEU  18          2HD2      LEU  18 -12.170   5.324  11.000
  530    H    SER  19           H        SER  19 -14.329   0.365   8.309
  531    HA   SER  19           HA       SER  19 -14.338  -0.731  10.934
  532    HB2  SER  19           2HB      SER  19 -16.173  -0.588   8.655
  533    HB3  SER  19           1HB      SER  19 -16.308  -2.095   9.559
  534    HG   SER  19           HG       SER  19 -17.261  -1.042  11.088
  535    H    MET  20           H        MET  20 -13.193  -1.851   7.891
  536    HA   MET  20           HA       MET  20 -13.267  -4.650   8.502
  537    HB2  MET  20           2HB      MET  20 -13.193  -3.552   6.184
  538    HB3  MET  20           1HB      MET  20 -11.472  -3.332   6.473
  539    HG2  MET  20           2HG      MET  20 -11.199  -5.745   6.717
  540    HG3  MET  20           1HG      MET  20 -12.927  -5.967   6.449
  541    HE1  MET  20           3HE      MET  20 -13.513  -3.818   4.134
  542    HE2  MET  20           1HE      MET  20 -14.147  -5.462   4.175
  543    HE3  MET  20           2HE      MET  20 -13.343  -4.865   2.726
  544    H    GLY  21           H        GLY  21 -11.337  -2.082   9.493
  545    HA2  GLY  21           2HA      GLY  21  -9.741  -2.357  11.242
  546    HA3  GLY  21           1HA      GLY  21  -9.394  -3.966  10.626
  547    H    PHE  22           H        PHE  22  -9.663  -1.432   8.321
  548    HA   PHE  22           HA       PHE  22  -6.748  -1.507   7.993
  549    HB2  PHE  22           2HB      PHE  22  -8.426  -2.202   6.102
  550    HB3  PHE  22           1HB      PHE  22  -8.620  -0.466   5.894
  551    HD1  PHE  22           1HD      PHE  22  -5.819  -2.893   6.344
  552    HD2  PHE  22           2HD      PHE  22  -7.340   0.495   4.263
  553    HE1  PHE  22           1HE      PHE  22  -3.783  -2.828   4.960
  554    HE2  PHE  22           2HE      PHE  22  -5.306   0.569   2.885
  555    HZ   PHE  22           HZ       PHE  22  -3.524  -1.097   3.233
  556    H    SER  23           H        SER  23  -5.622   0.248   8.429
  557    HA   SER  23           HA       SER  23  -6.866   2.881   8.225
  558    HB2  SER  23           2HB      SER  23  -5.350   1.996  10.692
  559    HB3  SER  23           1HB      SER  23  -6.184   3.532  10.450
  560    HG   SER  23           HG       SER  23  -8.037   1.813  10.021
  561    H    ASP  24           H        ASP  24  -5.451   4.444   7.566
  562    HA   ASP  24           HA       ASP  24  -2.649   3.611   7.229
  563    HB2  ASP  24           2HB      ASP  24  -2.893   3.855   5.025
  564    HB3  ASP  24           1HB      ASP  24  -4.581   4.272   5.258
  565    H    GLU  25           H        GLU  25  -1.040   5.165   7.488
  566    HA   GLU  25           HA       GLU  25  -1.924   7.681   8.732
  567    HB2  GLU  25           2HB      GLU  25   0.629   7.081   9.752
  568    HB3  GLU  25           1HB      GLU  25  -0.899   7.088  10.616
  569    HG2  GLU  25           2HG      GLU  25  -0.037   4.992  11.071
  570    HG3  GLU  25           1HG      GLU  25  -1.160   4.686   9.752
  571    H    GLY  26           H        GLY  26  -0.875   6.818   5.963
  572    HA2  GLY  26           2HA      GLY  26   1.203   8.925   5.821
  573    HA3  GLY  26           1HA      GLY  26   1.278   7.459   4.848
  574    H    GLY  27           H        GLY  27  -1.879   8.312   5.193
  575    HA2  GLY  27           2HA      GLY  27  -3.431   9.365   3.874
  576    HA3  GLY  27           1HA      GLY  27  -2.133  10.381   3.253
  577    H    TRP  28           H        TRP  28  -1.964   6.896   3.126
  578    HA   TRP  28           HA       TRP  28  -1.994   7.146   0.218
  579    HB2  TRP  28           2HB      TRP  28  -0.744   5.154   0.058
  580    HB3  TRP  28           1HB      TRP  28  -0.007   6.115   1.326
  581    HD1  TRP  28           HD       TRP  28  -0.427   5.208   3.900
  582    HE1  TRP  28           1HE      TRP  28  -0.725   2.793   4.745
  583    HE3  TRP  28           3HE      TRP  28  -1.618   2.939  -0.524
  584    HZ2  TRP  28           2HZ      TRP  28  -1.355   0.256   3.671
  585    HZ3  TRP  28           3HZ      TRP  28  -2.038   0.513  -0.527
  586    HH2  TRP  28           HH       TRP  28  -1.912  -0.794   1.521
  587    H    LEU  29           H        LEU  29  -3.954   5.914   2.752
  588    HA   LEU  29           HA       LEU  29  -5.277   3.902   1.226
  589    HB2  LEU  29           2HB      LEU  29  -5.480   3.796   3.598
  590    HB3  LEU  29           1HB      LEU  29  -6.069   5.443   3.688
  591    HG   LEU  29           HG       LEU  29  -8.155   4.737   2.559
  592   HD11  LEU  29          1HD1      LEU  29  -7.341   2.837   1.313
  593   HD12  LEU  29          2HD1      LEU  29  -8.642   2.328   2.389
  594   HD13  LEU  29          3HD1      LEU  29  -6.964   1.979   2.804
  595   HD21  LEU  29          3HD2      LEU  29  -7.512   3.131   5.027
  596   HD22  LEU  29          1HD2      LEU  29  -9.116   3.600   4.461
  597   HD23  LEU  29          2HD2      LEU  29  -7.980   4.831   5.013
  598    H    THR  30           H        THR  30  -5.915   7.310   1.889
  599    HA   THR  30           HA       THR  30  -8.349   7.494   0.490
  600    HB   THR  30           HB       THR  30  -7.695   9.233   2.057
  601    HG1  THR  30           1HG      THR  30  -8.449   9.746  -0.513
  602   HG21  THR  30          3HG2      THR  30  -5.507   9.931   0.092
  603   HG22  THR  30          1HG2      THR  30  -5.271   9.186   1.674
  604   HG23  THR  30          2HG2      THR  30  -5.913  10.822   1.560
  605    H    ARG  31           H        ARG  31  -5.097   7.280  -0.582
  606    HA   ARG  31           HA       ARG  31  -5.717   8.297  -3.245
  607    HB2  ARG  31           2HB      ARG  31  -3.255   7.712  -1.713
  608    HB3  ARG  31           1HB      ARG  31  -3.172   7.419  -3.445
  609    HG2  ARG  31           2HG      ARG  31  -3.796   9.695  -3.902
  610    HG3  ARG  31           1HG      ARG  31  -4.037  10.005  -2.182
  611    HD2  ARG  31           2HD      ARG  31  -1.402   9.044  -3.233
  612    HD3  ARG  31           1HD      ARG  31  -1.828  10.754  -3.275
  613    HE   ARG  31           HE       ARG  31  -2.227   9.658  -0.679
  614   HH11  ARG  31          1HH1      ARG  31   0.268  10.722  -2.887
  615   HH12  ARG  31          2HH1      ARG  31   1.344  11.237  -1.626
  616   HH21  ARG  31          1HH2      ARG  31  -0.805  10.311   0.992
  617   HH22  ARG  31          2HH2      ARG  31   0.728  11.007   0.584
  618    H    LEU  32           H        LEU  32  -5.235   5.336  -1.513
  619    HA   LEU  32           HA       LEU  32  -4.768   3.601  -3.678
  620    HB2  LEU  32           2HB      LEU  32  -4.517   3.131  -1.186
  621    HB3  LEU  32           1HB      LEU  32  -6.254   2.907  -1.145
  622    HG   LEU  32           HG       LEU  32  -5.937   1.101  -2.897
  623   HD11  LEU  32          1HD1      LEU  32  -3.753   1.672  -3.695
  624   HD12  LEU  32          2HD1      LEU  32  -3.686   0.079  -2.942
  625   HD13  LEU  32          3HD1      LEU  32  -3.067   1.490  -2.082
  626   HD21  LEU  32          3HD2      LEU  32  -5.247  -0.566  -1.233
  627   HD22  LEU  32          1HD2      LEU  32  -6.410   0.586  -0.577
  628   HD23  LEU  32          2HD2      LEU  32  -4.698   0.734  -0.173
  629    H    LEU  33           H        LEU  33  -7.703   4.771  -2.131
  630    HA   LEU  33           HA       LEU  33  -9.484   3.212  -3.741
  631    HB2  LEU  33           2HB      LEU  33  -9.984   5.640  -2.018
  632    HB3  LEU  33           1HB      LEU  33 -11.236   4.653  -2.744
  633    HG   LEU  33           HG       LEU  33  -9.250   3.714  -0.670
  634   HD11  LEU  33          1HD1      LEU  33 -11.253   3.595   0.781
  635   HD12  LEU  33          2HD1      LEU  33 -12.184   4.384  -0.491
  636   HD13  LEU  33          3HD1      LEU  33 -10.852   5.239   0.288
  637   HD21  LEU  33          3HD2      LEU  33 -10.717   1.712  -0.584
  638   HD22  LEU  33          1HD2      LEU  33  -9.851   1.887  -2.110
  639   HD23  LEU  33          2HD2      LEU  33 -11.557   2.315  -2.011
  640    H    GLN  34           H        GLN  34  -7.636   5.939  -4.378
  641    HA   GLN  34           HA       GLN  34  -9.532   7.011  -6.328
  642    HB2  GLN  34           2HB      GLN  34  -6.839   7.999  -5.388
  643    HB3  GLN  34           1HB      GLN  34  -7.735   8.746  -6.701
  644    HG2  GLN  34           2HG      GLN  34  -8.565   8.549  -3.820
  645    HG3  GLN  34           1HG      GLN  34  -8.088   9.999  -4.699
  646   HE21  GLN  34          1HE2      GLN  34 -10.608   7.762  -4.040
  647   HE22  GLN  34          2HE2      GLN  34 -11.874   8.616  -4.855
  648    H    THR  35           H        THR  35  -6.404   5.428  -6.116
  649    HA   THR  35           HA       THR  35  -5.913   5.551  -8.941
  650    HB   THR  35           HB       THR  35  -4.086   3.825  -8.290
  651    HG1  THR  35           1HG      THR  35  -4.415   4.870  -5.693
  652   HG21  THR  35          3HG2      THR  35  -4.077   6.630  -7.169
  653   HG22  THR  35          1HG2      THR  35  -3.608   6.156  -8.800
  654   HG23  THR  35          2HG2      THR  35  -2.647   5.628  -7.420
  655    H    LYS  36           H        LYS  36  -6.919   3.027  -6.653
  656    HA   LYS  36           HA       LYS  36  -7.440   1.255  -8.938
  657    HB2  LYS  36           2HB      LYS  36  -7.067   0.671  -6.000
  658    HB3  LYS  36           1HB      LYS  36  -7.553  -0.541  -7.179
  659    HG2  LYS  36           2HG      LYS  36  -5.495  -0.668  -8.111
  660    HG3  LYS  36           1HG      LYS  36  -5.131   1.031  -7.809
  661    HD2  LYS  36           2HD      LYS  36  -5.138   0.225  -5.297
  662    HD3  LYS  36           1HD      LYS  36  -4.785  -1.338  -6.038
  663    HE2  LYS  36           2HE      LYS  36  -2.681  -0.375  -5.585
  664    HE3  LYS  36           1HE      LYS  36  -2.936  -0.149  -7.314
  665    HZ1  LYS  36           3HZ      LYS  36  -2.304   1.948  -6.786
  666    HZ2  LYS  36           1HZ      LYS  36  -2.836   1.833  -5.180
  667    HZ3  LYS  36           2HZ      LYS  36  -3.950   2.116  -6.415
  668    H    ASN  37           H        ASN  37  -9.058   3.521  -7.653
  669    HA   ASN  37           HA       ASN  37 -11.239   4.075  -7.427
  670    HB2  ASN  37           2HB      ASN  37 -11.380   2.584  -9.503
  671    HB3  ASN  37           1HB      ASN  37 -11.974   1.326  -8.428
  672   HD21  ASN  37          1HD2      ASN  37 -14.069   1.137  -8.492
  673   HD22  ASN  37          2HD2      ASN  37 -15.211   2.432  -8.677
  674    H    TYR  38           H        TYR  38 -13.471   2.937  -6.509
  675    HA   TYR  38           HA       TYR  38 -12.750   2.234  -3.789
  676    HB2  TYR  38           2HB      TYR  38 -15.491   2.684  -4.989
  677    HB3  TYR  38           1HB      TYR  38 -15.098   2.609  -3.276
  678    HD1  TYR  38           1HD      TYR  38 -13.528   4.407  -2.342
  679    HD2  TYR  38           2HD      TYR  38 -15.429   4.725  -6.134
  680    HE1  TYR  38           1HE      TYR  38 -13.150   6.836  -2.321
  681    HE2  TYR  38           2HE      TYR  38 -15.055   7.156  -6.123
  682    HH   TYR  38           HH       TYR  38 -14.678   8.961  -4.450
  683    H    ASP  39           H        ASP  39 -12.203   0.273  -5.784
  684    HA   ASP  39           HA       ASP  39 -14.251  -1.766  -5.490
  685    HB2  ASP  39           2HB      ASP  39 -11.702  -1.550  -7.072
  686    HB3  ASP  39           1HB      ASP  39 -12.464  -3.122  -6.825
  687    H    ILE  40           H        ILE  40 -14.253  -2.394  -3.403
  688    HA   ILE  40           HA       ILE  40 -12.074  -2.707  -1.704
  689    HB   ILE  40           HB       ILE  40 -14.660  -4.269  -1.622
  690   HG12  ILE  40          2HG1      ILE  40 -13.941  -1.601  -0.367
  691   HG13  ILE  40          1HG1      ILE  40 -15.036  -1.834  -1.726
  692   HG21  ILE  40          1HG2      ILE  40 -12.988  -5.226  -0.163
  693   HG22  ILE  40          2HG2      ILE  40 -14.202  -4.388   0.804
  694   HG23  ILE  40          3HG2      ILE  40 -12.632  -3.639   0.520
  695   HD11  ILE  40          3HD1      ILE  40 -15.442  -2.808   1.090
  696   HD12  ILE  40          1HD1      ILE  40 -16.518  -3.149  -0.266
  697   HD13  ILE  40          2HD1      ILE  40 -16.294  -1.489   0.289
  698    H    GLY  41           H        GLY  41 -13.593  -5.040  -3.886
  699    HA2  GLY  41           2HA      GLY  41 -12.214  -7.337  -3.073
  700    HA3  GLY  41           1HA      GLY  41 -12.880  -7.073  -4.677
  701    H    ALA  42           H        ALA  42 -11.398  -4.988  -5.603
  702    HA   ALA  42           HA       ALA  42  -9.018  -6.259  -6.421
  703    HB1  ALA  42           1HB      ALA  42  -8.552  -4.273  -7.660
  704    HB2  ALA  42           2HB      ALA  42  -9.639  -3.323  -6.649
  705    HB3  ALA  42           3HB      ALA  42 -10.297  -4.549  -7.733
  706    H    ALA  43           H        ALA  43  -9.663  -3.682  -4.085
  707    HA   ALA  43           HA       ALA  43  -7.009  -3.020  -3.477
  708    HB1  ALA  43           1HB      ALA  43  -9.385  -2.876  -1.626
  709    HB2  ALA  43           2HB      ALA  43  -8.971  -1.666  -2.841
  710    HB3  ALA  43           3HB      ALA  43  -7.880  -1.966  -1.491
  711    H    LEU  44           H        LEU  44  -9.192  -5.375  -1.954
  712    HA   LEU  44           HA       LEU  44  -7.429  -6.207   0.078
  713    HB2  LEU  44           2HB      LEU  44  -9.969  -7.063  -1.043
  714    HB3  LEU  44           1HB      LEU  44  -8.982  -8.421  -0.539
  715    HG   LEU  44           HG       LEU  44  -8.818  -7.476   1.719
  716   HD11  LEU  44          1HD1      LEU  44 -10.180  -5.562   2.362
  717   HD12  LEU  44          2HD1      LEU  44 -10.676  -5.342   0.683
  718   HD13  LEU  44          3HD1      LEU  44  -8.989  -5.111   1.143
  719   HD21  LEU  44          3HD2      LEU  44 -11.133  -7.838   2.384
  720   HD22  LEU  44          1HD2      LEU  44 -10.618  -9.035   1.196
  721   HD23  LEU  44          2HD2      LEU  44 -11.649  -7.689   0.704
  722    H    ASP  45           H        ASP  45  -7.904  -7.289  -3.230
  723    HA   ASP  45           HA       ASP  45  -6.191  -9.554  -3.081
  724    HB2  ASP  45           2HB      ASP  45  -7.811  -9.532  -4.818
  725    HB3  ASP  45           1HB      ASP  45  -7.309  -7.940  -5.369
  726    H    THR  46           H        THR  46  -5.695  -6.165  -3.675
  727    HA   THR  46           HA       THR  46  -3.244  -6.164  -4.989
  728    HB   THR  46           HB       THR  46  -4.209  -4.170  -2.928
  729    HG1  THR  46           1HG      THR  46  -5.550  -4.672  -4.908
  730   HG21  THR  46          3HG2      THR  46  -2.755  -2.577  -4.052
  731   HG22  THR  46          1HG2      THR  46  -2.229  -3.821  -5.186
  732   HG23  THR  46          2HG2      THR  46  -1.812  -3.952  -3.476
  733    H    ILE  47           H        ILE  47  -3.915  -6.357  -1.498
  734    HA   ILE  47           HA       ILE  47  -1.029  -6.639  -1.015
  735    HB   ILE  47           HB       ILE  47  -1.521  -6.218   1.350
  736   HG12  ILE  47          2HG1      ILE  47  -4.372  -5.726   0.460
  737   HG13  ILE  47          1HG1      ILE  47  -3.836  -7.180   1.292
  738   HG21  ILE  47          1HG2      ILE  47  -2.664  -4.181  -0.556
  739   HG22  ILE  47          2HG2      ILE  47  -0.975  -4.343  -0.074
  740   HG23  ILE  47          3HG2      ILE  47  -2.188  -3.853   1.109
  741   HD11  ILE  47          3HD1      ILE  47  -3.853  -4.375   2.362
  742   HD12  ILE  47          1HD1      ILE  47  -3.105  -5.744   3.186
  743   HD13  ILE  47          2HD1      ILE  47  -4.842  -5.737   2.884
  744    H    GLN  48           H        GLN  48  -3.528  -8.598  -1.640
  745    HA   GLN  48           HA       GLN  48  -3.872 -10.825  -1.475
  746    HB2  GLN  48           2HB      GLN  48  -1.105 -10.596  -0.522
  747    HB3  GLN  48           1HB      GLN  48  -1.961 -12.020   0.055
  748    HG2  GLN  48           2HG      GLN  48  -1.559 -11.195  -2.808
  749    HG3  GLN  48           1HG      GLN  48  -0.790 -12.545  -1.972
  750   HE21  GLN  48          1HE2      GLN  48  -2.600 -12.319  -4.357
  751   HE22  GLN  48          2HE2      GLN  48  -3.875 -13.448  -4.039
  752    H    TYR  49           H        TYR  49  -2.841  -9.377   1.595
  753    HA   TYR  49           HA       TYR  49  -4.071 -11.231   3.300
  754    HB2  TYR  49           2HB      TYR  49  -3.450  -8.299   3.697
  755    HB3  TYR  49           1HB      TYR  49  -4.020  -9.360   4.981
  756    HD1  TYR  49           2HD      TYR  49  -2.605 -11.642   5.147
  757    HD2  TYR  49           1HD      TYR  49  -1.170  -7.953   3.592
  758    HE1  TYR  49           2HE      TYR  49  -0.299 -12.353   5.615
  759    HE2  TYR  49           1HE      TYR  49   1.146  -8.653   4.057
  760    HH   TYR  49           HH       TYR  49   2.287 -10.295   5.667
  761    H    SER  50           H        SER  50  -6.125 -11.760   2.639
  762    HA   SER  50           HA       SER  50  -8.152  -9.668   3.052
  763    HB2  SER  50           2HB      SER  50  -9.408 -11.313   1.297
  764    HB3  SER  50           1HB      SER  50  -8.499  -9.883   0.814
  765    HG   SER  50           HG       SER  50  -6.655 -11.290   0.576
  766    H    LYS  51           H        LYS  51  -7.021 -12.782   3.836
  767    HA   LYS  51           HA       LYS  51  -9.484 -13.275   5.358
  768    HB2  LYS  51           2HB      LYS  51  -7.911 -15.355   3.825
  769    HB3  LYS  51           1HB      LYS  51  -9.222 -15.712   4.940
  770    HG2  LYS  51           2HG      LYS  51 -10.622 -14.161   3.422
  771    HG3  LYS  51           1HG      LYS  51  -9.333 -14.423   2.248
  772    HD2  LYS  51           2HD      LYS  51 -10.819 -16.109   1.710
  773    HD3  LYS  51           1HD      LYS  51  -9.707 -16.940   2.799
  774    HE2  LYS  51           2HE      LYS  51 -11.281 -16.542   4.657
  775    HE3  LYS  51           1HE      LYS  51 -12.396 -15.775   3.527
  776    HZ1  LYS  51           3HZ      LYS  51 -11.534 -18.615   3.560
  777    HZ2  LYS  51           1HZ      LYS  51 -12.400 -17.919   2.283
  778    HZ3  LYS  51           2HZ      LYS  51 -13.090 -18.005   3.823
  779    H    HIS  52           H        HIS  52  -6.519 -12.357   5.736
  780    HA   HIS  52           HA       HIS  52  -6.261 -13.250   8.386
  781    HB2  HIS  52           2HB      HIS  52  -5.559 -15.366   7.216
  782    HB3  HIS  52           1HB      HIS  52  -4.223 -14.472   6.499
  783    HD1  HIS  52           1HD      HIS  52  -2.162 -15.169   7.678
  784    HD2  HIS  52           2HD      HIS  52  -5.346 -14.653  10.297
  785    HE1  HIS  52           1HE      HIS  52  -1.210 -15.520   9.976
  786    HE2  HIS  52           2HE      HIS  52  -3.106 -14.985  11.542
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1  20.086  20.020  -3.393
    2    H2   GLY   1           2HT      GLY   1  18.650  19.960  -2.510
    3    H3   GLY   1           3HT      GLY   1  18.623  20.430  -4.133
    4    HA2  GLY   1           1HA      GLY   1  17.830  18.177  -3.940
    5    HA3  GLY   1           2HA      GLY   1  19.360  18.224  -4.809
    6    H    SER   2           H        SER   2  20.594  16.559  -4.261
    7    HA   SER   2           HA       SER   2  20.359  15.390  -1.606
    8    HB2  SER   2           2HB      SER   2  22.143  14.489  -3.876
    9    HB3  SER   2           1HB      SER   2  21.630  13.547  -2.475
   10    HG   SER   2           HG       SER   2  19.982  14.503  -4.586
   11    HA   PRO   3           HA       PRO   3  23.973  17.873  -0.553
   12    HB2  PRO   3           2HB      PRO   3  23.640  17.832   2.100
   13    HB3  PRO   3           1HB      PRO   3  22.585  18.798   1.062
   14    HG2  PRO   3           2HG      PRO   3  22.077  16.138   2.329
   15    HG3  PRO   3           1HG      PRO   3  20.985  17.525   2.162
   16    HD2  PRO   3           2HD      PRO   3  20.987  15.308   0.505
   17    HD3  PRO   3           1HD      PRO   3  20.342  16.901   0.061
   18    HA   PRO   4           HA       PRO   4  27.010  14.775   0.372
   19    HB2  PRO   4           2HB      PRO   4  28.348  16.720   2.146
   20    HB3  PRO   4           1HB      PRO   4  28.959  15.926   0.694
   21    HG2  PRO   4           2HG      PRO   4  28.316  18.516   0.673
   22    HG3  PRO   4           1HG      PRO   4  27.997  17.474  -0.730
   23    HD2  PRO   4           2HD      PRO   4  26.106  18.457   1.379
   24    HD3  PRO   4           1HD      PRO   4  25.865  18.315  -0.374
   25    H    GLU   5           H        GLU   5  25.172  16.308   2.782
   26    HA   GLU   5           HA       GLU   5  26.164  14.876   5.054
   27    HB2  GLU   5           2HB      GLU   5  23.555  16.356   4.667
   28    HB3  GLU   5           1HB      GLU   5  24.220  15.830   6.208
   29    HG2  GLU   5           2HG      GLU   5  25.664  17.733   4.388
   30    HG3  GLU   5           1HG      GLU   5  24.520  18.262   5.622
   31    H    ALA   6           H        ALA   6  23.948  14.236   2.515
   32    HA   ALA   6           HA       ALA   6  22.390  12.282   3.929
   33    HB1  ALA   6           1HB      ALA   6  22.590  12.880   0.980
   34    HB2  ALA   6           2HB      ALA   6  21.387  13.520   2.100
   35    HB3  ALA   6           3HB      ALA   6  21.412  11.798   1.724
   36    H    ASP   7           H        ASP   7  22.643  10.106   3.960
   37    HA   ASP   7           HA       ASP   7  25.237   9.076   3.289
   38    HB2  ASP   7           2HB      ASP   7  23.799   8.384   5.291
   39    HB3  ASP   7           1HB      ASP   7  22.865   7.422   4.147
   40    HA   PRO   8           HA       PRO   8  24.204   7.977  -0.883
   41    HB2  PRO   8           2HB      PRO   8  26.354   6.349  -1.333
   42    HB3  PRO   8           1HB      PRO   8  26.430   8.114  -1.387
   43    HG2  PRO   8           2HG      PRO   8  27.186   6.250   0.832
   44    HG3  PRO   8           1HG      PRO   8  28.041   7.686   0.234
   45    HD2  PRO   8           2HD      PRO   8  26.544   7.763   2.462
   46    HD3  PRO   8           1HD      PRO   8  26.633   9.147   1.354
   47    H    ARG   9           H        ARG   9  24.580   5.714   1.725
   48    HA   ARG   9           HA       ARG   9  23.662   3.480   0.078
   49    HB2  ARG   9           2HB      ARG   9  24.408   3.598   3.008
   50    HB3  ARG   9           1HB      ARG   9  23.993   2.135   2.121
   51    HG2  ARG   9           2HG      ARG   9  25.963   2.125   0.939
   52    HG3  ARG   9           1HG      ARG   9  26.214   3.861   1.132
   53    HD2  ARG   9           2HD      ARG   9  26.414   1.818   3.341
   54    HD3  ARG   9           1HD      ARG   9  27.781   2.512   2.467
   55    HE   ARG   9           HE       ARG   9  26.036   4.462   3.703
   56   HH11  ARG   9          1HH1      ARG   9  28.850   2.410   4.121
   57   HH12  ARG   9          2HH1      ARG   9  29.538   3.396   5.369
   58   HH21  ARG   9          1HH2      ARG   9  26.927   5.751   5.351
   59   HH22  ARG   9          2HH2      ARG   9  28.443   5.289   6.079
   60    H    LEU  10           H        LEU  10  22.468   5.727   2.456
   61    HA   LEU  10           HA       LEU  10  20.052   4.197   2.912
   62    HB2  LEU  10           2HB      LEU  10  21.141   5.620   4.677
   63    HB3  LEU  10           1HB      LEU  10  20.634   7.029   3.764
   64    HG   LEU  10           HG       LEU  10  18.270   6.342   4.058
   65   HD11  LEU  10          1HD1      LEU  10  17.769   4.614   5.764
   66   HD12  LEU  10          2HD1      LEU  10  19.476   4.170   5.763
   67   HD13  LEU  10          3HD1      LEU  10  18.510   3.968   4.300
   68   HD21  LEU  10          3HD2      LEU  10  19.822   6.599   6.628
   69   HD22  LEU  10          1HD2      LEU  10  18.104   6.928   6.415
   70   HD23  LEU  10          2HD2      LEU  10  19.301   7.934   5.598
   71    H    ILE  11           H        ILE  11  21.127   6.809   0.891
   72    HA   ILE  11           HA       ILE  11  18.484   7.645   0.138
   73    HB   ILE  11           HB       ILE  11  20.492   9.146   0.074
   74   HG12  ILE  11          2HG1      ILE  11  19.145   8.905  -2.618
   75   HG13  ILE  11          1HG1      ILE  11  18.340   9.549  -1.191
   76   HG21  ILE  11          1HG2      ILE  11  21.968   9.040  -1.883
   77   HG22  ILE  11          2HG2      ILE  11  21.195   7.533  -2.373
   78   HG23  ILE  11          3HG2      ILE  11  22.109   7.604  -0.868
   79   HD11  ILE  11          3HD1      ILE  11  19.867  11.378  -1.074
   80   HD12  ILE  11          1HD1      ILE  11  19.251  11.272  -2.725
   81   HD13  ILE  11          2HD1      ILE  11  20.872  10.685  -2.344
   82    H    GLU  12           H        GLU  12  20.707   5.208  -0.854
   83    HA   GLU  12           HA       GLU  12  19.591   4.852  -3.472
   84    HB2  GLU  12           2HB      GLU  12  21.616   3.372  -1.842
   85    HB3  GLU  12           1HB      GLU  12  20.950   2.640  -3.297
   86    HG2  GLU  12           2HG      GLU  12  22.573   5.149  -3.043
   87    HG3  GLU  12           1HG      GLU  12  22.936   3.689  -3.963
   88    H    SER  13           H        SER  13  18.630   3.924  -0.356
   89    HA   SER  13           HA       SER  13  17.477   1.416  -0.836
   90    HB2  SER  13           2HB      SER  13  16.371   3.546   1.013
   91    HB3  SER  13           1HB      SER  13  16.196   1.796   1.164
   92    HG   SER  13           HG       SER  13  18.047   1.743   2.150
   93    H    LEU  14           H        LEU  14  16.458   4.647  -1.628
   94    HA   LEU  14           HA       LEU  14  13.753   4.015  -2.278
   95    HB2  LEU  14           2HB      LEU  14  15.545   6.336  -3.001
   96    HB3  LEU  14           1HB      LEU  14  13.880   6.225  -3.535
   97    HG   LEU  14           HG       LEU  14  13.340   6.012  -0.991
   98   HD11  LEU  14          1HD1      LEU  14  14.924   7.286   0.412
   99   HD12  LEU  14          2HD1      LEU  14  16.075   7.272  -0.924
  100   HD13  LEU  14          3HD1      LEU  14  15.586   5.758  -0.167
  101   HD21  LEU  14          3HD2      LEU  14  14.238   8.602  -2.244
  102   HD22  LEU  14          1HD2      LEU  14  13.221   8.459  -0.811
  103   HD23  LEU  14          2HD2      LEU  14  12.637   7.873  -2.371
  104    H    SER  15           H        SER  15  16.725   4.488  -4.193
  105    HA   SER  15           HA       SER  15  15.551   3.939  -6.696
  106    HB2  SER  15           2HB      SER  15  18.311   3.150  -6.654
  107    HB3  SER  15           1HB      SER  15  17.583   4.578  -7.392
  108    HG   SER  15           HG       SER  15  19.228   4.606  -5.428
  109    H    GLN  16           H        GLN  16  16.903   1.896  -4.190
  110    HA   GLN  16           HA       GLN  16  17.223  -0.481  -5.621
  111    HB2  GLN  16           2HB      GLN  16  18.055  -0.189  -3.339
  112    HB3  GLN  16           1HB      GLN  16  16.406  -0.099  -2.733
  113    HG2  GLN  16           2HG      GLN  16  17.358  -2.275  -2.296
  114    HG3  GLN  16           1HG      GLN  16  16.017  -2.403  -3.430
  115   HE21  GLN  16          1HE2      GLN  16  16.432  -2.937  -5.572
  116   HE22  GLN  16          2HE2      GLN  16  17.937  -3.628  -6.069
  117    H    MET  17           H        MET  17  14.370   0.817  -3.957
  118    HA   MET  17           HA       MET  17  12.688  -1.400  -4.475
  119    HB2  MET  17           2HB      MET  17  11.980   1.503  -3.990
  120    HB3  MET  17           1HB      MET  17  10.821   0.181  -4.000
  121    HG2  MET  17           2HG      MET  17  13.111   0.536  -2.079
  122    HG3  MET  17           1HG      MET  17  11.402   0.793  -1.735
  123    HE1  MET  17           3HE      MET  17   9.659  -1.167  -1.291
  124    HE2  MET  17           1HE      MET  17   9.942  -2.810  -1.852
  125    HE3  MET  17           2HE      MET  17   9.872  -1.485  -3.014
  126    H    LEU  18           H        LEU  18  13.373   1.575  -6.209
  127    HA   LEU  18           HA       LEU  18  11.455   1.301  -8.248
  128    HB2  LEU  18           2HB      LEU  18  12.683   3.390  -7.715
  129    HB3  LEU  18           1HB      LEU  18  14.147   2.670  -8.348
  130    HG   LEU  18           HG       LEU  18  13.070   2.536 -10.586
  131   HD11  LEU  18          1HD1      LEU  18  10.872   4.078  -9.218
  132   HD12  LEU  18          2HD1      LEU  18  10.748   2.470  -9.928
  133   HD13  LEU  18          3HD1      LEU  18  11.031   3.871 -10.961
  134   HD21  LEU  18          3HD2      LEU  18  14.525   4.413  -9.939
  135   HD22  LEU  18          1HD2      LEU  18  13.107   5.297  -9.377
  136   HD23  LEU  18          2HD2      LEU  18  13.275   4.895 -11.085
  137    H    SER  19           H        SER  19  14.831   0.286  -8.010
  138    HA   SER  19           HA       SER  19  15.022  -0.826 -10.606
  139    HB2  SER  19           2HB      SER  19  16.964  -0.184  -9.154
  140    HB3  SER  19           1HB      SER  19  16.613  -1.576  -8.134
  141    HG   SER  19           HG       SER  19  16.870  -2.093 -10.848
  142    H    MET  20           H        MET  20  13.910  -2.043  -7.526
  143    HA   MET  20           HA       MET  20  13.854  -4.801  -8.172
  144    HB2  MET  20           2HB      MET  20  13.753  -3.971  -5.858
  145    HB3  MET  20           1HB      MET  20  12.189  -3.234  -6.183
  146    HG2  MET  20           2HG      MET  20  11.327  -5.529  -6.692
  147    HG3  MET  20           1HG      MET  20  12.859  -6.166  -6.098
  148    HE1  MET  20           3HE      MET  20  12.827  -5.096  -2.349
  149    HE2  MET  20           1HE      MET  20  13.494  -4.138  -3.669
  150    HE3  MET  20           2HE      MET  20  13.727  -5.885  -3.643
  151    H    GLY  21           H        GLY  21  11.712  -2.138  -8.773
  152    HA2  GLY  21           2HA      GLY  21  10.249  -2.336 -10.721
  153    HA3  GLY  21           1HA      GLY  21   9.902  -3.980 -10.201
  154    H    PHE  22           H        PHE  22  10.135  -1.592  -7.747
  155    HA   PHE  22           HA       PHE  22   7.209  -1.630  -7.487
  156    HB2  PHE  22           2HB      PHE  22   9.417  -1.743  -5.490
  157    HB3  PHE  22           1HB      PHE  22   7.958  -0.866  -5.038
  158    HD1  PHE  22           1HD      PHE  22   9.064  -4.135  -6.427
  159    HD2  PHE  22           2HD      PHE  22   6.164  -2.008  -4.154
  160    HE1  PHE  22           1HE      PHE  22   7.960  -6.258  -5.854
  161    HE2  PHE  22           2HE      PHE  22   5.057  -4.126  -3.578
  162    HZ   PHE  22           HZ       PHE  22   5.957  -6.253  -4.429
  163    H    SER  23           H        SER  23   6.190   0.188  -7.824
  164    HA   SER  23           HA       SER  23   7.328   2.739  -7.063
  165    HB2  SER  23           2HB      SER  23   6.366   2.408  -9.908
  166    HB3  SER  23           1HB      SER  23   7.291   3.738  -9.213
  167    HG   SER  23           HG       SER  23   8.836   1.746  -8.820
  168    H    ASP  24           H        ASP  24   5.700   4.409  -6.999
  169    HA   ASP  24           HA       ASP  24   2.997   3.261  -6.915
  170    HB2  ASP  24           2HB      ASP  24   2.401   5.069  -5.370
  171    HB3  ASP  24           1HB      ASP  24   3.748   4.124  -4.756
  172    H    GLU  25           H        GLU  25   1.223   4.553  -7.594
  173    HA   GLU  25           HA       GLU  25   1.959   6.414  -9.751
  174    HB2  GLU  25           2HB      GLU  25  -0.798   5.520  -9.831
  175    HB3  GLU  25           1HB      GLU  25   0.446   5.406 -11.061
  176    HG2  GLU  25           2HG      GLU  25  -0.070   3.195 -10.731
  177    HG3  GLU  25           1HG      GLU  25   1.296   3.403  -9.637
  178    H    GLY  26           H        GLY  26   0.112   5.965  -6.852
  179    HA2  GLY  26           2HA      GLY  26  -1.053   8.646  -7.126
  180    HA3  GLY  26           1HA      GLY  26  -1.602   7.410  -6.006
  181    H    GLY  27           H        GLY  27   1.745   7.506  -6.060
  182    HA2  GLY  27           2HA      GLY  27   3.336   8.415  -4.664
  183    HA3  GLY  27           1HA      GLY  27   2.194   9.695  -4.281
  184    H    TRP  28           H        TRP  28   1.703   6.228  -3.823
  185    HA   TRP  28           HA       TRP  28   1.256   6.781  -0.998
  186    HB2  TRP  28           2HB      TRP  28   0.144   4.585  -0.923
  187    HB3  TRP  28           1HB      TRP  28  -0.566   5.656  -2.120
  188    HD1  TRP  28           HD       TRP  28  -0.255   4.971  -4.702
  189    HE1  TRP  28           1HE      TRP  28   0.275   2.715  -5.823
  190    HE3  TRP  28           3HE      TRP  28   1.482   2.453  -0.610
  191    HZ2  TRP  28           2HZ      TRP  28   1.292   0.175  -5.042
  192    HZ3  TRP  28           3HZ      TRP  28   2.213   0.119  -0.875
  193    HH2  TRP  28           HH       TRP  28   2.120  -0.993  -3.050
  194    H    LEU  29           H        LEU  29   3.349   4.851  -3.073
  195    HA   LEU  29           HA       LEU  29   4.452   3.254  -0.999
  196    HB2  LEU  29           2HB      LEU  29   4.608   2.650  -3.382
  197    HB3  LEU  29           1HB      LEU  29   5.657   4.029  -3.660
  198    HG   LEU  29           HG       LEU  29   7.263   2.973  -1.990
  199   HD11  LEU  29          1HD1      LEU  29   5.746   1.430  -0.917
  200   HD12  LEU  29          2HD1      LEU  29   7.046   0.535  -1.702
  201   HD13  LEU  29          3HD1      LEU  29   5.451   0.608  -2.450
  202   HD21  LEU  29          3HD2      LEU  29   6.657   1.547  -4.577
  203   HD22  LEU  29          1HD2      LEU  29   8.155   1.393  -3.663
  204   HD23  LEU  29          2HD2      LEU  29   7.709   2.948  -4.365
  205    H    THR  30           H        THR  30   5.335   6.330  -2.463
  206    HA   THR  30           HA       THR  30   7.782   6.711  -1.140
  207    HB   THR  30           HB       THR  30   6.987   8.036  -3.104
  208    HG1  THR  30           1HG      THR  30   8.053   9.181  -0.771
  209   HG21  THR  30          3HG2      THR  30   4.680   8.436  -2.177
  210   HG22  THR  30          1HG2      THR  30   5.471   9.865  -2.845
  211   HG23  THR  30          2HG2      THR  30   5.397   9.633  -1.097
  212    H    ARG  31           H        ARG  31   4.631   6.697   0.095
  213    HA   ARG  31           HA       ARG  31   5.262   8.423   2.365
  214    HB2  ARG  31           2HB      ARG  31   2.706   6.976   1.648
  215    HB3  ARG  31           1HB      ARG  31   2.899   8.101   2.984
  216    HG2  ARG  31           2HG      ARG  31   3.519   8.980   0.205
  217    HG3  ARG  31           1HG      ARG  31   1.847   8.905   0.760
  218    HD2  ARG  31           2HD      ARG  31   3.861  10.269   2.472
  219    HD3  ARG  31           1HD      ARG  31   3.276  11.095   1.031
  220    HE   ARG  31           HE       ARG  31   1.427  10.067   3.079
  221   HH11  ARG  31          1HH1      ARG  31   2.611  12.689   1.074
  222   HH12  ARG  31          2HH1      ARG  31   1.328  13.769   1.517
  223   HH21  ARG  31          1HH2      ARG  31  -0.264  11.465   3.635
  224   HH22  ARG  31          2HH2      ARG  31  -0.322  13.063   2.962
  225    H    LEU  32           H        LEU  32   4.482   5.070   1.606
  226    HA   LEU  32           HA       LEU  32   4.353   4.086   4.226
  227    HB2  LEU  32           2HB      LEU  32   3.696   2.992   1.982
  228    HB3  LEU  32           1HB      LEU  32   5.369   2.468   1.913
  229    HG   LEU  32           HG       LEU  32   4.940   1.447   4.241
  230   HD11  LEU  32          1HD1      LEU  32   2.817   2.589   4.659
  231   HD12  LEU  32          2HD1      LEU  32   2.639   0.835   4.705
  232   HD13  LEU  32          3HD1      LEU  32   2.096   1.742   3.293
  233   HD21  LEU  32          3HD2      LEU  32   3.962  -0.585   3.226
  234   HD22  LEU  32          1HD2      LEU  32   5.301   0.084   2.295
  235   HD23  LEU  32          2HD2      LEU  32   3.642   0.341   1.758
  236    H    LEU  33           H        LEU  33   7.066   4.713   2.124
  237    HA   LEU  33           HA       LEU  33   9.002   3.281   3.645
  238    HB2  LEU  33           2HB      LEU  33   9.314   5.542   1.673
  239    HB3  LEU  33           1HB      LEU  33  10.646   4.618   2.341
  240    HG   LEU  33           HG       LEU  33   8.431   3.478   0.631
  241   HD11  LEU  33          1HD1      LEU  33  10.151   3.306  -1.090
  242   HD12  LEU  33          2HD1      LEU  33  11.305   4.111  -0.026
  243   HD13  LEU  33          3HD1      LEU  33   9.890   4.984  -0.614
  244   HD21  LEU  33          3HD2      LEU  33   9.297   1.822   2.159
  245   HD22  LEU  33          1HD2      LEU  33  10.954   2.251   1.737
  246   HD23  LEU  33          2HD2      LEU  33   9.905   1.497   0.536
  247    H    GLN  34           H        GLN  34   7.327   6.131   4.232
  248    HA   GLN  34           HA       GLN  34   9.466   7.272   5.874
  249    HB2  GLN  34           2HB      GLN  34   6.711   8.326   5.195
  250    HB3  GLN  34           1HB      GLN  34   7.888   9.169   6.189
  251    HG2  GLN  34           2HG      GLN  34   8.312   8.398   3.312
  252    HG3  GLN  34           1HG      GLN  34   7.792   9.988   3.867
  253   HE21  GLN  34          1HE2      GLN  34  10.426   7.763   3.611
  254   HE22  GLN  34          2HE2      GLN  34  11.678   8.867   4.069
  255    H    THR  35           H        THR  35   6.239   5.886   6.103
  256    HA   THR  35           HA       THR  35   6.083   6.249   8.945
  257    HB   THR  35           HB       THR  35   4.018   4.791   8.714
  258    HG1  THR  35           1HG      THR  35   3.403   4.129   6.741
  259   HG21  THR  35          3HG2      THR  35   4.214   7.275   7.005
  260   HG22  THR  35          1HG2      THR  35   3.895   7.228   8.737
  261   HG23  THR  35          2HG2      THR  35   2.716   6.560   7.609
  262    H    LYS  36           H        LYS  36   6.964   3.614   6.779
  263    HA   LYS  36           HA       LYS  36   7.417   1.923   9.149
  264    HB2  LYS  36           2HB      LYS  36   6.615   1.305   6.348
  265    HB3  LYS  36           1HB      LYS  36   7.537   0.104   7.245
  266    HG2  LYS  36           2HG      LYS  36   5.773  -0.487   8.457
  267    HG3  LYS  36           1HG      LYS  36   5.339   1.189   8.793
  268    HD2  LYS  36           2HD      LYS  36   4.320   1.324   6.545
  269    HD3  LYS  36           1HD      LYS  36   4.670  -0.391   6.317
  270    HE2  LYS  36           2HE      LYS  36   2.362  -0.080   7.022
  271    HE3  LYS  36           1HE      LYS  36   3.288  -0.930   8.259
  272    HZ1  LYS  36           3HZ      LYS  36   3.561   1.263   9.382
  273    HZ2  LYS  36           1HZ      LYS  36   1.971   0.700   9.333
  274    HZ3  LYS  36           2HZ      LYS  36   2.464   1.925   8.271
  275    H    ASN  37           H        ASN  37   9.164   3.998   7.770
  276    HA   ASN  37           HA       ASN  37  11.386   4.365   7.535
  277    HB2  ASN  37           2HB      ASN  37  11.382   2.599   9.491
  278    HB3  ASN  37           1HB      ASN  37  12.087   1.549   8.269
  279   HD21  ASN  37          1HD2      ASN  37  12.557   4.290  10.307
  280   HD22  ASN  37          2HD2      ASN  37  14.248   4.492   9.994
  281    H    TYR  38           H        TYR  38  13.471   3.143   6.511
  282    HA   TYR  38           HA       TYR  38  12.610   2.515   3.795
  283    HB2  TYR  38           2HB      TYR  38  15.388   3.065   4.874
  284    HB3  TYR  38           1HB      TYR  38  14.948   2.916   3.176
  285    HD1  TYR  38           1HD      TYR  38  13.467   4.669   2.142
  286    HD2  TYR  38           2HD      TYR  38  15.133   5.104   6.030
  287    HE1  TYR  38           1HE      TYR  38  13.034   7.090   2.051
  288    HE2  TYR  38           2HE      TYR  38  14.707   7.523   5.952
  289    HH   TYR  38           HH       TYR  38  14.177   9.259   4.587
  290    H    ASP  39           H        ASP  39  12.460   0.575   6.056
  291    HA   ASP  39           HA       ASP  39  14.519  -1.368   5.511
  292    HB2  ASP  39           2HB      ASP  39  13.436  -1.117   7.766
  293    HB3  ASP  39           1HB      ASP  39  11.961  -1.780   7.069
  294    H    ILE  40           H        ILE  40  14.456  -2.155   3.517
  295    HA   ILE  40           HA       ILE  40  12.273  -2.526   1.859
  296    HB   ILE  40           HB       ILE  40  14.826  -4.149   1.900
  297   HG12  ILE  40          2HG1      ILE  40  14.181  -1.689   0.265
  298   HG13  ILE  40          1HG1      ILE  40  15.067  -1.631   1.784
  299   HG21  ILE  40          1HG2      ILE  40  13.055  -5.161   0.539
  300   HG22  ILE  40          2HG2      ILE  40  14.381  -4.561  -0.456
  301   HG23  ILE  40          3HG2      ILE  40  12.877  -3.647  -0.348
  302   HD11  ILE  40          3HD1      ILE  40  15.942  -3.214  -0.617
  303   HD12  ILE  40          1HD1      ILE  40  16.859  -2.908   0.858
  304   HD13  ILE  40          2HD1      ILE  40  16.494  -1.580  -0.246
  305    H    GLY  41           H        GLY  41  13.693  -4.765   4.202
  306    HA2  GLY  41           2HA      GLY  41  12.265  -7.067   3.526
  307    HA3  GLY  41           1HA      GLY  41  12.894  -6.704   5.125
  308    H    ALA  42           H        ALA  42  11.446  -4.630   5.999
  309    HA   ALA  42           HA       ALA  42   8.997  -5.813   6.733
  310    HB1  ALA  42           1HB      ALA  42   8.501  -3.712   7.839
  311    HB2  ALA  42           2HB      ALA  42   9.792  -2.910   6.942
  312    HB3  ALA  42           3HB      ALA  42  10.180  -4.165   8.120
  313    H    ALA  43           H        ALA  43   9.791  -3.299   4.366
  314    HA   ALA  43           HA       ALA  43   7.176  -2.574   3.654
  315    HB1  ALA  43           1HB      ALA  43   9.629  -2.573   1.898
  316    HB2  ALA  43           2HB      ALA  43   9.184  -1.298   3.032
  317    HB3  ALA  43           3HB      ALA  43   8.155  -1.639   1.639
  318    H    LEU  44           H        LEU  44   9.353  -4.988   2.222
  319    HA   LEU  44           HA       LEU  44   7.566  -5.846   0.208
  320    HB2  LEU  44           2HB      LEU  44  10.124  -6.206   0.512
  321    HB3  LEU  44           1HB      LEU  44   9.649  -7.622   1.430
  322    HG   LEU  44           HG       LEU  44   8.430  -8.465  -0.561
  323   HD11  LEU  44          1HD1      LEU  44   9.637  -6.032  -1.862
  324   HD12  LEU  44          2HD1      LEU  44   7.927  -6.437  -1.718
  325   HD13  LEU  44          3HD1      LEU  44   8.981  -7.404  -2.751
  326   HD21  LEU  44          3HD2      LEU  44  11.344  -7.835  -1.025
  327   HD22  LEU  44          1HD2      LEU  44  10.417  -9.111  -1.811
  328   HD23  LEU  44          2HD2      LEU  44  10.717  -9.183  -0.074
  329    H    ASP  45           H        ASP  45   8.016  -6.773   3.551
  330    HA   ASP  45           HA       ASP  45   6.482  -9.168   3.458
  331    HB2  ASP  45           2HB      ASP  45   8.163  -8.542   5.230
  332    HB3  ASP  45           1HB      ASP  45   6.972  -7.414   5.864
  333    H    THR  46           H        THR  46   5.732  -5.805   4.061
  334    HA   THR  46           HA       THR  46   3.179  -6.068   5.159
  335    HB   THR  46           HB       THR  46   4.099  -3.830   3.346
  336    HG1  THR  46           1HG      THR  46   5.500  -4.396   5.238
  337   HG21  THR  46          3HG2      THR  46   2.545  -2.456   4.630
  338   HG22  THR  46          1HG2      THR  46   2.088  -3.857   5.598
  339   HG23  THR  46          2HG2      THR  46   1.699  -3.810   3.879
  340    H    ILE  47           H        ILE  47   4.250  -6.276   1.823
  341    HA   ILE  47           HA       ILE  47   1.458  -6.407   0.955
  342    HB   ILE  47           HB       ILE  47   2.379  -6.263  -1.364
  343   HG12  ILE  47          2HG1      ILE  47   4.869  -5.089  -0.927
  344   HG13  ILE  47          1HG1      ILE  47   4.878  -6.517   0.108
  345   HG21  ILE  47          1HG2      ILE  47   3.188  -3.994   0.453
  346   HG22  ILE  47          2HG2      ILE  47   1.537  -4.316  -0.076
  347   HG23  ILE  47          3HG2      ILE  47   2.774  -3.885  -1.258
  348   HD11  ILE  47          3HD1      ILE  47   4.274  -6.507  -2.837
  349   HD12  ILE  47          1HD1      ILE  47   4.368  -7.921  -1.791
  350   HD13  ILE  47          2HD1      ILE  47   5.812  -6.959  -2.102
  351    H    GLN  48           H        GLN  48   3.703  -8.458   2.034
  352    HA   GLN  48           HA       GLN  48   3.891 -10.699   2.120
  353    HB2  GLN  48           2HB      GLN  48   1.234 -10.295   1.485
  354    HB3  GLN  48           1HB      GLN  48   1.766 -11.451   0.274
  355    HG2  GLN  48           2HG      GLN  48   2.263 -11.834   3.206
  356    HG3  GLN  48           1HG      GLN  48   0.798 -12.398   2.409
  357   HE21  GLN  48          1HE2      GLN  48   2.979 -13.867   3.744
  358   HE22  GLN  48          2HE2      GLN  48   3.557 -14.998   2.569
  359    H    TYR  49           H        TYR  49   3.029  -9.812  -1.240
  360    HA   TYR  49           HA       TYR  49   4.320 -11.916  -2.528
  361    HB2  TYR  49           2HB      TYR  49   3.827  -9.091  -3.463
  362    HB3  TYR  49           1HB      TYR  49   4.411 -10.376  -4.513
  363    HD1  TYR  49           2HD      TYR  49   2.934 -12.531  -4.570
  364    HD2  TYR  49           1HD      TYR  49   1.547  -8.726  -3.287
  365    HE1  TYR  49           2HE      TYR  49   0.619 -13.242  -4.994
  366    HE2  TYR  49           1HE      TYR  49  -0.774  -9.423  -3.700
  367    HH   TYR  49           HH       TYR  49  -1.999 -11.060  -5.007
  368    H    SER  50           H        SER  50   6.316 -12.406  -1.729
  369    HA   SER  50           HA       SER  50   8.406 -10.367  -2.026
  370    HB2  SER  50           2HB      SER  50   9.592 -12.357  -0.604
  371    HB3  SER  50           1HB      SER  50   8.731 -11.000   0.128
  372    HG   SER  50           HG       SER  50   6.893 -12.277   0.283
  373    H    LYS  51           H        LYS  51   7.716 -13.801  -2.623
  374    HA   LYS  51           HA       LYS  51  10.109 -14.287  -4.073
  375    HB2  LYS  51           2HB      LYS  51   7.499 -15.799  -4.002
  376    HB3  LYS  51           1HB      LYS  51   8.949 -16.369  -4.812
  377    HG2  LYS  51           2HG      LYS  51  10.129 -16.286  -2.626
  378    HG3  LYS  51           1HG      LYS  51   8.587 -15.890  -1.867
  379    HD2  LYS  51           2HD      LYS  51   8.955 -18.252  -1.641
  380    HD3  LYS  51           1HD      LYS  51   7.652 -18.003  -2.808
  381    HE2  LYS  51           2HE      LYS  51   9.134 -18.397  -4.640
  382    HE3  LYS  51           1HE      LYS  51  10.538 -18.422  -3.573
  383    HZ1  LYS  51           3HZ      LYS  51   9.654 -20.417  -2.539
  384    HZ2  LYS  51           1HZ      LYS  51   9.870 -20.641  -4.201
  385    HZ3  LYS  51           2HZ      LYS  51   8.321 -20.393  -3.579
  386    H    HIS  52           H        HIS  52   6.727 -13.988  -5.181
  387    HA   HIS  52           HA       HIS  52   7.710 -12.808  -7.664
  388    HB2  HIS  52           2HB      HIS  52   6.727 -15.473  -7.462
  389    HB3  HIS  52           1HB      HIS  52   5.533 -14.521  -8.336
  390    HD1  HIS  52           1HD      HIS  52   6.028 -15.606 -10.606
  391    HD2  HIS  52           2HD      HIS  52   9.353 -13.842  -8.832
  392    HE1  HIS  52           1HE      HIS  52   7.812 -15.564 -12.386
  393    HE2  HIS  52           2HE      HIS  52   9.800 -14.451 -11.307
  394    H1   GLY   1           1HT      GLY   1 -17.516  19.228   2.269
  395    H2   GLY   1           2HT      GLY   1 -16.560  18.030   2.979
  396    H3   GLY   1           3HT      GLY   1 -16.931  19.437   3.842
  397    HA2  GLY   1           1HA      GLY   1 -18.271  17.624   4.641
  398    HA3  GLY   1           2HA      GLY   1 -19.271  18.840   3.858
  399    H    SER   2           H        SER   2 -20.524  16.608   4.026
  400    HA   SER   2           HA       SER   2 -20.032  15.033   1.606
  401    HB2  SER   2           2HB      SER   2 -22.082  14.324   3.680
  402    HB3  SER   2           1HB      SER   2 -21.145  13.259   2.629
  403    HG   SER   2           HG       SER   2 -20.325  13.136   4.716
  404    HA   PRO   3           HA       PRO   3 -23.536  17.509   0.144
  405    HB2  PRO   3           2HB      PRO   3 -22.984  17.325  -2.477
  406    HB3  PRO   3           1HB      PRO   3 -22.072  18.401  -1.412
  407    HG2  PRO   3           2HG      PRO   3 -21.334  15.701  -2.463
  408    HG3  PRO   3           1HG      PRO   3 -20.326  17.147  -2.286
  409    HD2  PRO   3           2HD      PRO   3 -20.347  15.046  -0.509
  410    HD3  PRO   3           1HD      PRO   3 -19.873  16.704  -0.088
  411    HA   PRO   4           HA       PRO   4 -26.387  14.222  -0.745
  412    HB2  PRO   4           2HB      PRO   4 -27.886  16.184  -2.370
  413    HB3  PRO   4           1HB      PRO   4 -28.403  15.277  -0.946
  414    HG2  PRO   4           2HG      PRO   4 -27.905  17.892  -0.790
  415    HG3  PRO   4           1HG      PRO   4 -27.452  16.797   0.527
  416    HD2  PRO   4           2HD      PRO   4 -25.728  17.982  -1.622
  417    HD3  PRO   4           1HD      PRO   4 -25.397  17.800   0.115
  418    H    GLU   5           H        GLU   5 -24.657  15.904  -3.131
  419    HA   GLU   5           HA       GLU   5 -25.692  14.538  -5.425
  420    HB2  GLU   5           2HB      GLU   5 -23.288  16.276  -4.922
  421    HB3  GLU   5           1HB      GLU   5 -23.500  15.445  -6.457
  422    HG2  GLU   5           2HG      GLU   5 -25.290  17.527  -5.236
  423    HG3  GLU   5           1HG      GLU   5 -24.338  17.648  -6.714
  424    H    ALA   6           H        ALA   6 -23.324  13.924  -3.003
  425    HA   ALA   6           HA       ALA   6 -21.958  11.865  -4.501
  426    HB1  ALA   6           1HB      ALA   6 -21.765  12.543  -1.563
  427    HB2  ALA   6           2HB      ALA   6 -20.764  13.244  -2.834
  428    HB3  ALA   6           3HB      ALA   6 -20.659  11.520  -2.483
  429    H    ASP   7           H        ASP   7 -22.553   9.802  -4.585
  430    HA   ASP   7           HA       ASP   7 -24.988   8.902  -3.566
  431    HB2  ASP   7           2HB      ASP   7 -23.744   7.903  -5.511
  432    HB3  ASP   7           1HB      ASP   7 -22.653   7.149  -4.353
  433    HA   PRO   8           HA       PRO   8 -24.050   8.240   0.708
  434    HB2  PRO   8           2HB      PRO   8 -26.138   6.532   1.227
  435    HB3  PRO   8           1HB      PRO   8 -26.279   8.294   1.168
  436    HG2  PRO   8           2HG      PRO   8 -26.913   6.267  -0.947
  437    HG3  PRO   8           1HG      PRO   8 -27.827   7.708  -0.462
  438    HD2  PRO   8           2HD      PRO   8 -26.300   7.716  -2.656
  439    HD3  PRO   8           1HD      PRO   8 -26.410   9.151  -1.613
  440    H    ARG   9           H        ARG   9 -24.325   5.660  -1.621
  441    HA   ARG   9           HA       ARG   9 -23.224   3.731   0.277
  442    HB2  ARG   9           2HB      ARG   9 -24.133   3.403  -2.588
  443    HB3  ARG   9           1HB      ARG   9 -23.541   2.101  -1.565
  444    HG2  ARG   9           2HG      ARG   9 -25.475   1.926  -0.441
  445    HG3  ARG   9           1HG      ARG   9 -25.731   3.670  -0.408
  446    HD2  ARG   9           2HD      ARG   9 -26.164   1.918  -2.824
  447    HD3  ARG   9           1HD      ARG   9 -27.434   2.431  -1.719
  448    HE   ARG   9           HE       ARG   9 -25.809   4.355  -3.267
  449   HH11  ARG   9          1HH1      ARG   9 -28.921   3.195  -2.111
  450   HH12  ARG   9          2HH1      ARG   9 -29.816   4.466  -2.877
  451   HH21  ARG   9          1HH2      ARG   9 -26.999   6.007  -4.283
  452   HH22  ARG   9          2HH2      ARG   9 -28.729   6.061  -4.099
  453    H    LEU  10           H        LEU  10 -22.321   5.714  -2.417
  454    HA   LEU  10           HA       LEU  10 -19.889   4.389  -3.075
  455    HB2  LEU  10           2HB      LEU  10 -20.965   5.879  -4.659
  456    HB3  LEU  10           1HB      LEU  10 -20.811   7.225  -3.547
  457    HG   LEU  10           HG       LEU  10 -18.345   7.103  -3.778
  458   HD11  LEU  10          1HD1      LEU  10 -17.414   5.774  -5.639
  459   HD12  LEU  10          2HD1      LEU  10 -18.987   5.003  -5.845
  460   HD13  LEU  10          3HD1      LEU  10 -18.080   4.771  -4.350
  461   HD21  LEU  10          3HD2      LEU  10 -19.866   7.385  -6.365
  462   HD22  LEU  10          1HD2      LEU  10 -18.250   8.015  -6.048
  463   HD23  LEU  10          2HD2      LEU  10 -19.633   8.646  -5.153
  464    H    ILE  11           H        ILE  11 -20.762   6.994  -0.873
  465    HA   ILE  11           HA       ILE  11 -18.053   7.576  -0.142
  466    HB   ILE  11           HB       ILE  11 -19.879   9.244   0.056
  467   HG12  ILE  11          2HG1      ILE  11 -18.608   8.647   2.736
  468   HG13  ILE  11          1HG1      ILE  11 -17.750   9.381   1.386
  469   HG21  ILE  11          1HG2      ILE  11 -21.410   9.126   1.981
  470   HG22  ILE  11          2HG2      ILE  11 -20.820   7.501   2.324
  471   HG23  ILE  11          3HG2      ILE  11 -21.672   7.828   0.816
  472   HD11  ILE  11          3HD1      ILE  11 -19.236  11.288   1.446
  473   HD12  ILE  11          1HD1      ILE  11 -18.499  11.027   3.026
  474   HD13  ILE  11          2HD1      ILE  11 -20.169  10.541   2.745
  475    H    GLU  12           H        GLU  12 -20.363   5.207   0.742
  476    HA   GLU  12           HA       GLU  12 -19.306   4.655   3.347
  477    HB2  GLU  12           2HB      GLU  12 -21.324   3.340   1.573
  478    HB3  GLU  12           1HB      GLU  12 -20.675   2.462   2.951
  479    HG2  GLU  12           2HG      GLU  12 -22.335   4.947   2.910
  480    HG3  GLU  12           1HG      GLU  12 -22.605   3.439   3.780
  481    H    SER  13           H        SER  13 -18.307   3.934   0.194
  482    HA   SER  13           HA       SER  13 -17.167   1.384   0.566
  483    HB2  SER  13           2HB      SER  13 -16.109   3.566  -1.245
  484    HB3  SER  13           1HB      SER  13 -15.921   1.823  -1.445
  485    HG   SER  13           HG       SER  13 -18.496   2.233  -1.287
  486    H    LEU  14           H        LEU  14 -16.157   4.594   1.443
  487    HA   LEU  14           HA       LEU  14 -13.440   3.905   2.029
  488    HB2  LEU  14           2HB      LEU  14 -15.158   6.297   2.670
  489    HB3  LEU  14           1HB      LEU  14 -13.527   6.137   3.290
  490    HG   LEU  14           HG       LEU  14 -12.839   5.863   0.804
  491   HD11  LEU  14          1HD1      LEU  14 -14.296   7.037  -0.770
  492   HD12  LEU  14          2HD1      LEU  14 -15.525   7.194   0.485
  493   HD13  LEU  14          3HD1      LEU  14 -15.072   5.598  -0.112
  494   HD21  LEU  14          3HD2      LEU  14 -13.810   8.509   1.878
  495   HD22  LEU  14          1HD2      LEU  14 -12.662   8.294   0.557
  496   HD23  LEU  14          2HD2      LEU  14 -12.238   7.774   2.189
  497    H    SER  15           H        SER  15 -16.416   4.354   3.906
  498    HA   SER  15           HA       SER  15 -15.245   3.899   6.435
  499    HB2  SER  15           2HB      SER  15 -18.028   3.079   6.271
  500    HB3  SER  15           1HB      SER  15 -17.306   4.410   7.172
  501    HG   SER  15           HG       SER  15 -18.862   4.672   5.171
  502    H    GLN  16           H        GLN  16 -16.436   1.787   3.934
  503    HA   GLN  16           HA       GLN  16 -16.769  -0.560   5.428
  504    HB2  GLN  16           2HB      GLN  16 -17.521  -0.234   3.073
  505    HB3  GLN  16           1HB      GLN  16 -15.843  -0.354   2.559
  506    HG2  GLN  16           2HG      GLN  16 -17.111  -2.443   2.255
  507    HG3  GLN  16           1HG      GLN  16 -15.713  -2.627   3.309
  508   HE21  GLN  16          1HE2      GLN  16 -16.011  -3.108   5.460
  509   HE22  GLN  16          2HE2      GLN  16 -17.545  -3.565   6.117
  510    H    MET  17           H        MET  17 -13.908   0.895   3.988
  511    HA   MET  17           HA       MET  17 -12.171  -1.302   4.457
  512    HB2  MET  17           2HB      MET  17 -11.518   1.642   4.188
  513    HB3  MET  17           1HB      MET  17 -10.347   0.334   4.122
  514    HG2  MET  17           2HG      MET  17 -12.532   0.952   2.155
  515    HG3  MET  17           1HG      MET  17 -10.790   1.013   1.896
  516    HE1  MET  17           3HE      MET  17  -9.261  -1.005   1.544
  517    HE2  MET  17           1HE      MET  17  -9.749  -2.694   1.688
  518    HE3  MET  17           2HE      MET  17  -9.667  -1.673   3.126
  519    H    LEU  18           H        LEU  18 -12.885   1.664   6.242
  520    HA   LEU  18           HA       LEU  18 -11.149   1.213   8.410
  521    HB2  LEU  18           2HB      LEU  18 -12.155   3.388   7.886
  522    HB3  LEU  18           1HB      LEU  18 -13.741   2.758   8.279
  523    HG   LEU  18           HG       LEU  18 -12.972   2.426  10.625
  524   HD11  LEU  18          1HD1      LEU  18 -10.545   3.924   9.654
  525   HD12  LEU  18          2HD1      LEU  18 -10.587   2.271  10.264
  526   HD13  LEU  18          3HD1      LEU  18 -10.943   3.620  11.345
  527   HD21  LEU  18          3HD2      LEU  18 -14.270   4.372  10.053
  528   HD22  LEU  18          1HD2      LEU  18 -12.825   5.213   9.493
  529   HD23  LEU  18          2HD2      LEU  18 -13.014   4.828  11.201
  530    H    SER  19           H        SER  19 -14.486   0.298   7.785
  531    HA   SER  19           HA       SER  19 -15.094  -0.757  10.329
  532    HB2  SER  19           2HB      SER  19 -16.524  -0.269   8.057
  533    HB3  SER  19           1HB      SER  19 -16.394  -2.023   7.992
  534    HG   SER  19           HG       SER  19 -17.971  -0.492   9.539
  535    H    MET  20           H        MET  20 -13.370  -2.008   7.593
  536    HA   MET  20           HA       MET  20 -13.425  -4.756   8.482
  537    HB2  MET  20           2HB      MET  20 -13.298  -3.997   6.066
  538    HB3  MET  20           1HB      MET  20 -11.646  -3.497   6.390
  539    HG2  MET  20           2HG      MET  20 -11.068  -5.804   6.970
  540    HG3  MET  20           1HG      MET  20 -12.719  -6.299   6.607
  541    HE1  MET  20           3HE      MET  20 -13.269  -4.413   3.907
  542    HE2  MET  20           1HE      MET  20 -13.828  -6.048   4.267
  543    HE3  MET  20           2HE      MET  20 -12.965  -5.723   2.765
  544    H    GLY  21           H        GLY  21 -11.675  -1.960   9.210
  545    HA2  GLY  21           2HA      GLY  21 -10.161  -1.893  11.047
  546    HA3  GLY  21           1HA      GLY  21  -9.700  -3.551  10.689
  547    H    PHE  22           H        PHE  22  -9.961  -1.669   7.904
  548    HA   PHE  22           HA       PHE  22  -7.040  -1.507   7.751
  549    HB2  PHE  22           2HB      PHE  22  -9.190  -2.038   5.821
  550    HB3  PHE  22           1HB      PHE  22  -7.966  -0.921   5.236
  551    HD1  PHE  22           1HD      PHE  22  -5.572  -1.638   5.227
  552    HD2  PHE  22           2HD      PHE  22  -8.774  -4.345   5.943
  553    HE1  PHE  22           1HE      PHE  22  -4.092  -3.526   4.688
  554    HE2  PHE  22           2HE      PHE  22  -7.299  -6.240   5.408
  555    HZ   PHE  22           HZ       PHE  22  -4.951  -5.828   4.779
  556    H    SER  23           H        SER  23  -6.093   0.360   7.968
  557    HA   SER  23           HA       SER  23  -7.214   2.778   6.870
  558    HB2  SER  23           2HB      SER  23  -6.701   3.892   9.211
  559    HB3  SER  23           1HB      SER  23  -8.264   3.134   8.910
  560    HG   SER  23           HG       SER  23  -7.380   2.450  10.897
  561    H    ASP  24           H        ASP  24  -5.609   4.528   6.859
  562    HA   ASP  24           HA       ASP  24  -2.908   3.392   6.813
  563    HB2  ASP  24           2HB      ASP  24  -2.371   5.510   5.492
  564    HB3  ASP  24           1HB      ASP  24  -3.389   4.314   4.706
  565    H    GLU  25           H        GLU  25  -1.136   4.984   7.272
  566    HA   GLU  25           HA       GLU  25  -1.758   6.467   9.747
  567    HB2  GLU  25           2HB      GLU  25   1.037   5.955   9.540
  568    HB3  GLU  25           1HB      GLU  25  -0.095   5.321  10.725
  569    HG2  GLU  25           2HG      GLU  25   0.907   3.432   9.809
  570    HG3  GLU  25           1HG      GLU  25  -0.652   3.534   8.993
  571    H    GLY  26           H        GLY  26   0.375   6.355   6.911
  572    HA2  GLY  26           2HA      GLY  26   0.923   9.222   7.195
  573    HA3  GLY  26           1HA      GLY  26   1.744   8.112   6.105
  574    H    GLY  27           H        GLY  27  -1.545   7.605   6.028
  575    HA2  GLY  27           2HA      GLY  27  -3.258   8.259   4.646
  576    HA3  GLY  27           1HA      GLY  27  -2.319   9.679   4.217
  577    H    TRP  28           H        TRP  28  -1.560   6.226   3.809
  578    HA   TRP  28           HA       TRP  28  -1.016   6.794   0.998
  579    HB2  TRP  28           2HB      TRP  28   0.309   4.827   0.952
  580    HB3  TRP  28           1HB      TRP  28   0.680   5.629   2.469
  581    HD1  TRP  28           HD       TRP  28  -0.122   4.423   4.726
  582    HE1  TRP  28           1HE      TRP  28  -0.742   1.975   5.214
  583    HE3  TRP  28           3HE      TRP  28  -0.798   2.781  -0.068
  584    HZ2  TRP  28           2HZ      TRP  28  -1.424  -0.356   3.759
  585    HZ3  TRP  28           3HZ      TRP  28  -1.435   0.433  -0.438
  586    HH2  TRP  28           HH       TRP  28  -1.743  -1.099   1.441
  587    H    LEU  29           H        LEU  29  -3.284   5.079   2.990
  588    HA   LEU  29           HA       LEU  29  -4.271   3.362   0.907
  589    HB2  LEU  29           2HB      LEU  29  -4.401   2.827   3.341
  590    HB3  LEU  29           1HB      LEU  29  -5.571   4.117   3.529
  591    HG   LEU  29           HG       LEU  29  -7.029   2.865   1.861
  592   HD11  LEU  29          1HD1      LEU  29  -5.279   1.426   0.928
  593   HD12  LEU  29          2HD1      LEU  29  -6.615   0.485   1.595
  594   HD13  LEU  29          3HD1      LEU  29  -5.106   0.634   2.495
  595   HD21  LEU  29          3HD2      LEU  29  -6.389   1.515   4.480
  596   HD22  LEU  29          1HD2      LEU  29  -7.885   1.346   3.561
  597   HD23  LEU  29          2HD2      LEU  29  -7.456   2.904   4.272
  598    H    THR  30           H        THR  30  -5.217   6.425   2.379
  599    HA   THR  30           HA       THR  30  -7.658   6.768   1.034
  600    HB   THR  30           HB       THR  30  -6.943   8.155   2.952
  601    HG1  THR  30           1HG      THR  30  -8.215   8.973   0.761
  602   HG21  THR  30          3HG2      THR  30  -5.117   9.499   0.957
  603   HG22  THR  30          1HG2      THR  30  -4.610   8.528   2.340
  604   HG23  THR  30          2HG2      THR  30  -5.442  10.065   2.596
  605    H    ARG  31           H        ARG  31  -4.372   7.172  -0.003
  606    HA   ARG  31           HA       ARG  31  -5.047   8.616  -2.416
  607    HB2  ARG  31           2HB      ARG  31  -2.439   7.267  -1.656
  608    HB3  ARG  31           1HB      ARG  31  -2.670   8.466  -2.923
  609    HG2  ARG  31           2HG      ARG  31  -3.291   9.093  -0.061
  610    HG3  ARG  31           1HG      ARG  31  -1.650   9.223  -0.699
  611    HD2  ARG  31           2HD      ARG  31  -4.017  10.602  -1.952
  612    HD3  ARG  31           1HD      ARG  31  -3.024  11.349  -0.700
  613    HE   ARG  31           HE       ARG  31  -2.242  10.753  -3.450
  614   HH11  ARG  31          1HH1      ARG  31  -1.380  12.015  -0.291
  615   HH12  ARG  31          2HH1      ARG  31   0.101  12.731  -0.846
  616   HH21  ARG  31          1HH2      ARG  31  -0.294  11.693  -4.169
  617   HH22  ARG  31          2HH2      ARG  31   0.718  12.549  -3.046
  618    H    LEU  32           H        LEU  32  -4.213   5.361  -1.417
  619    HA   LEU  32           HA       LEU  32  -3.940   4.128  -3.900
  620    HB2  LEU  32           2HB      LEU  32  -3.390   3.123  -1.685
  621    HB3  LEU  32           1HB      LEU  32  -5.107   2.928  -1.384
  622    HG   LEU  32           HG       LEU  32  -5.008   1.586  -3.669
  623   HD11  LEU  32          1HD1      LEU  32  -2.654   2.053  -4.096
  624   HD12  LEU  32          2HD1      LEU  32  -2.931   0.326  -3.868
  625   HD13  LEU  32          3HD1      LEU  32  -2.215   1.282  -2.570
  626   HD21  LEU  32          3HD2      LEU  32  -4.730  -0.464  -2.371
  627   HD22  LEU  32          1HD2      LEU  32  -5.754   0.692  -1.523
  628   HD23  LEU  32          2HD2      LEU  32  -4.076   0.469  -1.023
  629    H    LEU  33           H        LEU  33  -6.829   4.640  -1.912
  630    HA   LEU  33           HA       LEU  33  -8.637   3.286  -3.606
  631    HB2  LEU  33           2HB      LEU  33  -9.032   5.446  -1.546
  632    HB3  LEU  33           1HB      LEU  33 -10.366   4.698  -2.402
  633    HG   LEU  33           HG       LEU  33  -8.393   3.193  -0.686
  634   HD11  LEU  33          1HD1      LEU  33 -10.189   3.060   0.962
  635   HD12  LEU  33          2HD1      LEU  33 -11.196   4.102  -0.044
  636   HD13  LEU  33          3HD1      LEU  33  -9.710   4.731   0.666
  637   HD21  LEU  33          3HD2      LEU  33  -9.377   1.784  -2.377
  638   HD22  LEU  33          1HD2      LEU  33 -10.992   2.374  -1.985
  639   HD23  LEU  33          2HD2      LEU  33 -10.097   1.401  -0.816
  640    H    GLN  34           H        GLN  34  -7.080   6.291  -3.967
  641    HA   GLN  34           HA       GLN  34  -9.131   7.325  -5.765
  642    HB2  GLN  34           2HB      GLN  34  -6.569   8.489  -4.678
  643    HB3  GLN  34           1HB      GLN  34  -7.497   9.279  -5.945
  644    HG2  GLN  34           2HG      GLN  34  -8.484   8.622  -3.178
  645    HG3  GLN  34           1HG      GLN  34  -8.000  10.213  -3.760
  646   HE21  GLN  34          1HE2      GLN  34 -10.555   9.314  -2.691
  647   HE22  GLN  34          2HE2      GLN  34 -11.738   9.626  -3.914
  648    H    THR  35           H        THR  35  -6.183   5.581  -5.835
  649    HA   THR  35           HA       THR  35  -5.768   6.194  -8.669
  650    HB   THR  35           HB       THR  35  -3.913   4.435  -7.109
  651    HG1  THR  35           1HG      THR  35  -4.502   6.629  -6.049
  652   HG21  THR  35          3HG2      THR  35  -3.558   6.464  -9.319
  653   HG22  THR  35          1HG2      THR  35  -3.507   4.709  -9.484
  654   HG23  THR  35          2HG2      THR  35  -2.252   5.546  -8.570
  655    H    LYS  36           H        LYS  36  -6.638   3.580  -6.501
  656    HA   LYS  36           HA       LYS  36  -6.811   1.718  -8.779
  657    HB2  LYS  36           2HB      LYS  36  -6.330   1.377  -5.868
  658    HB3  LYS  36           1HB      LYS  36  -7.276   0.128  -6.660
  659    HG2  LYS  36           2HG      LYS  36  -5.181  -0.739  -6.874
  660    HG3  LYS  36           1HG      LYS  36  -5.294   0.167  -8.384
  661    HD2  LYS  36           2HD      LYS  36  -3.942   1.903  -7.566
  662    HD3  LYS  36           1HD      LYS  36  -4.130   1.376  -5.891
  663    HE2  LYS  36           2HE      LYS  36  -1.980   0.672  -6.440
  664    HE3  LYS  36           1HE      LYS  36  -2.956  -0.781  -6.657
  665    HZ1  LYS  36           3HZ      LYS  36  -3.029  -0.289  -9.042
  666    HZ2  LYS  36           1HZ      LYS  36  -1.443  -0.503  -8.495
  667    HZ3  LYS  36           2HZ      LYS  36  -2.026   1.060  -8.801
  668    H    ASN  37           H        ASN  37  -8.707   3.907  -7.625
  669    HA   ASN  37           HA       ASN  37 -10.941   4.299  -7.660
  670    HB2  ASN  37           2HB      ASN  37 -10.749   2.397  -9.525
  671    HB3  ASN  37           1HB      ASN  37 -11.671   1.487  -8.334
  672   HD21  ASN  37          1HD2      ASN  37 -12.334   2.591 -11.024
  673   HD22  ASN  37          2HD2      ASN  37 -13.775   3.513 -10.775
  674    H    TYR  38           H        TYR  38 -13.086   3.360  -6.648
  675    HA   TYR  38           HA       TYR  38 -12.387   2.731  -3.899
  676    HB2  TYR  38           2HB      TYR  38 -15.136   3.214  -5.064
  677    HB3  TYR  38           1HB      TYR  38 -14.676   3.280  -3.369
  678    HD1  TYR  38           1HD      TYR  38 -12.874   5.092  -2.760
  679    HD2  TYR  38           2HD      TYR  38 -15.254   5.168  -6.287
  680    HE1  TYR  38           1HE      TYR  38 -12.498   7.516  -2.957
  681    HE2  TYR  38           2HE      TYR  38 -14.881   7.591  -6.495
  682    HH   TYR  38           HH       TYR  38 -14.322   9.516  -4.804
  683    H    ASP  39           H        ASP  39 -12.124   0.659  -6.002
  684    HA   ASP  39           HA       ASP  39 -14.267  -1.204  -5.413
  685    HB2  ASP  39           2HB      ASP  39 -13.336  -1.095  -7.696
  686    HB3  ASP  39           1HB      ASP  39 -11.772  -1.622  -7.073
  687    H    ILE  40           H        ILE  40 -14.250  -2.375  -3.660
  688    HA   ILE  40           HA       ILE  40 -12.038  -2.616  -1.923
  689    HB   ILE  40           HB       ILE  40 -14.505  -4.361  -1.949
  690   HG12  ILE  40          2HG1      ILE  40 -14.114  -1.736  -0.496
  691   HG13  ILE  40          1HG1      ILE  40 -15.014  -1.899  -1.999
  692   HG21  ILE  40          1HG2      ILE  40 -12.733  -5.164  -0.493
  693   HG22  ILE  40          2HG2      ILE  40 -14.087  -4.554   0.456
  694   HG23  ILE  40          3HG2      ILE  40 -12.628  -3.580   0.280
  695   HD11  ILE  40          3HD1      ILE  40 -15.694  -3.243   0.606
  696   HD12  ILE  40          1HD1      ILE  40 -16.594  -3.388  -0.902
  697   HD13  ILE  40          2HD1      ILE  40 -16.499  -1.830  -0.082
  698    H    GLY  41           H        GLY  41 -13.361  -4.745  -4.408
  699    HA2  GLY  41           2HA      GLY  41 -11.976  -7.093  -3.761
  700    HA3  GLY  41           1HA      GLY  41 -12.534  -6.660  -5.370
  701    H    ALA  42           H        ALA  42 -11.120  -4.608  -6.154
  702    HA   ALA  42           HA       ALA  42  -8.616  -5.652  -6.837
  703    HB1  ALA  42           1HB      ALA  42  -8.118  -3.427  -7.720
  704    HB2  ALA  42           2HB      ALA  42  -9.497  -2.767  -6.843
  705    HB3  ALA  42           3HB      ALA  42  -9.755  -3.924  -8.149
  706    H    ALA  43           H        ALA  43  -9.564  -3.385  -4.321
  707    HA   ALA  43           HA       ALA  43  -7.036  -2.605  -3.436
  708    HB1  ALA  43           1HB      ALA  43  -9.519  -2.900  -1.748
  709    HB2  ALA  43           2HB      ALA  43  -9.160  -1.521  -2.786
  710    HB3  ALA  43           3HB      ALA  43  -8.119  -1.879  -1.411
  711    H    LEU  44           H        LEU  44  -9.097  -5.235  -2.192
  712    HA   LEU  44           HA       LEU  44  -7.291  -6.116  -0.214
  713    HB2  LEU  44           2HB      LEU  44  -9.809  -6.942  -1.339
  714    HB3  LEU  44           1HB      LEU  44  -8.785  -8.337  -1.051
  715    HG   LEU  44           HG       LEU  44  -8.494  -7.550   1.308
  716   HD11  LEU  44          1HD1      LEU  44 -10.040  -5.909   2.197
  717   HD12  LEU  44          2HD1      LEU  44 -10.692  -5.618   0.584
  718   HD13  LEU  44          3HD1      LEU  44  -9.020  -5.191   0.950
  719   HD21  LEU  44          3HD2      LEU  44 -10.070  -9.311   0.809
  720   HD22  LEU  44          1HD2      LEU  44 -11.310  -8.127   0.388
  721   HD23  LEU  44          2HD2      LEU  44 -10.737  -8.252   2.051
  722    H    ASP  45           H        ASP  45  -7.767  -7.079  -3.563
  723    HA   ASP  45           HA       ASP  45  -5.986  -9.285  -3.527
  724    HB2  ASP  45           2HB      ASP  45  -7.795  -8.860  -5.244
  725    HB3  ASP  45           1HB      ASP  45  -6.761  -7.605  -5.920
  726    H    THR  46           H        THR  46  -5.466  -5.915  -3.558
  727    HA   THR  46           HA       THR  46  -3.102  -5.745  -5.073
  728    HB   THR  46           HB       THR  46  -3.961  -4.004  -2.753
  729    HG1  THR  46           1HG      THR  46  -5.488  -4.150  -4.505
  730   HG21  THR  46          3HG2      THR  46  -2.150  -3.299  -5.063
  731   HG22  THR  46          1HG2      THR  46  -1.555  -3.802  -3.480
  732   HG23  THR  46          2HG2      THR  46  -2.510  -2.326  -3.637
  733    H    ILE  47           H        ILE  47  -3.534  -6.559  -1.615
  734    HA   ILE  47           HA       ILE  47  -0.604  -6.896  -1.514
  735    HB   ILE  47           HB       ILE  47  -0.599  -6.202   0.825
  736   HG12  ILE  47          2HG1      ILE  47  -3.460  -5.324   0.419
  737   HG13  ILE  47          1HG1      ILE  47  -3.028  -6.839   1.211
  738   HG21  ILE  47          1HG2      ILE  47  -0.790  -3.848   0.451
  739   HG22  ILE  47          2HG2      ILE  47  -1.900  -4.096  -0.898
  740   HG23  ILE  47          3HG2      ILE  47  -0.212  -4.587  -1.042
  741   HD11  ILE  47          3HD1      ILE  47  -3.458  -5.206   2.891
  742   HD12  ILE  47          1HD1      ILE  47  -2.363  -4.051   2.130
  743   HD13  ILE  47          2HD1      ILE  47  -1.723  -5.522   2.866
  744    H    GLN  48           H        GLN  48  -2.767  -8.917  -1.939
  745    HA   GLN  48           HA       GLN  48  -3.056 -11.123  -1.474
  746    HB2  GLN  48           2HB      GLN  48  -0.550 -10.550  -0.111
  747    HB3  GLN  48           1HB      GLN  48  -1.472 -11.796   0.709
  748    HG2  GLN  48           2HG      GLN  48  -0.740 -11.853  -2.209
  749    HG3  GLN  48           1HG      GLN  48   0.160 -12.658  -0.928
  750   HE21  GLN  48          1HE2      GLN  48  -2.696 -12.687  -2.884
  751   HE22  GLN  48          2HE2      GLN  48  -3.236 -14.266  -2.428
  752    H    TYR  49           H        TYR  49  -2.528  -9.372   1.576
  753    HA   TYR  49           HA       TYR  49  -4.030 -10.861   3.311
  754    HB2  TYR  49           2HB      TYR  49  -3.632  -7.873   3.183
  755    HB3  TYR  49           1HB      TYR  49  -4.433  -8.669   4.533
  756    HD1  TYR  49           2HD      TYR  49  -1.230  -8.232   2.774
  757    HD2  TYR  49           1HD      TYR  49  -3.170  -9.918   6.160
  758    HE1  TYR  49           2HE      TYR  49   0.959  -8.643   3.811
  759    HE2  TYR  49           1HE      TYR  49  -0.985 -10.328   7.212
  760    HH   TYR  49           HH       TYR  49   1.885  -8.946   6.097
  761    H    SER  50           H        SER  50  -5.986 -11.618   3.069
  762    HA   SER  50           HA       SER  50  -8.181  -9.787   2.493
  763    HB2  SER  50           2HB      SER  50  -9.112 -11.711   0.972
  764    HB3  SER  50           1HB      SER  50  -7.914 -10.596   0.310
  765    HG   SER  50           HG       SER  50  -6.342 -12.122   0.540
  766    H    LYS  51           H        LYS  51  -7.785 -13.308   2.738
  767    HA   LYS  51           HA       LYS  51 -10.009 -13.534   4.540
  768    HB2  LYS  51           2HB      LYS  51  -7.965 -15.570   3.622
  769    HB3  LYS  51           1HB      LYS  51  -9.398 -15.945   4.564
  770    HG2  LYS  51           2HG      LYS  51 -10.813 -15.638   2.797
  771    HG3  LYS  51           1HG      LYS  51  -9.735 -14.503   1.989
  772    HD2  LYS  51           2HD      LYS  51  -9.721 -16.496   0.700
  773    HD3  LYS  51           1HD      LYS  51  -8.190 -16.437   1.570
  774    HE2  LYS  51           2HE      LYS  51  -9.077 -17.972   3.245
  775    HE3  LYS  51           1HE      LYS  51 -10.614 -18.022   2.388
  776    HZ1  LYS  51           3HZ      LYS  51  -9.439 -18.952   0.475
  777    HZ2  LYS  51           1HZ      LYS  51  -9.295 -19.939   1.840
  778    HZ3  LYS  51           2HZ      LYS  51  -7.997 -18.967   1.357
  779    H    HIS  52           H        HIS  52  -6.508 -13.724   4.769
  780    HA   HIS  52           HA       HIS  52  -6.494 -12.956   7.504
  781    HB2  HIS  52           2HB      HIS  52  -6.982 -15.546   7.444
  782    HB3  HIS  52           1HB      HIS  52  -5.268 -15.663   7.061
  783    HD1  HIS  52           1HD      HIS  52  -3.974 -13.751   8.935
  784    HD2  HIS  52           2HD      HIS  52  -7.199 -16.121  10.071
  785    HE1  HIS  52           1HE      HIS  52  -3.850 -13.903  11.447
  786    HE2  HIS  52           2HE      HIS  52  -5.728 -15.458  12.098
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1  20.285  19.705  -3.429
    2    H2   GLY   1           2HT      GLY   1  19.102  19.778  -2.225
    3    H3   GLY   1           3HT      GLY   1  18.800  20.457  -3.743
    4    HA2  GLY   1           1HA      GLY   1  17.638  18.378  -3.559
    5    HA3  GLY   1           2HA      GLY   1  18.913  18.263  -4.763
    6    H    SER   2           H        SER   2  20.985  17.335  -4.020
    7    HA   SER   2           HA       SER   2  20.498  15.241  -2.005
    8    HB2  SER   2           2HB      SER   2  22.587  15.097  -4.177
    9    HB3  SER   2           1HB      SER   2  21.868  13.775  -3.256
   10    HG   SER   2           HG       SER   2  20.988  13.859  -5.339
   11    HA   PRO   3           HA       PRO   3  23.747  17.809  -0.119
   12    HB2  PRO   3           2HB      PRO   3  23.070  17.339   2.435
   13    HB3  PRO   3           1HB      PRO   3  22.174  18.477   1.431
   14    HG2  PRO   3           2HG      PRO   3  21.489  15.671   2.179
   15    HG3  PRO   3           1HG      PRO   3  20.433  17.091   2.063
   16    HD2  PRO   3           2HD      PRO   3  20.656  15.156   0.117
   17    HD3  PRO   3           1HD      PRO   3  20.133  16.824  -0.184
   18    HA   PRO   4           HA       PRO   4  26.614  14.528   0.736
   19    HB2  PRO   4           2HB      PRO   4  28.524  15.899   2.068
   20    HB3  PRO   4           1HB      PRO   4  28.269  16.084   0.329
   21    HG2  PRO   4           2HG      PRO   4  27.330  17.829   2.576
   22    HG3  PRO   4           1HG      PRO   4  28.046  18.297   1.019
   23    HD2  PRO   4           2HD      PRO   4  25.372  18.369   1.486
   24    HD3  PRO   4           1HD      PRO   4  26.056  18.023  -0.115
   25    H    GLU   5           H        GLU   5  24.826  16.176   3.020
   26    HA   GLU   5           HA       GLU   5  25.876  14.872   5.377
   27    HB2  GLU   5           2HB      GLU   5  23.330  16.480   5.061
   28    HB3  GLU   5           1HB      GLU   5  24.131  16.063   6.568
   29    HG2  GLU   5           2HG      GLU   5  26.132  17.381   5.594
   30    HG3  GLU   5           1HG      GLU   5  24.927  18.067   4.501
   31    H    ALA   6           H        ALA   6  24.100  13.874   2.839
   32    HA   ALA   6           HA       ALA   6  22.398  12.072   4.422
   33    HB1  ALA   6           1HB      ALA   6  22.191  12.872   1.517
   34    HB2  ALA   6           2HB      ALA   6  21.155  13.432   2.829
   35    HB3  ALA   6           3HB      ALA   6  21.122  11.738   2.339
   36    H    ASP   7           H        ASP   7  22.697   9.897   4.257
   37    HA   ASP   7           HA       ASP   7  25.190   8.970   3.237
   38    HB2  ASP   7           2HB      ASP   7  23.910   8.097   5.279
   39    HB3  ASP   7           1HB      ASP   7  22.902   7.226   4.130
   40    HA   PRO   8           HA       PRO   8  23.902   8.156  -0.942
   41    HB2  PRO   8           2HB      PRO   8  25.966   6.448  -1.559
   42    HB3  PRO   8           1HB      PRO   8  26.089   8.213  -1.586
   43    HG2  PRO   8           2HG      PRO   8  26.929   6.279   0.541
   44    HG3  PRO   8           1HG      PRO   8  27.773   7.719  -0.062
   45    HD2  PRO   8           2HD      PRO   8  26.421   7.756   2.251
   46    HD3  PRO   8           1HD      PRO   8  26.450   9.168   1.169
   47    H    ARG   9           H        ARG   9  24.515   5.660   1.440
   48    HA   ARG   9           HA       ARG   9  23.336   3.583  -0.220
   49    HB2  ARG   9           2HB      ARG   9  24.165   3.453   2.681
   50    HB3  ARG   9           1HB      ARG   9  23.811   2.091   1.628
   51    HG2  ARG   9           2HG      ARG   9  25.793   2.317   0.449
   52    HG3  ARG   9           1HG      ARG   9  26.003   3.999   0.935
   53    HD2  ARG   9           2HD      ARG   9  26.244   1.587   2.726
   54    HD3  ARG   9           1HD      ARG   9  27.580   2.552   2.099
   55    HE   ARG   9           HE       ARG   9  25.984   4.353   3.406
   56   HH11  ARG   9          1HH1      ARG   9  27.576   1.356   4.313
   57   HH12  ARG   9          2HH1      ARG   9  27.818   1.849   5.958
   58   HH21  ARG   9          1HH2      ARG   9  26.334   4.995   5.556
   59   HH22  ARG   9          2HH2      ARG   9  27.108   3.896   6.665
   60    H    LEU  10           H        LEU  10  22.453   5.749   2.333
   61    HA   LEU  10           HA       LEU  10  20.087   4.413   3.163
   62    HB2  LEU  10           2HB      LEU  10  21.218   6.126   4.530
   63    HB3  LEU  10           1HB      LEU  10  20.807   7.344   3.341
   64    HG   LEU  10           HG       LEU  10  18.386   6.891   3.811
   65   HD11  LEU  10          1HD1      LEU  10  17.872   5.738   5.942
   66   HD12  LEU  10          2HD1      LEU  10  19.558   5.230   6.037
   67   HD13  LEU  10          3HD1      LEU  10  18.541   4.666   4.713
   68   HD21  LEU  10          3HD2      LEU  10  20.204   7.864   6.006
   69   HD22  LEU  10          1HD2      LEU  10  18.448   8.008   6.074
   70   HD23  LEU  10          2HD2      LEU  10  19.350   8.821   4.796
   71    H    ILE  11           H        ILE  11  20.853   6.793   0.697
   72    HA   ILE  11           HA       ILE  11  18.112   7.212  -0.054
   73    HB   ILE  11           HB       ILE  11  20.007   8.885  -0.354
   74   HG12  ILE  11          2HG1      ILE  11  18.347   8.308  -2.814
   75   HG13  ILE  11          1HG1      ILE  11  17.730   9.096  -1.363
   76   HG21  ILE  11          1HG2      ILE  11  21.267   8.757  -2.451
   77   HG22  ILE  11          2HG2      ILE  11  20.583   7.160  -2.754
   78   HG23  ILE  11          3HG2      ILE  11  21.641   7.416  -1.369
   79   HD11  ILE  11          3HD1      ILE  11  19.360  10.909  -1.691
   80   HD12  ILE  11          1HD1      ILE  11  18.247  10.741  -3.049
   81   HD13  ILE  11          2HD1      ILE  11  19.897  10.133  -3.180
   82    H    GLU  12           H        GLU  12  20.406   4.799  -0.648
   83    HA   GLU  12           HA       GLU  12  19.660   4.035  -3.279
   84    HB2  GLU  12           2HB      GLU  12  21.161   2.737  -1.047
   85    HB3  GLU  12           1HB      GLU  12  20.629   1.754  -2.406
   86    HG2  GLU  12           2HG      GLU  12  22.253   4.259  -2.709
   87    HG3  GLU  12           1HG      GLU  12  22.953   2.647  -2.580
   88    H    SER  13           H        SER  13  18.176   3.657  -0.228
   89    HA   SER  13           HA       SER  13  16.759   1.275  -0.557
   90    HB2  SER  13           2HB      SER  13  15.637   3.683   0.863
   91    HB3  SER  13           1HB      SER  13  15.447   1.977   1.268
   92    HG   SER  13           HG       SER  13  17.419   3.729   1.978
   93    H    LEU  14           H        LEU  14  16.261   4.455  -1.882
   94    HA   LEU  14           HA       LEU  14  13.575   3.905  -2.779
   95    HB2  LEU  14           2HB      LEU  14  15.474   6.176  -3.379
   96    HB3  LEU  14           1HB      LEU  14  13.836   6.081  -3.995
   97    HG   LEU  14           HG       LEU  14  13.404   5.795  -1.321
   98   HD11  LEU  14          1HD1      LEU  14  14.738   7.408  -0.133
   99   HD12  LEU  14          2HD1      LEU  14  15.637   7.797  -1.599
  100   HD13  LEU  14          3HD1      LEU  14  15.801   6.203  -0.864
  101   HD21  LEU  14          3HD2      LEU  14  13.570   8.386  -2.852
  102   HD22  LEU  14          1HD2      LEU  14  12.638   8.101  -1.383
  103   HD23  LEU  14          2HD2      LEU  14  12.209   7.265  -2.875
  104    H    SER  15           H        SER  15  16.805   4.139  -4.228
  105    HA   SER  15           HA       SER  15  15.996   3.654  -6.887
  106    HB2  SER  15           2HB      SER  15  18.664   2.665  -6.290
  107    HB3  SER  15           1HB      SER  15  18.176   4.027  -7.299
  108    HG   SER  15           HG       SER  15  19.446   4.251  -5.116
  109    H    GLN  16           H        GLN  16  16.903   1.535  -4.221
  110    HA   GLN  16           HA       GLN  16  17.105  -0.876  -5.632
  111    HB2  GLN  16           2HB      GLN  16  17.789  -0.511  -3.253
  112    HB3  GLN  16           1HB      GLN  16  16.088  -0.510  -2.806
  113    HG2  GLN  16           2HG      GLN  16  16.998  -2.665  -2.337
  114    HG3  GLN  16           1HG      GLN  16  15.905  -2.812  -3.714
  115   HE21  GLN  16          1HE2      GLN  16  16.745  -3.269  -5.744
  116   HE22  GLN  16          2HE2      GLN  16  18.371  -3.817  -5.967
  117    H    MET  17           H        MET  17  14.340   0.752  -4.173
  118    HA   MET  17           HA       MET  17  12.423  -1.261  -4.671
  119    HB2  MET  17           2HB      MET  17  12.367   1.626  -3.965
  120    HB3  MET  17           1HB      MET  17  10.908   0.959  -4.679
  121    HG2  MET  17           2HG      MET  17  12.287  -0.155  -2.248
  122    HG3  MET  17           1HG      MET  17  10.910   0.949  -2.208
  123    HE1  MET  17           3HE      MET  17  10.790  -1.754  -0.652
  124    HE2  MET  17           1HE      MET  17   9.189  -2.344  -1.107
  125    HE3  MET  17           2HE      MET  17   9.435  -0.631  -0.768
  126    H    LEU  18           H        LEU  18  13.404   1.619  -6.467
  127    HA   LEU  18           HA       LEU  18  11.585   1.402  -8.582
  128    HB2  LEU  18           2HB      LEU  18  13.434   3.214  -7.858
  129    HB3  LEU  18           1HB      LEU  18  14.297   2.436  -9.169
  130    HG   LEU  18           HG       LEU  18  12.384   2.935 -10.679
  131   HD11  LEU  18          1HD1      LEU  18  11.362   4.432  -8.273
  132   HD12  LEU  18          2HD1      LEU  18  10.586   3.084  -9.102
  133   HD13  LEU  18          3HD1      LEU  18  10.753   4.639  -9.914
  134   HD21  LEU  18          3HD2      LEU  18  14.358   4.395 -10.546
  135   HD22  LEU  18          1HD2      LEU  18  13.551   5.347  -9.300
  136   HD23  LEU  18          2HD2      LEU  18  12.886   5.289 -10.932
  137    H    SER  19           H        SER  19  14.850   0.069  -8.189
  138    HA   SER  19           HA       SER  19  14.890  -1.137 -10.782
  139    HB2  SER  19           2HB      SER  19  16.643  -1.278  -8.354
  140    HB3  SER  19           1HB      SER  19  16.861  -2.446  -9.655
  141    HG   SER  19           HG       SER  19  17.174   0.357  -9.717
  142    H    MET  20           H        MET  20  13.578  -2.038  -7.736
  143    HA   MET  20           HA       MET  20  13.564  -4.873  -8.226
  144    HB2  MET  20           2HB      MET  20  13.478  -3.625  -5.954
  145    HB3  MET  20           1HB      MET  20  11.759  -3.464  -6.287
  146    HG2  MET  20           2HG      MET  20  11.549  -5.891  -6.421
  147    HG3  MET  20           1HG      MET  20  13.275  -6.065  -6.119
  148    HE1  MET  20           3HE      MET  20  13.408  -3.538  -3.737
  149    HE2  MET  20           1HE      MET  20  14.408  -4.970  -3.999
  150    HE3  MET  20           2HE      MET  20  13.592  -4.734  -2.456
  151    H    GLY  21           H        GLY  21  11.828  -2.272  -9.389
  152    HA2  GLY  21           2HA      GLY  21  10.205  -2.416 -11.077
  153    HA3  GLY  21           1HA      GLY  21   9.842  -4.059 -10.558
  154    H    PHE  22           H        PHE  22  10.091  -1.902  -7.972
  155    HA   PHE  22           HA       PHE  22   7.172  -1.852  -7.753
  156    HB2  PHE  22           2HB      PHE  22   9.361  -1.797  -5.690
  157    HB3  PHE  22           1HB      PHE  22   7.745  -1.221  -5.304
  158    HD1  PHE  22           2HD      PHE  22   5.814  -2.774  -5.444
  159    HD2  PHE  22           1HD      PHE  22   9.839  -4.104  -5.814
  160    HE1  PHE  22           2HE      PHE  22   5.091  -5.080  -4.976
  161    HE2  PHE  22           1HE      PHE  22   9.126  -6.409  -5.343
  162    HZ   PHE  22           HZ       PHE  22   6.750  -6.899  -4.924
  163    H    SER  23           H        SER  23   6.174  -0.069  -8.115
  164    HA   SER  23           HA       SER  23   7.161   2.487  -7.222
  165    HB2  SER  23           2HB      SER  23   6.524   2.183 -10.162
  166    HB3  SER  23           1HB      SER  23   7.247   3.566  -9.345
  167    HG   SER  23           HG       SER  23   8.862   1.585  -8.852
  168    H    ASP  24           H        ASP  24   5.437   3.891  -6.872
  169    HA   ASP  24           HA       ASP  24   2.807   2.763  -7.519
  170    HB2  ASP  24           2HB      ASP  24   2.019   3.365  -5.475
  171    HB3  ASP  24           1HB      ASP  24   3.720   3.258  -5.051
  172    H    GLU  25           H        GLU  25   1.043   4.481  -7.777
  173    HA   GLU  25           HA       GLU  25   2.148   6.641  -9.458
  174    HB2  GLU  25           2HB      GLU  25  -0.523   6.126 -10.221
  175    HB3  GLU  25           1HB      GLU  25   0.945   5.837 -11.139
  176    HG2  GLU  25           2HG      GLU  25  -0.171   3.789 -11.113
  177    HG3  GLU  25           1HG      GLU  25   1.104   3.622  -9.913
  178    H    GLY  26           H        GLY  26   0.774   6.339  -6.535
  179    HA2  GLY  26           2HA      GLY  26  -0.847   8.786  -6.931
  180    HA3  GLY  26           1HA      GLY  26  -1.243   7.555  -5.740
  181    H    GLY  27           H        GLY  27   1.951   7.585  -5.622
  182    HA2  GLY  27           2HA      GLY  27   3.570   8.774  -4.447
  183    HA3  GLY  27           1HA      GLY  27   2.372  10.012  -4.078
  184    H    TRP  28           H        TRP  28   1.766   6.614  -3.583
  185    HA   TRP  28           HA       TRP  28   1.533   7.182  -0.724
  186    HB2  TRP  28           2HB      TRP  28   0.110   5.249  -0.546
  187    HB3  TRP  28           1HB      TRP  28  -0.455   6.275  -1.848
  188    HD1  TRP  28           HD       TRP  28  -0.527   5.250  -4.264
  189    HE1  TRP  28           1HE      TRP  28  -0.209   2.869  -5.181
  190    HE3  TRP  28           3HE      TRP  28   1.505   3.053  -0.124
  191    HZ2  TRP  28           2HZ      TRP  28   0.753   0.377  -4.260
  192    HZ3  TRP  28           3HZ      TRP  28   2.092   0.666  -0.220
  193    HH2  TRP  28           HH       TRP  28   1.724  -0.645  -2.246
  194    H    LEU  29           H        LEU  29   3.394   5.203  -2.936
  195    HA   LEU  29           HA       LEU  29   4.396   3.449  -0.901
  196    HB2  LEU  29           2HB      LEU  29   4.362   2.811  -3.280
  197    HB3  LEU  29           1HB      LEU  29   5.530   4.072  -3.633
  198    HG   LEU  29           HG       LEU  29   7.147   2.895  -2.119
  199   HD11  LEU  29          1HD1      LEU  29   5.591   1.638  -0.764
  200   HD12  LEU  29          2HD1      LEU  29   6.688   0.535  -1.593
  201   HD13  LEU  29          3HD1      LEU  29   5.038   0.742  -2.179
  202   HD21  LEU  29          3HD2      LEU  29   6.095   1.356  -4.490
  203   HD22  LEU  29          1HD2      LEU  29   7.665   1.107  -3.729
  204   HD23  LEU  29          2HD2      LEU  29   7.301   2.641  -4.522
  205    H    THR  30           H        THR  30   5.442   6.456  -2.388
  206    HA   THR  30           HA       THR  30   7.993   6.562  -1.169
  207    HB   THR  30           HB       THR  30   7.259   7.951  -3.139
  208    HG1  THR  30           1HG      THR  30   9.101   8.757  -2.414
  209   HG21  THR  30          3HG2      THR  30   5.897   9.599  -1.008
  210   HG22  THR  30          1HG2      THR  30   5.105   8.722  -2.315
  211   HG23  THR  30          2HG2      THR  30   6.147  10.098  -2.682
  212    H    ARG  31           H        ARG  31   4.826   7.056   0.005
  213    HA   ARG  31           HA       ARG  31   5.688   8.591   2.322
  214    HB2  ARG  31           2HB      ARG  31   2.980   7.620   1.403
  215    HB3  ARG  31           1HB      ARG  31   3.242   8.470   2.921
  216    HG2  ARG  31           2HG      ARG  31   4.424   9.881   0.691
  217    HG3  ARG  31           1HG      ARG  31   2.697   9.611   0.455
  218    HD2  ARG  31           2HD      ARG  31   3.811  10.712   3.022
  219    HD3  ARG  31           1HD      ARG  31   3.400  11.751   1.658
  220    HE   ARG  31           HE       ARG  31   1.527  10.174   3.278
  221   HH11  ARG  31          1HH1      ARG  31   2.103  12.526   0.748
  222   HH12  ARG  31          2HH1      ARG  31   0.456  13.064   0.700
  223   HH21  ARG  31          1HH2      ARG  31  -0.636  10.862   3.206
  224   HH22  ARG  31          2HH2      ARG  31  -1.112  12.118   2.109
  225    H    LEU  32           H        LEU  32   4.734   5.363   1.395
  226    HA   LEU  32           HA       LEU  32   4.364   4.295   3.979
  227    HB2  LEU  32           2HB      LEU  32   3.659   3.246   1.801
  228    HB3  LEU  32           1HB      LEU  32   5.337   2.814   1.534
  229    HG   LEU  32           HG       LEU  32   5.292   1.441   3.595
  230   HD11  LEU  32          1HD1      LEU  32   3.613   2.532   4.883
  231   HD12  LEU  32          2HD1      LEU  32   3.038   0.901   4.538
  232   HD13  LEU  32          3HD1      LEU  32   2.400   2.272   3.632
  233   HD21  LEU  32          3HD2      LEU  32   3.917  -0.364   2.700
  234   HD22  LEU  32          1HD2      LEU  32   4.852   0.415   1.422
  235   HD23  LEU  32          2HD2      LEU  32   3.132   0.769   1.598
  236    H    LEU  33           H        LEU  33   7.168   4.926   2.030
  237    HA   LEU  33           HA       LEU  33   9.026   3.376   3.525
  238    HB2  LEU  33           2HB      LEU  33   9.333   5.702   1.638
  239    HB3  LEU  33           1HB      LEU  33  10.706   4.923   2.402
  240    HG   LEU  33           HG       LEU  33   8.729   3.458   0.648
  241   HD11  LEU  33          1HD1      LEU  33  10.443   3.586  -1.104
  242   HD12  LEU  33          2HD1      LEU  33  11.403   4.652  -0.077
  243   HD13  LEU  33          3HD1      LEU  33   9.825   5.179  -0.666
  244   HD21  LEU  33          3HD2      LEU  33   9.978   2.055   2.216
  245   HD22  LEU  33          1HD2      LEU  33  11.495   2.734   1.626
  246   HD23  LEU  33          2HD2      LEU  33  10.487   1.759   0.555
  247    H    GLN  34           H        GLN  34   7.338   6.193   4.222
  248    HA   GLN  34           HA       GLN  34   9.383   7.236   6.035
  249    HB2  GLN  34           2HB      GLN  34   6.609   8.350   5.605
  250    HB3  GLN  34           1HB      GLN  34   8.012   9.170   6.271
  251    HG2  GLN  34           2HG      GLN  34   7.631   8.304   3.414
  252    HG3  GLN  34           1HG      GLN  34   7.572   9.951   4.035
  253   HE21  GLN  34          1HE2      GLN  34   9.301   8.633   2.014
  254   HE22  GLN  34          2HE2      GLN  34  10.927   8.949   2.533
  255    H    THR  35           H        THR  35   6.273   5.642   5.990
  256    HA   THR  35           HA       THR  35   5.864   5.827   8.827
  257    HB   THR  35           HB       THR  35   4.423   3.761   7.246
  258    HG1  THR  35           1HG      THR  35   4.245   6.562   6.758
  259   HG21  THR  35          3HG2      THR  35   2.513   4.616   8.494
  260   HG22  THR  35          1HG2      THR  35   3.495   5.936   9.133
  261   HG23  THR  35          2HG2      THR  35   3.850   4.271   9.590
  262    H    LYS  36           H        LYS  36   6.726   3.226   6.561
  263    HA   LYS  36           HA       LYS  36   7.303   1.413   8.772
  264    HB2  LYS  36           2HB      LYS  36   6.661   1.158   5.938
  265    HB3  LYS  36           1HB      LYS  36   8.007   0.131   6.412
  266    HG2  LYS  36           2HG      LYS  36   6.086  -1.193   6.669
  267    HG3  LYS  36           1HG      LYS  36   6.531  -0.692   8.301
  268    HD2  LYS  36           2HD      LYS  36   4.851   1.087   8.208
  269    HD3  LYS  36           1HD      LYS  36   4.405   0.576   6.576
  270    HE2  LYS  36           2HE      LYS  36   2.820  -0.338   8.150
  271    HE3  LYS  36           1HE      LYS  36   3.796  -1.645   7.488
  272    HZ1  LYS  36           3HZ      LYS  36   5.138  -1.627   9.492
  273    HZ2  LYS  36           1HZ      LYS  36   3.507  -1.863   9.882
  274    HZ3  LYS  36           2HZ      LYS  36   4.227  -0.351  10.127
  275    H    ASN  37           H        ASN  37   8.948   3.839   7.477
  276    HA   ASN  37           HA       ASN  37  11.141   4.459   7.480
  277    HB2  ASN  37           2HB      ASN  37  11.125   2.763   9.525
  278    HB3  ASN  37           1HB      ASN  37  12.055   1.764   8.415
  279   HD21  ASN  37          1HD2      ASN  37  12.939   2.854  10.894
  280   HD22  ASN  37          2HD2      ASN  37  14.271   3.903  10.549
  281    H    TYR  38           H        TYR  38  13.348   3.672   6.497
  282    HA   TYR  38           HA       TYR  38  12.701   2.690   3.859
  283    HB2  TYR  38           2HB      TYR  38  15.224   3.780   5.100
  284    HB3  TYR  38           1HB      TYR  38  15.182   3.142   3.458
  285    HD1  TYR  38           1HD      TYR  38  13.601   4.222   1.793
  286    HD2  TYR  38           2HD      TYR  38  14.538   5.998   5.543
  287    HE1  TYR  38           1HE      TYR  38  12.824   6.396   0.950
  288    HE2  TYR  38           2HE      TYR  38  13.761   8.180   4.714
  289    HH   TYR  38           HH       TYR  38  13.364   9.344   2.674
  290    H    ASP  39           H        ASP  39  12.207   0.713   5.599
  291    HA   ASP  39           HA       ASP  39  14.502  -1.113   5.543
  292    HB2  ASP  39           2HB      ASP  39  13.023  -0.718   7.641
  293    HB3  ASP  39           1HB      ASP  39  11.836  -1.717   6.811
  294    H    ILE  40           H        ILE  40  14.630  -1.996   3.583
  295    HA   ILE  40           HA       ILE  40  12.537  -2.438   1.787
  296    HB   ILE  40           HB       ILE  40  15.135  -3.976   1.913
  297   HG12  ILE  40          2HG1      ILE  40  14.642  -1.475   0.302
  298   HG13  ILE  40          1HG1      ILE  40  15.264  -1.404   1.948
  299   HG21  ILE  40          1HG2      ILE  40  13.573  -4.972   0.375
  300   HG22  ILE  40          2HG2      ILE  40  14.833  -4.138  -0.540
  301   HG23  ILE  40          3HG2      ILE  40  13.239  -3.401  -0.360
  302   HD11  ILE  40          3HD1      ILE  40  16.576  -2.921  -0.293
  303   HD12  ILE  40          1HD1      ILE  40  17.224  -2.632   1.320
  304   HD13  ILE  40          2HD1      ILE  40  17.013  -1.286   0.200
  305    H    GLY  41           H        GLY  41  13.985  -4.586   4.196
  306    HA2  GLY  41           2HA      GLY  41  12.657  -6.952   3.419
  307    HA3  GLY  41           1HA      GLY  41  13.335  -6.632   5.009
  308    H    ALA  42           H        ALA  42  11.838  -4.613   5.985
  309    HA   ALA  42           HA       ALA  42   9.472  -5.914   6.795
  310    HB1  ALA  42           1HB      ALA  42  10.619  -4.238   8.169
  311    HB2  ALA  42           2HB      ALA  42   8.915  -3.842   7.941
  312    HB3  ALA  42           3HB      ALA  42  10.149  -2.981   7.023
  313    H    ALA  43           H        ALA  43  10.047  -3.354   4.416
  314    HA   ALA  43           HA       ALA  43   7.402  -2.689   3.836
  315    HB1  ALA  43           1HB      ALA  43   9.729  -2.709   1.923
  316    HB2  ALA  43           2HB      ALA  43   9.359  -1.418   3.065
  317    HB3  ALA  43           3HB      ALA  43   8.238  -1.783   1.753
  318    H    LEU  44           H        LEU  44   9.481  -5.134   2.282
  319    HA   LEU  44           HA       LEU  44   7.595  -5.986   0.378
  320    HB2  LEU  44           2HB      LEU  44  10.184  -6.884   1.381
  321    HB3  LEU  44           1HB      LEU  44   9.149  -8.208   0.882
  322    HG   LEU  44           HG       LEU  44   8.897  -7.150  -1.340
  323   HD11  LEU  44          1HD1      LEU  44  10.392  -5.311  -1.968
  324   HD12  LEU  44          2HD1      LEU  44  10.923  -5.176  -0.291
  325   HD13  LEU  44          3HD1      LEU  44   9.248  -4.825  -0.719
  326   HD21  LEU  44          3HD2      LEU  44  10.614  -8.844  -0.952
  327   HD22  LEU  44          1HD2      LEU  44  11.756  -7.577  -0.500
  328   HD23  LEU  44          2HD2      LEU  44  11.129  -7.651  -2.146
  329    H    ASP  45           H        ASP  45   8.197  -6.988   3.686
  330    HA   ASP  45           HA       ASP  45   6.433  -9.252   3.585
  331    HB2  ASP  45           2HB      ASP  45   8.434  -8.971   5.121
  332    HB3  ASP  45           1HB      ASP  45   7.451  -7.854   6.057
  333    H    THR  46           H        THR  46   5.862  -5.964   3.712
  334    HA   THR  46           HA       THR  46   3.567  -6.043   5.463
  335    HB   THR  46           HB       THR  46   4.461  -3.833   3.600
  336    HG1  THR  46           1HG      THR  46   6.022  -4.442   5.234
  337   HG21  THR  46          3HG2      THR  46   3.131  -2.364   5.015
  338   HG22  THR  46          1HG2      THR  46   2.664  -3.729   6.033
  339   HG23  THR  46          2HG2      THR  46   2.107  -3.644   4.362
  340    H    ILE  47           H        ILE  47   4.135  -6.476   2.051
  341    HA   ILE  47           HA       ILE  47   1.220  -6.401   1.619
  342    HB   ILE  47           HB       ILE  47   1.733  -6.061  -0.799
  343   HG12  ILE  47          2HG1      ILE  47   4.523  -5.353   0.123
  344   HG13  ILE  47          1HG1      ILE  47   4.124  -6.928  -0.556
  345   HG21  ILE  47          1HG2      ILE  47   1.048  -4.196   0.554
  346   HG22  ILE  47          2HG2      ILE  47   2.328  -3.662  -0.536
  347   HG23  ILE  47          3HG2      ILE  47   2.689  -3.979   1.159
  348   HD11  ILE  47          3HD1      ILE  47   3.803  -4.274  -1.938
  349   HD12  ILE  47          1HD1      ILE  47   3.410  -5.850  -2.623
  350   HD13  ILE  47          2HD1      ILE  47   5.083  -5.453  -2.229
  351    H    GLN  48           H        GLN  48   3.167  -8.608   2.462
  352    HA   GLN  48           HA       GLN  48   3.227 -10.871   2.291
  353    HB2  GLN  48           2HB      GLN  48   0.722 -10.314   1.387
  354    HB3  GLN  48           1HB      GLN  48   1.404 -11.127  -0.011
  355    HG2  GLN  48           2HG      GLN  48   1.581 -12.307   2.737
  356    HG3  GLN  48           1HG      GLN  48   0.175 -12.549   1.700
  357   HE21  GLN  48          1HE2      GLN  48   2.273 -14.383   2.756
  358   HE22  GLN  48          2HE2      GLN  48   2.886 -15.201   1.363
  359    H    TYR  49           H        TYR  49   3.016  -9.401  -0.936
  360    HA   TYR  49           HA       TYR  49   4.519 -11.355  -2.285
  361    HB2  TYR  49           2HB      TYR  49   4.043  -8.435  -2.894
  362    HB3  TYR  49           1HB      TYR  49   4.856  -9.537  -3.998
  363    HD1  TYR  49           2HD      TYR  49   3.555 -11.595  -4.780
  364    HD2  TYR  49           1HD      TYR  49   1.708  -8.249  -2.903
  365    HE1  TYR  49           2HE      TYR  49   1.384 -12.275  -5.711
  366    HE2  TYR  49           1HE      TYR  49  -0.471  -8.923  -3.832
  367    HH   TYR  49           HH       TYR  49  -1.331 -10.249  -5.731
  368    H    SER  50           H        SER  50   6.446 -11.927  -1.441
  369    HA   SER  50           HA       SER  50   8.423  -9.789  -1.011
  370    HB2  SER  50           2HB      SER  50   8.658 -12.587   0.075
  371    HB3  SER  50           1HB      SER  50   9.466 -11.121   0.630
  372    HG   SER  50           HG       SER  50   6.710 -11.014   0.706
  373    H    LYS  51           H        LYS  51   7.908 -12.996  -2.404
  374    HA   LYS  51           HA       LYS  51  10.445 -12.748  -3.851
  375    HB2  LYS  51           2HB      LYS  51  10.165 -14.840  -2.628
  376    HB3  LYS  51           1HB      LYS  51   8.645 -15.147  -3.457
  377    HG2  LYS  51           2HG      LYS  51   9.701 -15.627  -5.480
  378    HG3  LYS  51           1HG      LYS  51  11.196 -14.827  -4.996
  379    HD2  LYS  51           2HD      LYS  51  11.504 -17.230  -4.974
  380    HD3  LYS  51           1HD      LYS  51  11.581 -16.600  -3.328
  381    HE2  LYS  51           2HE      LYS  51   9.498 -17.484  -2.766
  382    HE3  LYS  51           1HE      LYS  51   9.010 -17.649  -4.453
  383    HZ1  LYS  51           3HZ      LYS  51  11.167 -19.239  -3.183
  384    HZ2  LYS  51           1HZ      LYS  51  10.518 -19.460  -4.729
  385    HZ3  LYS  51           2HZ      LYS  51   9.573 -19.773  -3.363
  386    H    HIS  52           H        HIS  52   7.270 -14.183  -4.652
  387    HA   HIS  52           HA       HIS  52   6.739 -12.399  -6.793
  388    HB2  HIS  52           2HB      HIS  52   8.643 -13.939  -7.675
  389    HB3  HIS  52           1HB      HIS  52   7.398 -15.179  -7.737
  390    HD1  HIS  52           1HD      HIS  52   5.227 -14.479  -9.265
  391    HD2  HIS  52           2HD      HIS  52   8.749 -12.361  -9.876
  392    HE1  HIS  52           1HE      HIS  52   4.972 -13.374 -11.504
  393    HE2  HIS  52           2HE      HIS  52   7.027 -11.943 -11.750
  394    H1   GLY   1           1HT      GLY   1 -18.867  19.963   1.794
  395    H2   GLY   1           2HT      GLY   1 -17.268  19.420   1.680
  396    H3   GLY   1           3HT      GLY   1 -17.712  20.501   2.902
  397    HA2  GLY   1           1HA      GLY   1 -17.443  18.178   3.672
  398    HA3  GLY   1           2HA      GLY   1 -19.010  18.897   4.018
  399    H    SER   2           H        SER   2 -20.331  17.167   3.978
  400    HA   SER   2           HA       SER   2 -20.143  15.258   1.783
  401    HB2  SER   2           2HB      SER   2 -22.081  15.184   4.095
  402    HB3  SER   2           1HB      SER   2 -21.544  13.842   3.085
  403    HG   SER   2           HG       SER   2 -20.439  13.758   5.027
  404    HA   PRO   3           HA       PRO   3 -23.582  17.562  -0.023
  405    HB2  PRO   3           2HB      PRO   3 -23.001  17.094  -2.577
  406    HB3  PRO   3           1HB      PRO   3 -22.008  18.192  -1.609
  407    HG2  PRO   3           2HG      PRO   3 -21.463  15.385  -2.454
  408    HG3  PRO   3           1HG      PRO   3 -20.340  16.745  -2.280
  409    HD2  PRO   3           2HD      PRO   3 -20.783  14.694  -0.405
  410    HD3  PRO   3           1HD      PRO   3 -19.920  16.213  -0.114
  411    HA   PRO   4           HA       PRO   4 -26.353  14.076  -0.548
  412    HB2  PRO   4           2HB      PRO   4 -28.220  15.958  -1.809
  413    HB3  PRO   4           1HB      PRO   4 -28.389  15.057  -0.301
  414    HG2  PRO   4           2HG      PRO   4 -28.025  17.712  -0.309
  415    HG3  PRO   4           1HG      PRO   4 -27.333  16.677   0.950
  416    HD2  PRO   4           2HD      PRO   4 -25.997  17.867  -1.462
  417    HD3  PRO   4           1HD      PRO   4 -25.417  17.759   0.217
  418    H    GLU   5           H        GLU   5 -24.925  15.859  -2.988
  419    HA   GLU   5           HA       GLU   5 -26.302  14.765  -5.252
  420    HB2  GLU   5           2HB      GLU   5 -23.530  15.931  -5.319
  421    HB3  GLU   5           1HB      GLU   5 -24.751  15.939  -6.579
  422    HG2  GLU   5           2HG      GLU   5 -24.780  17.534  -4.033
  423    HG3  GLU   5           1HG      GLU   5 -24.527  18.145  -5.665
  424    H    ALA   6           H        ALA   6 -23.635  13.843  -3.248
  425    HA   ALA   6           HA       ALA   6 -22.643  11.853  -5.114
  426    HB1  ALA   6           1HB      ALA   6 -21.836  12.385  -2.255
  427    HB2  ALA   6           2HB      ALA   6 -21.083  13.106  -3.677
  428    HB3  ALA   6           3HB      ALA   6 -20.982  11.365  -3.415
  429    H    ASP   7           H        ASP   7 -22.853   9.633  -4.875
  430    HA   ASP   7           HA       ASP   7 -25.220   8.724  -3.586
  431    HB2  ASP   7           2HB      ASP   7 -24.103   7.744  -5.686
  432    HB3  ASP   7           1HB      ASP   7 -23.024   6.912  -4.569
  433    HA   PRO   8           HA       PRO   8 -23.636   8.120   0.488
  434    HB2  PRO   8           2HB      PRO   8 -25.501   6.263   1.297
  435    HB3  PRO   8           1HB      PRO   8 -25.764   8.009   1.291
  436    HG2  PRO   8           2HG      PRO   8 -26.595   5.959  -0.718
  437    HG3  PRO   8           1HG      PRO   8 -27.500   7.352  -0.097
  438    HD2  PRO   8           2HD      PRO   8 -26.315   7.412  -2.500
  439    HD3  PRO   8           1HD      PRO   8 -26.371   8.852  -1.460
  440    H    ARG   9           H        ARG   9 -24.106   5.523  -1.799
  441    HA   ARG   9           HA       ARG   9 -22.665   3.623  -0.135
  442    HB2  ARG   9           2HB      ARG   9 -23.888   3.427  -2.879
  443    HB3  ARG   9           1HB      ARG   9 -22.973   2.118  -2.146
  444    HG2  ARG   9           2HG      ARG   9 -24.591   1.654  -0.603
  445    HG3  ARG   9           1HG      ARG   9 -25.210   3.307  -0.603
  446    HD2  ARG   9           2HD      ARG   9 -25.537   1.324  -2.845
  447    HD3  ARG   9           1HD      ARG   9 -26.770   1.724  -1.654
  448    HE   ARG   9           HE       ARG   9 -25.713   3.967  -3.174
  449   HH11  ARG   9          1HH1      ARG   9 -28.224   1.545  -2.860
  450   HH12  ARG   9          2HH1      ARG   9 -29.345   2.390  -3.880
  451   HH21  ARG   9          1HH2      ARG   9 -27.176   5.093  -4.499
  452   HH22  ARG   9          2HH2      ARG   9 -28.759   4.427  -4.797
  453    H    LEU  10           H        LEU  10 -21.952   5.989  -2.460
  454    HA   LEU  10           HA       LEU  10 -19.604   4.759  -3.551
  455    HB2  LEU  10           2HB      LEU  10 -20.863   6.509  -4.751
  456    HB3  LEU  10           1HB      LEU  10 -20.441   7.664  -3.502
  457    HG   LEU  10           HG       LEU  10 -17.997   7.173  -4.127
  458   HD11  LEU  10          1HD1      LEU  10 -17.641   6.415  -6.421
  459   HD12  LEU  10          2HD1      LEU  10 -19.371   6.100  -6.588
  460   HD13  LEU  10          3HD1      LEU  10 -18.409   5.165  -5.441
  461   HD21  LEU  10          3HD2      LEU  10 -19.834   8.587  -6.056
  462   HD22  LEU  10          1HD2      LEU  10 -18.084   8.787  -5.983
  463   HD23  LEU  10          2HD2      LEU  10 -19.086   9.279  -4.618
  464    H    ILE  11           H        ILE  11 -20.360   6.811  -0.846
  465    HA   ILE  11           HA       ILE  11 -17.558   7.233  -0.200
  466    HB   ILE  11           HB       ILE  11 -19.356   9.009   0.089
  467   HG12  ILE  11          2HG1      ILE  11 -17.813   8.397   2.610
  468   HG13  ILE  11          1HG1      ILE  11 -17.059   9.028   1.149
  469   HG21  ILE  11          1HG2      ILE  11 -20.643   8.955   2.172
  470   HG22  ILE  11          2HG2      ILE  11 -20.049   7.328   2.492
  471   HG23  ILE  11          3HG2      ILE  11 -21.079   7.635   1.092
  472   HD11  ILE  11          3HD1      ILE  11 -18.492  11.008   1.285
  473   HD12  ILE  11          1HD1      ILE  11 -17.487  10.808   2.719
  474   HD13  ILE  11          2HD1      ILE  11 -19.197  10.381   2.775
  475    H    GLU  12           H        GLU  12 -19.861   4.886   0.279
  476    HA   GLU  12           HA       GLU  12 -19.371   4.106   2.954
  477    HB2  GLU  12           2HB      GLU  12 -20.724   2.923   0.598
  478    HB3  GLU  12           1HB      GLU  12 -20.197   1.803   1.850
  479    HG2  GLU  12           2HG      GLU  12 -21.823   4.241   2.483
  480    HG3  GLU  12           1HG      GLU  12 -22.569   2.719   1.999
  481    H    SER  13           H        SER  13 -17.644   3.614   0.007
  482    HA   SER  13           HA       SER  13 -16.249   1.273   0.612
  483    HB2  SER  13           2HB      SER  13 -14.992   3.550  -0.889
  484    HB3  SER  13           1HB      SER  13 -14.881   1.816  -1.203
  485    HG   SER  13           HG       SER  13 -16.499   2.062  -2.508
  486    H    LEU  14           H        LEU  14 -15.811   4.587   1.636
  487    HA   LEU  14           HA       LEU  14 -13.191   4.243   2.721
  488    HB2  LEU  14           2HB      LEU  14 -15.315   6.350   2.951
  489    HB3  LEU  14           1HB      LEU  14 -13.937   6.380   4.032
  490    HG   LEU  14           HG       LEU  14 -12.463   6.394   1.966
  491   HD11  LEU  14          1HD1      LEU  14 -13.487   7.205  -0.099
  492   HD12  LEU  14          2HD1      LEU  14 -15.085   7.046   0.629
  493   HD13  LEU  14          3HD1      LEU  14 -14.098   5.613   0.346
  494   HD21  LEU  14          3HD2      LEU  14 -14.327   8.710   2.445
  495   HD22  LEU  14          1HD2      LEU  14 -12.779   8.799   1.606
  496   HD23  LEU  14          2HD2      LEU  14 -12.832   8.373   3.316
  497    H    SER  15           H        SER  15 -16.467   4.319   4.094
  498    HA   SER  15           HA       SER  15 -15.668   3.859   6.768
  499    HB2  SER  15           2HB      SER  15 -18.285   2.821   6.369
  500    HB3  SER  15           1HB      SER  15 -17.830   4.375   7.067
  501    HG   SER  15           HG       SER  15 -19.086   3.938   4.788
  502    H    GLN  16           H        GLN  16 -16.549   1.728   4.097
  503    HA   GLN  16           HA       GLN  16 -16.755  -0.666   5.534
  504    HB2  GLN  16           2HB      GLN  16 -17.409  -0.247   3.121
  505    HB3  GLN  16           1HB      GLN  16 -15.707  -0.437   2.716
  506    HG2  GLN  16           2HG      GLN  16 -16.998  -2.488   2.346
  507    HG3  GLN  16           1HG      GLN  16 -15.721  -2.704   3.542
  508   HE21  GLN  16          1HE2      GLN  16 -16.690  -4.452   4.515
  509   HE22  GLN  16          2HE2      GLN  16 -18.125  -4.310   5.474
  510    H    MET  17           H        MET  17 -13.934   0.799   3.932
  511    HA   MET  17           HA       MET  17 -12.111  -1.255   4.535
  512    HB2  MET  17           2HB      MET  17 -11.663   1.699   4.083
  513    HB3  MET  17           1HB      MET  17 -10.365   0.530   4.244
  514    HG2  MET  17           2HG      MET  17 -12.468   0.584   2.100
  515    HG3  MET  17           1HG      MET  17 -10.765   1.005   1.919
  516    HE1  MET  17           3HE      MET  17  -8.833  -0.719   1.623
  517    HE2  MET  17           1HE      MET  17  -8.944  -2.390   2.181
  518    HE3  MET  17           2HE      MET  17  -9.097  -1.062   3.333
  519    H    LEU  18           H        LEU  18 -13.199   1.557   6.317
  520    HA   LEU  18           HA       LEU  18 -11.351   1.426   8.442
  521    HB2  LEU  18           2HB      LEU  18 -12.844   3.356   7.849
  522    HB3  LEU  18           1HB      LEU  18 -14.186   2.451   8.521
  523    HG   LEU  18           HG       LEU  18 -12.998   2.440  10.720
  524   HD11  LEU  18          1HD1      LEU  18 -11.150   4.331   9.283
  525   HD12  LEU  18          2HD1      LEU  18 -10.734   2.767   9.985
  526   HD13  LEU  18          3HD1      LEU  18 -11.208   4.104  11.030
  527   HD21  LEU  18          3HD2      LEU  18 -14.775   4.021  10.271
  528   HD22  LEU  18          1HD2      LEU  18 -13.628   5.124   9.508
  529   HD23  LEU  18          2HD2      LEU  18 -13.509   4.785  11.234
  530    H    SER  19           H        SER  19 -14.590   0.066   7.976
  531    HA   SER  19           HA       SER  19 -14.790  -1.171  10.516
  532    HB2  SER  19           2HB      SER  19 -16.178  -1.999   7.955
  533    HB3  SER  19           1HB      SER  19 -16.707  -2.334   9.606
  534    HG   SER  19           HG       SER  19 -17.313  -0.277   9.861
  535    H    MET  20           H        MET  20 -13.157  -2.027   7.604
  536    HA   MET  20           HA       MET  20 -12.923  -4.838   8.227
  537    HB2  MET  20           2HB      MET  20 -11.788  -3.049   6.093
  538    HB3  MET  20           1HB      MET  20 -11.181  -4.683   6.313
  539    HG2  MET  20           2HG      MET  20 -14.056  -3.978   5.786
  540    HG3  MET  20           1HG      MET  20 -12.904  -4.495   4.557
  541    HE1  MET  20           3HE      MET  20 -11.247  -6.808   5.750
  542    HE2  MET  20           1HE      MET  20 -12.084  -6.890   4.198
  543    HE3  MET  20           2HE      MET  20 -12.261  -8.199   5.367
  544    H    GLY  21           H        GLY  21 -11.547  -2.092   9.423
  545    HA2  GLY  21           2HA      GLY  21  -9.921  -1.926  11.065
  546    HA3  GLY  21           1HA      GLY  21  -9.498  -3.607  10.776
  547    H    PHE  22           H        PHE  22  -9.669  -1.283   8.183
  548    HA   PHE  22           HA       PHE  22  -6.731  -1.378   8.005
  549    HB2  PHE  22           2HB      PHE  22  -8.504  -2.318   6.135
  550    HB3  PHE  22           1HB      PHE  22  -8.201  -0.688   5.549
  551    HD1  PHE  22           1HD      PHE  22  -6.671  -3.929   6.335
  552    HD2  PHE  22           2HD      PHE  22  -6.096  -0.078   4.629
  553    HE1  PHE  22           1HE      PHE  22  -4.550  -4.688   5.349
  554    HE2  PHE  22           2HE      PHE  22  -3.974  -0.827   3.635
  555    HZ   PHE  22           HZ       PHE  22  -3.196  -3.135   3.993
  556    H    SER  23           H        SER  23  -5.763   0.477   8.288
  557    HA   SER  23           HA       SER  23  -7.060   2.954   7.456
  558    HB2  SER  23           2HB      SER  23  -6.054   3.868   9.737
  559    HB3  SER  23           1HB      SER  23  -7.656   3.134   9.680
  560    HG   SER  23           HG       SER  23  -5.243   2.101  10.688
  561    H    ASP  24           H        ASP  24  -5.527   4.740   7.275
  562    HA   ASP  24           HA       ASP  24  -2.784   3.755   6.915
  563    HB2  ASP  24           2HB      ASP  24  -2.597   5.437   5.062
  564    HB3  ASP  24           1HB      ASP  24  -3.673   4.090   4.734
  565    H    GLU  25           H        GLU  25  -1.428   4.605   8.262
  566    HA   GLU  25           HA       GLU  25  -2.011   6.951   9.789
  567    HB2  GLU  25           2HB      GLU  25   0.690   5.640   9.568
  568    HB3  GLU  25           1HB      GLU  25   0.025   6.533  10.927
  569    HG2  GLU  25           2HG      GLU  25  -0.279   4.465  11.753
  570    HG3  GLU  25           1HG      GLU  25  -1.761   4.548  10.805
  571    H    GLY  26           H        GLY  26   0.212   6.187   7.149
  572    HA2  GLY  26           2HA      GLY  26   1.110   8.958   7.026
  573    HA3  GLY  26           1HA      GLY  26   1.726   7.620   6.064
  574    H    GLY  27           H        GLY  27  -1.628   7.631   6.093
  575    HA2  GLY  27           2HA      GLY  27  -3.228   8.207   4.562
  576    HA3  GLY  27           1HA      GLY  27  -2.220   9.589   4.152
  577    H    TRP  28           H        TRP  28  -1.635   6.087   3.824
  578    HA   TRP  28           HA       TRP  28  -0.923   6.573   1.039
  579    HB2  TRP  28           2HB      TRP  28   0.187   4.417   1.085
  580    HB3  TRP  28           1HB      TRP  28   0.709   5.383   2.455
  581    HD1  TRP  28           HD       TRP  28  -0.186   4.586   4.905
  582    HE1  TRP  28           1HE      TRP  28  -0.872   2.251   5.749
  583    HE3  TRP  28           3HE      TRP  28  -0.903   2.277   0.404
  584    HZ2  TRP  28           2HZ      TRP  28  -1.610  -0.244   4.641
  585    HZ3  TRP  28           3HZ      TRP  28  -1.590  -0.082   0.383
  586    HH2  TRP  28           HH       TRP  28  -1.937  -1.314   2.456
  587    H    LEU  29           H        LEU  29  -3.403   5.101   2.935
  588    HA   LEU  29           HA       LEU  29  -4.369   3.376   0.835
  589    HB2  LEU  29           2HB      LEU  29  -4.641   2.804   3.220
  590    HB3  LEU  29           1HB      LEU  29  -5.679   4.200   3.426
  591    HG   LEU  29           HG       LEU  29  -7.241   3.159   1.727
  592   HD11  LEU  29          1HD1      LEU  29  -5.733   1.622   0.661
  593   HD12  LEU  29          2HD1      LEU  29  -7.031   0.713   1.435
  594   HD13  LEU  29          3HD1      LEU  29  -5.439   0.791   2.187
  595   HD21  LEU  29          3HD2      LEU  29  -6.674   1.873   4.381
  596   HD22  LEU  29          1HD2      LEU  29  -8.064   1.427   3.388
  597   HD23  LEU  29          2HD2      LEU  29  -7.896   3.080   3.981
  598    H    THR  30           H        THR  30  -5.237   6.502   2.238
  599    HA   THR  30           HA       THR  30  -7.622   6.923   0.841
  600    HB   THR  30           HB       THR  30  -6.958   8.365   2.696
  601    HG1  THR  30           1HG      THR  30  -7.897  10.107   1.845
  602   HG21  THR  30          3HG2      THR  30  -4.903   9.591   0.865
  603   HG22  THR  30          1HG2      THR  30  -4.517   8.420   2.125
  604   HG23  THR  30          2HG2      THR  30  -5.205   9.986   2.555
  605    H    ARG  31           H        ARG  31  -4.325   7.074  -0.221
  606    HA   ARG  31           HA       ARG  31  -4.988   8.450  -2.698
  607    HB2  ARG  31           2HB      ARG  31  -2.342   7.141  -2.094
  608    HB3  ARG  31           1HB      ARG  31  -2.673   8.532  -3.116
  609    HG2  ARG  31           2HG      ARG  31  -3.488   9.070  -0.419
  610    HG3  ARG  31           1HG      ARG  31  -1.811   8.534  -0.460
  611    HD2  ARG  31           2HD      ARG  31  -2.621  10.518  -2.491
  612    HD3  ARG  31           1HD      ARG  31  -2.549  11.082  -0.825
  613    HE   ARG  31           HE       ARG  31  -0.205   9.668  -1.384
  614   HH11  ARG  31          1HH1      ARG  31  -1.792  12.645  -2.337
  615   HH12  ARG  31          2HH1      ARG  31  -0.301  13.473  -2.673
  616   HH21  ARG  31          1HH2      ARG  31   1.749  10.760  -1.824
  617   HH22  ARG  31          2HH2      ARG  31   1.704  12.407  -2.369
  618    H    LEU  32           H        LEU  32  -4.376   5.252  -1.483
  619    HA   LEU  32           HA       LEU  32  -3.957   3.888  -3.907
  620    HB2  LEU  32           2HB      LEU  32  -3.503   3.015  -1.601
  621    HB3  LEU  32           1HB      LEU  32  -5.229   2.820  -1.387
  622    HG   LEU  32           HG       LEU  32  -4.158   1.480  -3.766
  623   HD11  LEU  32          1HD1      LEU  32  -2.268   1.120  -2.299
  624   HD12  LEU  32          2HD1      LEU  32  -3.187  -0.377  -2.467
  625   HD13  LEU  32          3HD1      LEU  32  -3.341   0.595  -1.002
  626   HD21  LEU  32          3HD2      LEU  32  -5.583  -0.323  -2.962
  627   HD22  LEU  32          1HD2      LEU  32  -6.460   1.211  -2.972
  628   HD23  LEU  32          2HD2      LEU  32  -5.853   0.551  -1.453
  629    H    LEU  33           H        LEU  33  -6.869   4.628  -2.061
  630    HA   LEU  33           HA       LEU  33  -8.660   3.212  -3.753
  631    HB2  LEU  33           2HB      LEU  33  -9.145   5.455  -1.799
  632    HB3  LEU  33           1HB      LEU  33 -10.417   4.536  -2.581
  633    HG   LEU  33           HG       LEU  33  -8.330   3.240  -0.838
  634   HD11  LEU  33          1HD1      LEU  33 -10.001   3.283   0.957
  635   HD12  LEU  33          2HD1      LEU  33 -11.045   4.291  -0.047
  636   HD13  LEU  33          3HD1      LEU  33  -9.485   4.907   0.500
  637   HD21  LEU  33          3HD2      LEU  33  -9.604   1.820  -2.424
  638   HD22  LEU  33          1HD2      LEU  33 -11.096   2.351  -1.645
  639   HD23  LEU  33          2HD2      LEU  33  -9.905   1.424  -0.731
  640    H    GLN  34           H        GLN  34  -7.047   6.181  -4.113
  641    HA   GLN  34           HA       GLN  34  -9.051   7.255  -5.933
  642    HB2  GLN  34           2HB      GLN  34  -6.424   8.371  -4.950
  643    HB3  GLN  34           1HB      GLN  34  -7.460   9.187  -6.110
  644    HG2  GLN  34           2HG      GLN  34  -8.110   8.516  -3.255
  645    HG3  GLN  34           1HG      GLN  34  -7.850  10.116  -3.947
  646   HE21  GLN  34          1HE2      GLN  34 -10.169   8.918  -2.541
  647   HE22  GLN  34          2HE2      GLN  34 -11.519   9.129  -3.612
  648    H    THR  35           H        THR  35  -6.183   5.409  -5.998
  649    HA   THR  35           HA       THR  35  -5.691   6.034  -8.809
  650    HB   THR  35           HB       THR  35  -3.713   4.364  -8.347
  651    HG1  THR  35           1HG      THR  35  -4.119   5.395  -5.723
  652   HG21  THR  35          3HG2      THR  35  -3.768   7.153  -7.184
  653   HG22  THR  35          1HG2      THR  35  -3.484   6.754  -8.877
  654   HG23  THR  35          2HG2      THR  35  -2.325   6.247  -7.646
  655    H    LYS  36           H        LYS  36  -6.579   3.331  -6.698
  656    HA   LYS  36           HA       LYS  36  -6.972   1.676  -9.099
  657    HB2  LYS  36           2HB      LYS  36  -6.676   0.903  -6.196
  658    HB3  LYS  36           1HB      LYS  36  -7.098  -0.232  -7.472
  659    HG2  LYS  36           2HG      LYS  36  -4.968  -0.499  -7.993
  660    HG3  LYS  36           1HG      LYS  36  -4.778   1.237  -8.251
  661    HD2  LYS  36           2HD      LYS  36  -4.664   1.327  -5.650
  662    HD3  LYS  36           1HD      LYS  36  -4.274  -0.389  -5.789
  663    HE2  LYS  36           2HE      LYS  36  -2.234   0.895  -5.699
  664    HE3  LYS  36           1HE      LYS  36  -2.413   0.204  -7.311
  665    HZ1  LYS  36           3HZ      LYS  36  -3.189   2.317  -8.125
  666    HZ2  LYS  36           1HZ      LYS  36  -1.697   2.543  -7.356
  667    HZ3  LYS  36           2HZ      LYS  36  -3.136   2.994  -6.577
  668    H    ASN  37           H        ASN  37  -8.693   3.796  -7.620
  669    HA   ASN  37           HA       ASN  37 -10.905   4.262  -7.506
  670    HB2  ASN  37           2HB      ASN  37 -10.842   2.467  -9.520
  671    HB3  ASN  37           1HB      ASN  37 -11.849   1.591  -8.373
  672   HD21  ASN  37          1HD2      ASN  37 -12.453   2.837 -10.976
  673   HD22  ASN  37          2HD2      ASN  37 -13.776   3.912 -10.672
  674    H    TYR  38           H        TYR  38 -13.049   3.294  -6.543
  675    HA   TYR  38           HA       TYR  38 -12.352   2.445  -3.857
  676    HB2  TYR  38           2HB      TYR  38 -15.080   3.087  -4.998
  677    HB3  TYR  38           1HB      TYR  38 -14.651   2.972  -3.298
  678    HD1  TYR  38           1HD      TYR  38 -12.990   4.683  -2.376
  679    HD2  TYR  38           2HD      TYR  38 -14.938   5.132  -6.133
  680    HE1  TYR  38           1HE      TYR  38 -12.518   7.097  -2.330
  681    HE2  TYR  38           2HE      TYR  38 -14.469   7.543  -6.093
  682    HH   TYR  38           HH       TYR  38 -13.880   9.278  -4.705
  683    H    ASP  39           H        ASP  39 -11.826   0.387  -5.604
  684    HA   ASP  39           HA       ASP  39 -14.104  -1.448  -5.345
  685    HB2  ASP  39           2HB      ASP  39 -12.957  -1.202  -7.585
  686    HB3  ASP  39           1HB      ASP  39 -11.532  -1.942  -6.859
  687    H    ILE  40           H        ILE  40 -14.137  -2.506  -3.496
  688    HA   ILE  40           HA       ILE  40 -11.927  -2.848  -1.774
  689    HB   ILE  40           HB       ILE  40 -14.462  -4.484  -1.720
  690   HG12  ILE  40          2HG1      ILE  40 -14.042  -1.832  -0.337
  691   HG13  ILE  40          1HG1      ILE  40 -14.838  -1.967  -1.902
  692   HG21  ILE  40          1HG2      ILE  40 -12.738  -5.261  -0.215
  693   HG22  ILE  40          2HG2      ILE  40 -14.046  -4.516   0.704
  694   HG23  ILE  40          3HG2      ILE  40 -12.540  -3.634   0.442
  695   HD11  ILE  40          3HD1      ILE  40 -15.757  -3.292   0.640
  696   HD12  ILE  40          1HD1      ILE  40 -16.567  -3.356  -0.925
  697   HD13  ILE  40          2HD1      ILE  40 -16.436  -1.825  -0.063
  698    H    GLY  41           H        GLY  41 -13.474  -4.992  -4.115
  699    HA2  GLY  41           2HA      GLY  41 -12.212  -7.392  -3.449
  700    HA3  GLY  41           1HA      GLY  41 -12.790  -6.969  -5.053
  701    H    ALA  42           H        ALA  42 -11.221  -4.979  -5.862
  702    HA   ALA  42           HA       ALA  42  -8.817  -6.285  -6.565
  703    HB1  ALA  42           1HB      ALA  42  -8.238  -4.240  -7.707
  704    HB2  ALA  42           2HB      ALA  42  -9.465  -3.351  -6.805
  705    HB3  ALA  42           3HB      ALA  42  -9.946  -4.593  -7.961
  706    H    ALA  43           H        ALA  43  -9.572  -3.801  -4.182
  707    HA   ALA  43           HA       ALA  43  -7.011  -3.008  -3.457
  708    HB1  ALA  43           1HB      ALA  43  -9.458  -3.234  -1.710
  709    HB2  ALA  43           2HB      ALA  43  -8.990  -1.843  -2.691
  710    HB3  ALA  43           3HB      ALA  43  -7.998  -2.325  -1.315
  711    H    LEU  44           H        LEU  44  -8.976  -5.597  -1.998
  712    HA   LEU  44           HA       LEU  44  -7.037  -6.411  -0.118
  713    HB2  LEU  44           2HB      LEU  44  -9.563  -7.504  -1.204
  714    HB3  LEU  44           1HB      LEU  44  -8.468  -8.675  -0.493
  715    HG   LEU  44           HG       LEU  44  -8.490  -7.426   1.622
  716   HD11  LEU  44          1HD1      LEU  44 -10.091  -5.610   1.967
  717   HD12  LEU  44          2HD1      LEU  44 -10.499  -5.642   0.251
  718   HD13  LEU  44          3HD1      LEU  44  -8.874  -5.182   0.764
  719   HD21  LEU  44          3HD2      LEU  44 -10.758  -7.965   2.290
  720   HD22  LEU  44          1HD2      LEU  44 -10.118  -9.219   1.230
  721   HD23  LEU  44          2HD2      LEU  44 -11.261  -8.034   0.601
  722    H    ASP  45           H        ASP  45  -7.817  -7.619  -3.352
  723    HA   ASP  45           HA       ASP  45  -6.046  -9.791  -3.410
  724    HB2  ASP  45           2HB      ASP  45  -7.736  -9.658  -5.087
  725    HB3  ASP  45           1HB      ASP  45  -7.201  -8.063  -5.601
  726    H    THR  46           H        THR  46  -5.529  -6.405  -4.131
  727    HA   THR  46           HA       THR  46  -3.051  -6.612  -5.407
  728    HB   THR  46           HB       THR  46  -4.073  -4.334  -3.699
  729    HG1  THR  46           1HG      THR  46  -5.527  -4.689  -5.348
  730   HG21  THR  46          3HG2      THR  46  -2.587  -2.926  -5.020
  731   HG22  THR  46          1HG2      THR  46  -2.014  -4.335  -5.912
  732   HG23  THR  46          2HG2      THR  46  -1.661  -4.176  -4.191
  733    H    ILE  47           H        ILE  47  -3.862  -6.605  -1.969
  734    HA   ILE  47           HA       ILE  47  -0.989  -6.641  -1.343
  735    HB   ILE  47           HB       ILE  47  -1.663  -6.215   1.005
  736   HG12  ILE  47          2HG1      ILE  47  -4.417  -5.680  -0.113
  737   HG13  ILE  47          1HG1      ILE  47  -3.990  -7.184   0.692
  738   HG21  ILE  47          1HG2      ILE  47  -2.706  -4.194  -0.977
  739   HG22  ILE  47          2HG2      ILE  47  -1.018  -4.390  -0.508
  740   HG23  ILE  47          3HG2      ILE  47  -2.208  -3.871   0.684
  741   HD11  ILE  47          3HD1      ILE  47  -3.891  -4.440   1.912
  742   HD12  ILE  47          1HD1      ILE  47  -3.468  -5.949   2.723
  743   HD13  ILE  47          2HD1      ILE  47  -5.127  -5.667   2.196
  744    H    GLN  48           H        GLN  48  -3.220  -8.827  -2.032
  745    HA   GLN  48           HA       GLN  48  -3.360 -11.073  -1.776
  746    HB2  GLN  48           2HB      GLN  48  -0.769 -10.507  -0.540
  747    HB3  GLN  48           1HB      GLN  48  -1.552 -11.953   0.082
  748    HG2  GLN  48           2HG      GLN  48  -0.844 -11.351  -2.774
  749    HG3  GLN  48           1HG      GLN  48  -0.118 -12.561  -1.720
  750   HE21  GLN  48          1HE2      GLN  48  -1.491 -12.788  -4.332
  751   HE22  GLN  48          2HE2      GLN  48  -2.744 -13.958  -4.080
  752    H    TYR  49           H        TYR  49  -2.875  -9.321   1.250
  753    HA   TYR  49           HA       TYR  49  -4.135 -11.190   2.936
  754    HB2  TYR  49           2HB      TYR  49  -3.561  -8.247   3.171
  755    HB3  TYR  49           1HB      TYR  49  -4.451  -9.101   4.427
  756    HD1  TYR  49           2HD      TYR  49  -3.349 -10.841   5.763
  757    HD2  TYR  49           1HD      TYR  49  -1.184  -8.570   2.888
  758    HE1  TYR  49           2HE      TYR  49  -1.239 -11.572   6.779
  759    HE2  TYR  49           1HE      TYR  49   0.936  -9.294   3.904
  760    HH   TYR  49           HH       TYR  49   1.681 -10.126   6.239
  761    H    SER  50           H        SER  50  -5.999 -11.827   1.747
  762    HA   SER  50           HA       SER  50  -8.196  -9.869   1.802
  763    HB2  SER  50           2HB      SER  50  -8.174 -12.447   0.233
  764    HB3  SER  50           1HB      SER  50  -9.203 -11.035  -0.006
  765    HG   SER  50           HG       SER  50  -6.443 -10.663  -0.197
  766    H    LYS  51           H        LYS  51  -7.040 -12.879   3.019
  767    HA   LYS  51           HA       LYS  51  -9.591 -13.289   4.433
  768    HB2  LYS  51           2HB      LYS  51  -7.624 -15.414   3.556
  769    HB3  LYS  51           1HB      LYS  51  -9.095 -15.697   4.472
  770    HG2  LYS  51           2HG      LYS  51 -10.421 -14.883   2.577
  771    HG3  LYS  51           1HG      LYS  51  -8.934 -14.631   1.660
  772    HD2  LYS  51           2HD      LYS  51  -9.681 -16.704   0.915
  773    HD3  LYS  51           1HD      LYS  51  -8.482 -17.122   2.139
  774    HE2  LYS  51           2HE      LYS  51 -10.418 -18.513   2.445
  775    HE3  LYS  51           1HE      LYS  51 -10.324 -17.371   3.784
  776    HZ1  LYS  51           3HZ      LYS  51 -12.070 -17.068   1.400
  777    HZ2  LYS  51           1HZ      LYS  51 -12.007 -16.020   2.727
  778    HZ3  LYS  51           2HZ      LYS  51 -12.580 -17.596   2.923
  779    H    HIS  52           H        HIS  52  -6.180 -14.321   4.651
  780    HA   HIS  52           HA       HIS  52  -5.852 -13.097   7.223
  781    HB2  HIS  52           2HB      HIS  52  -7.034 -15.508   7.426
  782    HB3  HIS  52           1HB      HIS  52  -5.353 -16.026   7.343
  783    HD1  HIS  52           1HD      HIS  52  -3.950 -13.982   9.057
  784    HD2  HIS  52           2HD      HIS  52  -7.648 -15.597  10.053
  785    HE1  HIS  52           1HE      HIS  52  -4.170 -13.690  11.546
  786    HE2  HIS  52           2HE      HIS  52  -6.478 -14.538  12.093